Model name? Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 Stoichiometric species (literal list of strings)? ['O', 'Si'] Prototype label? A2B_hP36_163_g3h_i Temperature (K)? No temperature given Cauchy stress (literal list of floats, Voigt order xx,yy,zz,yz,xz,xy, eV/A^3)? No stress given Query result (literal list of dicts)? [{'instance-id': 2, 'a.si-value': 1.09403e-09, 'parameter-names.source-value': ['c/a', 'x2', 'x3', 'x4', 'x5', 'y5', 'z5'], 'parameter-values.source-value': [0.46081003, 0.39424677, 0.60573013, 0.21151548, 0.34234975, 0.84891908, 0.49374979], 'meta.uuid': 'TE_573872672238_002-and-MO_501246546792_000-1711749680-tr'}] Runtime arguments (literal dictonary)? {} ==== Building ASE atoms object with: ==== representative atom symbols = ['O', 'O', 'O', 'O', 'Si'] representative atom coordinates = [[0.5 0. 0. ] [0.39424677 0.60575323 0.25 ] [0.60573013 0.39426987 0.25 ] [0.21151548 0.78848452 0.25 ] [0.34234975 0.84891908 0.49374979]] spacegroup = 163 cell = [[10.9403, 0, 0], [-5.47015, 9.4745777250229, 0], [0, 0, 5.0414]] ========================================= E L A S T I C C O N S T A N T C A L C U L A T I O N S Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 11 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 11 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 33 steps. Minimization converged after 40 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 11 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 10 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 32 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 8 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 10 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 36 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 32 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 12 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 8 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 28 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 8 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 8 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 34 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 38 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 8 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 34 steps. Minimization converged after 28 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 32 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 5 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 6 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 6 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 22 steps. Minimization converged after 14 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 18 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 22 steps. Minimization converged after 14 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 18 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 18 steps. Minimization converged after 23 steps. Minimization converged after 18 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 5 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 27 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 14 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 20 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 5 steps. Minimization converged after 17 steps. Minimization converged after 19 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 20 steps. Minimization converged after 14 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 16 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 18 steps. Minimization converged after 21 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 15 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 22 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.73007 0.41797 0.07813 -0. -0.07959 0.00001] [ 0.41797 0.72925 0.07814 -0. 0.07959 0. ] [ 0.07813 0.07814 1.139 0. -0. 0. ] [-0. -0. 0. 0.12318 -0. 0.07961] [-0.07959 0.07959 -0. -0. 0.1232 0.00002] [ 0.00001 0. 0. 0.07961 0.00002 0.15564]] 95%% Error estimate [ASE units]: [[0.00011 0.00028 0.00004 0.00002 0.00003 0.00007] [0.00028 0.00025 0.00008 0.00009 0.00019 0. ] [0.00004 0.00008 0.00002 0.00004 0.00004 0.00003] [0.00002 0.00009 0.00004 0.00001 0.00001 0.00011] [0.00003 0.00019 0.00004 0.00001 0.00011 0.00005] [0.00007 0. 0.00003 0.00011 0.00005 0.00002]] Maximum deviation from material symmetry [ASE units]: 0.079610 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.139004 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 17 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 15 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 53 steps. Minimization converged after 54 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 1.06428898e-03 -1.07241332e-03 -1.46662443e-04] [ 2.29850102e-03 -4.40274011e-03 6.15828509e-04] [-8.53364688e-04 -1.94356247e-03 -2.37294706e-04] [-2.95553615e-04 -1.82337556e-03 3.32183088e-04] [-1.29123887e-03 -1.24203256e-03 9.08820407e-05] [-2.74909431e-03 -3.66733908e-03 -7.14322906e-04] [ 7.18650345e-03 1.68276776e-02 -2.69138249e-04] [ 5.98126773e-03 -4.17685447e-03 4.52089937e-04] [ 3.64217227e-03 -4.62504226e-03 1.21735156e-03] [ 4.78775703e-03 1.42106758e-02 -8.93872551e-04] [ 6.77423992e-03 -2.38820436e-03 8.04279345e-04] [ 3.96396760e-03 -5.15349896e-03 -8.57245927e-04] [-6.42302604e-03 1.97917733e-03 1.42198483e-03] [ 4.81295761e-04 2.03132775e-03 -9.29944396e-04] [ 7.75207031e-03 1.65397178e-03 -1.05325520e-03] [ 3.13181078e-03 7.61260392e-04 2.84017721e-03] [ 5.97788028e-04 -1.54172073e-03 2.23043540e-04] [-5.51033109e-03 -7.69174215e-04 -2.50167232e-03] [-2.46496547e-03 4.54021991e-03 5.55419146e-03] [-6.58693428e-03 -3.58934515e-04 -2.67220196e-04] [-5.89145241e-03 -2.99826930e-03 -4.40621808e-03] [-7.80973462e-03 7.62689899e-03 -6.43727283e-04] [-3.82285733e-03 -4.84957273e-03 -5.26644866e-04] [-3.97896752e-03 -3.14931995e-03 4.27303547e-04] [-3.99350236e-04 2.60842622e-03 1.47321620e-03] [ 4.20041553e-04 -8.98414603e-04 -1.67186769e-03] [ 1.72009874e-03 6.09132490e-04 2.65923782e-04] [ 4.46338066e-04 9.16659282e-04 -2.48974836e-03] [ 9.74886258e-04 1.61064065e-03 -1.91016652e-03] [ 1.46106573e-03 -2.75704161e-03 1.53894491e-03] [-2.20169023e-03 -4.27190598e-03 5.89851073e-04] [-1.11006500e-03 -2.20578118e-04 -1.16549969e-03] [ 1.42297331e-03 -1.38683431e-03 -3.92602095e-05] [-3.18301129e-03 -1.26887718e-03 4.31936411e-03] [ 1.49697658e-03 -2.10448237e-03 -1.78238874e-03] [-1.03240612e-03 1.69412060e-03 3.39535211e-04]] Final stress: [5.22003589e-05 3.16770232e-05 1.10828734e-03 1.57624929e-04 1.57974401e-05 2.79950755e-04] Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 51 steps. Minimization converged after 54 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 54 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 6.27104170e-04 -4.51910225e-03 4.30100498e-04] [-1.34458611e-02 2.87593681e-03 -2.17365918e-03] [ 2.86788042e-05 2.11988955e-03 6.20648980e-05] [ 4.01531805e-03 6.44387689e-03 -8.93009278e-04] [-1.68544750e-04 -4.99126809e-03 -4.75816708e-04] [ 1.39102781e-02 -2.06856498e-03 1.88475956e-03] [-7.00745736e-03 3.08317175e-03 5.74498414e-03] [ 7.49177869e-03 -3.74673094e-03 -7.77733943e-03] [-8.17429382e-03 -8.19682439e-03 6.44227591e-03] [-9.64026211e-03 5.72894501e-03 -4.13657812e-03] [ 8.26525610e-03 1.45876502e-03 -3.57401699e-04] [-3.50062667e-03 -7.08218554e-03 7.26678183e-04] [-1.50755259e-02 2.02434352e-02 5.46379154e-04] [ 1.48290838e-02 -1.82965724e-02 3.30589519e-04] [ 3.79240616e-03 -6.23801987e-03 -3.68778633e-03] [ 2.84709064e-02 -2.86157961e-02 7.80649968e-03] [-1.59367311e-02 3.38951769e-02 3.50026524e-04] [-1.61103972e-02 -1.82770387e-03 -4.75298677e-03] [ 1.73453154e-02 8.36763002e-04 1.13044622e-02] [ 7.37561625e-03 1.40623635e-02 1.23906066e-03] [-1.44746797e-02 -1.31758851e-03 -1.23201555e-02] [ 1.43818331e-02 3.48314118e-03 -1.63149882e-03] [ 6.42580905e-03 1.94258369e-02 -2.25090582e-04] [-1.59838996e-02 -4.13884744e-03 1.40202439e-03] [-1.76958752e-04 7.64697691e-04 3.27919132e-03] [ 3.54017327e-04 -6.33868128e-03 1.27975273e-03] [-5.57997264e-03 9.35587428e-04 -5.95754994e-03] [ 2.55886913e-03 -1.68344568e-03 -2.16693527e-03] [ 2.32618646e-03 9.30700045e-04 -1.58844770e-03] [-2.27378274e-03 -2.90985033e-03 -2.32467615e-03] [-7.33917038e-03 -2.37636447e-03 8.77306228e-03] [-2.25649730e-03 3.98456976e-03 -5.50852301e-03] [ 5.12061963e-03 -2.36307402e-03 -2.24316822e-04] [-5.33586156e-03 -3.49170539e-03 -3.13222723e-04] [ 2.08645521e-03 -8.24932826e-03 4.28236556e-04] [ 3.07499087e-03 -1.82120289e-03 4.48484588e-03]] Final stress: [-7.50091204e-05 -2.30105942e-04 -5.51566368e-06 1.17397355e-04 9.35291687e-05 -5.08671640e-05] Minimization converged after 53 steps. Minimization converged after 49 steps. Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-1.33954351e-03 1.11628034e-03 3.49588552e-04] [-2.91628006e-03 3.06911742e-03 -7.42180775e-04] [ 6.91046549e-04 1.35267700e-03 5.66553754e-05] [ 4.64336150e-04 1.48800809e-03 -1.35993958e-04] [ 1.62696169e-03 1.38929610e-03 -2.91495255e-04] [ 3.66257131e-03 2.57475695e-03 8.32504540e-04] [ 1.35861873e-03 -2.16703645e-03 -9.48995360e-04] [ 4.44572665e-03 4.00222601e-03 5.99190122e-04] [ 5.79895866e-04 -1.77041120e-03 1.73012849e-04] [-1.61341184e-04 -5.49588949e-03 2.30804545e-03] [ 1.45521016e-03 5.64916761e-04 -1.59931655e-03] [-3.30539254e-04 -1.21694171e-03 -6.26793566e-04] [ 3.14701025e-03 -2.11890621e-03 -4.14732225e-03] [-1.19236360e-03 1.17576485e-03 2.34880994e-03] [ 8.47696777e-04 2.86181309e-04 -3.32020185e-04] [-2.99029101e-03 -3.26158609e-04 1.25765468e-03] [-1.75225662e-04 -1.10263400e-03 -1.73695649e-03] [-6.92885086e-05 -6.00347914e-04 2.58524969e-03] [-1.00314713e-03 2.85864071e-03 -1.65401425e-03] [ 2.78887142e-03 -1.88515002e-03 -1.51405510e-03] [-3.03655240e-03 1.30599426e-03 -1.05636057e-04] [-7.74257810e-04 8.23509359e-04 -2.97637079e-03] [-1.39471568e-03 -2.19571365e-03 2.42917068e-03] [-5.76302369e-03 1.20560059e-05 3.74009231e-03] [-8.06281495e-04 2.83798332e-04 -1.45903203e-03] [ 7.51506205e-04 -1.30498835e-03 9.00393286e-04] [-8.78936852e-04 -1.49676097e-03 -1.01002646e-03] [-1.68554431e-03 1.53410694e-03 1.29625459e-03] [-2.30039181e-03 1.17617907e-03 1.19233870e-03] [ 3.54708970e-03 -1.51033951e-03 -2.11801461e-04] [ 1.48910583e-03 -8.49304381e-04 1.67896126e-04] [-2.92540935e-03 -8.44933050e-06 2.61700869e-03] [-1.32070279e-04 3.18894511e-03 -6.20624447e-04] [ 2.36125755e-03 -1.10860966e-03 -1.69845035e-03] [ 2.16008941e-03 -2.82253270e-03 1.82298164e-03] [-1.50179063e-03 -2.22280462e-04 -2.86576189e-03]] Final stress: [ 1.26249460e-04 -1.57821211e-04 -1.46760578e-05 1.63318187e-04 -2.29837712e-04 3.24302420e-04] Minimization converged after 52 steps. Minimization converged after 53 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.60284101e-03 1.13697425e-03 1.21997410e-04] [ 5.92668673e-03 -1.86796009e-03 9.87148532e-04] [-7.77940990e-04 8.09178304e-04 1.63528352e-04] [-1.26378691e-04 -3.52202929e-03 6.03224419e-04] [-4.67489035e-04 1.37521424e-03 2.29912698e-04] [-1.67356575e-03 1.02875019e-03 -1.17388630e-04] [ 1.60446314e-04 5.19028705e-03 1.33442324e-03] [ 4.15002653e-03 -3.57756135e-03 -9.07557054e-04] [ 1.00028076e-02 -4.64426075e-03 -6.73345060e-04] [-3.89876856e-03 -2.26714310e-03 -1.02872485e-04] [ 3.66128765e-03 1.03980889e-03 5.32524712e-04] [ 5.18201833e-04 4.64604561e-04 -1.21030253e-03] [ 3.66734603e-03 -4.26589081e-05 -2.21492915e-03] [ 2.44245547e-03 5.19099907e-03 -2.93051328e-03] [-6.57849974e-03 -4.14725221e-03 2.34019510e-03] [-1.59316884e-03 -8.16460373e-04 1.32669834e-05] [ 9.58326240e-04 -2.24944662e-03 1.74913153e-03] [ 1.17750125e-03 7.63947340e-05 2.79488768e-04] [-1.43808648e-02 6.92524067e-03 -2.15128857e-03] [ 4.17340683e-03 -3.15707905e-05 -3.51496609e-03] [ 7.69437206e-04 -8.26848580e-03 1.73098694e-05] [ 4.71147768e-03 -2.96473894e-03 -9.44343366e-04] [-1.01642985e-03 4.83082560e-05 2.26831412e-03] [-5.17394157e-03 -1.03440043e-03 4.90748342e-03] [ 7.07150184e-04 -8.28384965e-04 -8.51115320e-04] [ 7.47961716e-04 2.19181345e-03 1.67692420e-03] [-2.87256270e-03 2.35680995e-03 -9.27146494e-04] [-2.87129621e-03 -9.83031101e-04 6.31890635e-04] [-1.92185877e-03 -6.90325257e-04 1.19422514e-03] [ 2.87230354e-03 -5.16154656e-04 1.41208955e-03] [ 1.27002775e-03 2.57350891e-03 -1.73687596e-03] [-2.51623186e-03 6.34802498e-04 4.46512040e-04] [-4.93083535e-05 -4.32182771e-04 1.82244778e-03] [ 3.35643925e-03 2.83409482e-03 -5.27262836e-04] [-3.25638599e-04 2.97845340e-03 1.06922227e-03] [-3.42650444e-03 2.02880417e-03 -4.99135393e-03]] Final stress: [-8.82509572e-05 -6.06675971e-05 -1.36274095e-05 -3.09474773e-04 1.52887530e-05 -5.24786777e-04] Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 11 steps. Minimization converged after 45 steps. Minimization converged after 50 steps. Minimization converged after 12 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 51 steps. Minimization converged after 50 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 19 steps. Minimization converged after 12 steps. Minimization converged after 47 steps. Minimization converged after 49 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 53 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 50 steps. Minimization converged after 53 steps. Minimization converged after 57 steps. Minimization converged after 50 steps. Minimization converged after 46 steps. Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization converged after 52 steps. Minimization converged after 54 steps. Minimization converged after 53 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 11 steps. Minimization converged after 42 steps. Minimization converged after 45 steps. Minimization converged after 11 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 54 steps. Minimization converged after 52 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 45 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 50 steps. Minimization converged after 49 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 16 steps. Minimization converged after 11 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 49 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 55 steps. Minimization converged after 54 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 11 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 11 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 47 steps. Minimization converged after 49 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 53 steps. Minimization converged after 53 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 9 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 10 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 35 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 10 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 13 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 41 steps. Minimization converged after 33 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 33 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 10 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 10 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 32 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 16 steps. Minimization converged after 6 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 10 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 10 steps. Minimization converged after 36 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 34 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 32 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 8 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 8 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 28 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 8 steps. Minimization converged after 35 steps. Minimization converged after 30 steps. Minimization converged after 8 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 35 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 6 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 30 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 6 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 5 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 6 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 6 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 14 steps. Minimization converged after 22 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 25 steps. Minimization converged after 19 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 14 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.72935 0.41796 0.07811 -0. -0.07959 0. ] [ 0.41796 0.72926 0.07811 -0. 0.07959 0. ] [ 0.07811 0.07811 1.13898 0. -0. 0. ] [-0. -0. 0. 0.12319 0. 0.07959] [-0.07959 0.07959 -0. 0. 0.12319 0. ] [ 0. 0. 0. 0.07959 0. 0.15564]] 95%% Error estimate [ASE units]: [[0.00019 0.00023 0.00005 0. 0. 0. ] [0.00023 0.00026 0.00018 0. 0. 0. ] [0.00005 0.00018 0. 0. 0. 0. ] [0. 0. 0. 0. 0. 0.00001] [0. 0. 0. 0. 0. 0. ] [0. 0. 0. 0.00001 0. 0. ]] Maximum deviation from material symmetry [ASE units]: 0.079591 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.138977 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 1.23858054e-03 1.87016839e-04 -1.56607127e-05] [ 1.63978440e-03 -4.70464050e-03 1.61620256e-04] [-3.07831793e-03 2.09811200e-03 4.36182345e-04] [ 8.00188374e-04 -3.04877173e-03 9.21902365e-04] [-3.85232920e-03 1.73754063e-03 3.27318332e-04] [ 5.93190096e-03 7.95227695e-04 8.21979134e-04] [-2.39305500e-03 -3.27020018e-03 -1.77598567e-03] [-9.50649152e-05 4.63094099e-03 -1.74842409e-04] [ 8.01462269e-03 9.94634344e-04 1.82306607e-04] [ 9.66251171e-04 3.81037670e-03 9.51697614e-04] [-3.94075124e-03 -2.79995625e-03 -2.49403836e-04] [-2.55520209e-03 -4.62910446e-03 -1.54427131e-03] [ 6.38441070e-03 -5.69491597e-03 2.81162866e-03] [-6.59023205e-03 -1.86572249e-04 -2.70128371e-03] [-8.32567883e-05 6.25537543e-03 -3.04523321e-03] [ 3.80764462e-03 3.25842967e-03 6.55716468e-04] [ 1.41586689e-03 -9.67343230e-03 -7.84653265e-04] [-4.87591186e-03 2.92632354e-03 -4.94681652e-04] [-1.64929102e-03 4.53203755e-03 2.71591923e-03] [-1.54925927e-03 -3.47337604e-03 -1.28827090e-03] [-1.07061595e-03 5.29754969e-03 -2.39079934e-03] [ 6.19093686e-04 4.22928050e-03 4.87828463e-03] [ 1.20296429e-03 1.50480786e-02 -1.47267725e-03] [ 6.95785417e-03 1.38668729e-04 -1.77646376e-03] [-1.52614247e-03 2.14015937e-04 -7.10676625e-04] [-6.28611492e-03 -1.06672242e-03 3.07837713e-03] [ 1.66880176e-03 -2.89616602e-03 4.92356571e-03] [-3.90819161e-03 -3.38842808e-03 -3.49377598e-03] [ 9.66103303e-04 2.98553079e-03 1.08683870e-03] [ 5.38328319e-03 -1.93681503e-03 -2.80675338e-03] [-7.49254940e-04 -6.91391497e-03 2.37322288e-03] [ 1.66301378e-03 1.02528604e-03 -4.42862307e-03] [-3.31165194e-03 -4.89147879e-04 -3.59055802e-03] [ 1.89930952e-03 8.05686809e-04 5.17410470e-03] [ 1.13220343e-03 -6.60856765e-03 -1.91335465e-03] [-4.17723430e-03 -1.89380800e-04 3.15730401e-03]] Final stress: [-1.40208339e-02 -8.75796546e-03 -1.76246187e-03 7.87817852e-06 1.57464024e-03 -1.89341761e-05] Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-4.10010917e-04 1.97010200e-03 2.71780572e-04] [-2.93960743e-03 4.41685439e-03 -1.25159545e-03] [-1.61444623e-05 2.44746801e-03 2.29233870e-05] [ 1.43027644e-03 3.45848763e-03 -2.13170517e-04] [ 6.45813077e-04 3.34838080e-03 -2.36348475e-04] [ 1.07297875e-03 3.38449400e-03 8.71869846e-04] [-5.39310959e-03 -1.40944369e-02 9.73264175e-04] [ 7.50638126e-03 1.39665244e-03 1.08782579e-03] [-6.42840510e-03 8.99052409e-03 -2.09606368e-03] [-5.30045665e-03 8.58161744e-03 9.59503350e-04] [-3.15821019e-03 2.30066242e-03 -6.12201390e-04] [-9.52148487e-03 1.89232122e-03 -7.23383201e-04] [ 4.83100485e-03 -1.71383465e-03 -1.40740468e-03] [-2.54415177e-05 -3.16888028e-03 8.37392849e-04] [-5.55134746e-03 -2.25577184e-03 8.74790107e-04] [-6.64750581e-03 5.94747123e-03 -6.02509733e-04] [ 4.83262120e-03 -2.96873476e-03 6.34339574e-04] [ 1.07620970e-03 -3.10677381e-03 -7.02017468e-05] [ 3.48778234e-03 -9.50927757e-03 -2.93532968e-03] [ 3.22807777e-03 8.76453033e-03 1.00048239e-03] [-6.31468014e-03 4.35552500e-03 1.85909938e-03] [-3.86853668e-03 1.02619676e-02 -3.43343133e-03] [ 1.60853756e-02 -1.70142208e-02 4.52238642e-04] [ 3.75007528e-03 -9.10696454e-03 3.19406786e-03] [ 3.40533397e-03 -2.04998010e-03 -6.10471756e-04] [-2.72126212e-03 -1.97840982e-03 1.81347477e-03] [ 5.41461863e-03 -1.63247571e-03 -9.29215703e-04] [-3.35542798e-03 -2.40546347e-03 1.84400706e-03] [-1.87855056e-03 -1.92688120e-03 -3.63061992e-04] [ 3.12318989e-03 -2.11761223e-03 -1.34083810e-03] [ 4.11200665e-04 -8.34703057e-04 -2.36300336e-03] [ 2.85475738e-03 2.26595096e-05 4.71189470e-03] [-3.96447401e-03 2.60855940e-03 -7.85357488e-04] [ 6.25325112e-03 3.75480256e-03 -6.14428606e-04] [-1.10955024e-03 -5.91423389e-04 2.79782789e-03] [-8.04742244e-04 -1.42723598e-03 -3.61876547e-03]] Final stress: [ 2.76643489e-03 -3.16626191e-03 -1.08494907e-04 2.00872505e-06 -1.53989847e-03 -9.11887052e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[ 2.04959467e-03 -3.83652354e-04 -3.57553375e-04] [ 9.14207026e-04 -7.80606101e-04 9.65351303e-05] [ 1.93341361e-03 -2.33320124e-03 -4.21161630e-04] [-1.30791355e-03 -6.99258183e-03 1.34280423e-03] [ 5.28739863e-04 -3.28574974e-03 -1.70538704e-04] [-5.88900004e-04 -1.39609057e-03 -1.23897749e-04] [ 5.81566986e-03 1.18171665e-03 -1.82362707e-03] [ 4.22263477e-03 5.33664704e-03 1.46442412e-05] [ 1.27863247e-03 1.21873862e-03 1.59678934e-03] [-2.17047744e-03 1.06161322e-03 -9.18945311e-04] [-2.13677027e-03 -4.64866093e-03 -1.81314333e-03] [ 4.87299943e-03 2.38079542e-03 2.68701305e-03] [ 1.41090350e-03 -3.03865539e-05 8.11863356e-06] [-1.23361476e-03 5.14725989e-03 -1.41042462e-03] [-6.63921421e-04 1.78234313e-03 1.05937672e-03] [-2.87027412e-03 1.15346469e-04 5.77558484e-04] [-4.47623273e-04 -5.08834330e-03 -1.31629302e-04] [ 3.34927191e-03 9.17119267e-04 -6.37715481e-04] [ 7.98905421e-04 -1.90878161e-03 -8.41951824e-04] [-4.72732461e-03 -4.27920781e-03 -5.29479266e-04] [-7.05259278e-03 5.19886476e-05 1.75963099e-03] [-1.23083278e-03 -3.39991085e-04 2.13820453e-03] [ 1.41957302e-03 9.92551405e-04 -7.38072099e-04] [ 3.58013600e-03 -2.28930991e-03 -1.22407227e-03] [-1.07157010e-03 4.24114201e-03 4.56566412e-04] [ 1.10531120e-03 2.32861875e-04 -2.17073833e-03] [ 3.32296300e-03 6.38582703e-04 1.32137156e-03] [-3.58859516e-03 -1.18667679e-03 -8.83375313e-04] [ 6.33681622e-04 3.94714003e-03 -5.70551745e-04] [-3.21005924e-03 -1.06950360e-03 1.66415153e-03] [ 6.10297167e-05 -8.62244423e-04 2.11206314e-03] [-7.43279708e-04 3.29255590e-03 -2.55909449e-03] [-3.22789959e-03 1.49913045e-03 -1.15583922e-04] [ 1.19523280e-03 1.44757068e-03 -1.57541081e-03] [-1.64078966e-03 -1.64018181e-03 8.67101521e-04] [-5.80461431e-04 3.03006624e-03 1.31503709e-03]] Final stress: [-3.20467665e-03 2.68222504e-03 -1.17254444e-04 3.38953772e-06 1.53501935e-03 -2.08019154e-05] Minimization converged after 19 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[-6.22023824e-06 -9.42604722e-05 -5.57307779e-05] [ 2.19736718e-03 -4.38630451e-03 7.08680752e-04] [ 2.08072169e-03 -2.69560878e-03 -4.46827870e-04] [-1.89043149e-03 -2.64222748e-03 4.31712871e-04] [ 1.78372184e-04 2.61192905e-04 3.97017797e-05] [-2.15286324e-03 -4.55879787e-03 -7.21889873e-04] [-4.48315830e-03 -3.58434954e-03 1.43435429e-03] [-6.62927041e-04 -3.21399967e-03 -3.47993474e-05] [ 5.19092789e-03 -6.49184327e-03 -1.71035079e-03] [-3.47073269e-04 2.31705474e-03 4.25314491e-03] [ 1.02315006e-03 -1.03137112e-03 6.87443168e-04] [-2.37746922e-04 4.00407581e-04 -3.20249387e-03] [ 1.70215845e-03 -6.00666365e-04 1.34034472e-04] [ 3.34015433e-04 -2.61681661e-03 5.82081260e-04] [-2.11456307e-03 -4.35613358e-04 4.40593468e-04] [ 3.48743766e-03 -1.09555578e-03 -3.86220342e-04] [ 3.16193500e-05 -5.03145634e-03 7.41353781e-05] [-3.60207312e-03 -1.37596783e-03 7.30288691e-05] [-4.51391011e-04 8.46984995e-04 -5.52137729e-03] [-6.46096396e-04 1.76727770e-03 2.64757522e-04] [ 4.73541666e-04 -5.56477588e-04 5.21179008e-03] [-3.94216619e-04 -7.83954259e-04 -6.34157948e-03] [ 2.11604760e-03 -4.02937710e-03 3.33017637e-04] [-2.84747768e-03 -4.64418785e-03 6.27177228e-03] [ 4.43589740e-03 5.63541848e-03 -2.07087181e-03] [ 3.08573349e-03 2.05588205e-03 3.72503843e-03] [-3.63075302e-03 6.14430275e-03 -9.61190168e-04] [ 3.64075648e-03 6.42468129e-03 1.02721489e-03] [-4.33657475e-03 5.57880386e-03 2.25555663e-03] [-2.64858362e-03 2.32216987e-03 -3.34881404e-03] [ 3.48456248e-03 2.29515369e-03 -1.37804458e-03] [ 1.81684282e-03 -2.12047640e-04 2.94569823e-03] [-1.99209579e-03 5.75500465e-03 -4.83782534e-03] [ 1.91375424e-03 5.97252322e-03 3.66529752e-03] [-3.27577499e-03 2.57873635e-03 2.33077872e-04] [-1.47288551e-03 -2.74710706e-04 -3.77411674e-03]] Final stress: [ 6.30872513e-03 3.38847271e-03 1.16547202e-02 2.82502975e-08 -7.40579689e-04 -1.21126723e-05] Minimization converged after 45 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[ 0.0016352 -0.00301971 -0.00061814] [ 0.00338618 -0.00774517 0.00129092] [ 0.00010004 -0.00456362 -0.00056176] [-0.00017766 -0.0057719 0.00088387] [-0.00177582 -0.00309919 0.00037955] [-0.0065903 -0.00914265 -0.00218205] [ 0.0052133 0.00329789 -0.00527444] [-0.02119556 0.00710397 0.00324477] [-0.00275157 -0.0038277 0.00037082] [-0.00011005 -0.00511487 0.00391742] [ 0.0216157 -0.00149397 -0.00200463] [ 0.00336472 -0.0095617 0.00015667] [-0.00699171 0.00703394 -0.00509444] [ 0.00119226 -0.00208234 0.00128527] [ 0.00692839 0.00420326 -0.00039502] [ 0.00541068 -0.00601023 0.01031432] [-0.00144502 0.00922105 -0.00160217] [-0.00408503 -0.00343577 -0.00513793] [ 0.00819512 0.00648148 0.00736074] [-0.00118602 -0.00246281 -0.004317 ] [ 0.01479461 0.00561363 -0.00804632] [-0.01480059 0.00732929 0.00409277] [ 0.00208273 0.01946533 0.00427894] [-0.01509356 -0.0066699 -0.00121252] [-0.00126106 -0.00118926 0.00229012] [ 0.00543182 -0.00066808 -0.00373018] [ 0.00209196 0.0002067 0.00128842] [-0.00297086 -0.00171846 0.00149646] [-0.0006825 0.00685753 -0.00306009] [-0.00191246 0.00040024 0.00664563] [-0.0039912 0.00040213 0.0007441 ] [-0.00491134 0.00511219 -0.00044226] [ 0.00053088 -0.00201117 0.00121559] [ 0.00214963 -0.00098891 -0.00334644] [ 0.00567091 -0.00629662 -0.00217767] [ 0.00213818 0.00414542 -0.00205332]] Final stress: [ 0.00589473 0.00286627 0.00056456 0.00245656 -0.00073089 0.00141334] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[ 5.09850793e-03 -3.96155518e-03 1.98018339e-04] [-1.51009545e-02 5.50119535e-03 -3.15086205e-03] [ 1.08711679e-03 6.97885702e-03 1.07007049e-03] [-1.62504368e-03 7.22285108e-03 -7.69760742e-04] [ 1.56427687e-03 -7.12964571e-03 -1.35601270e-03] [ 9.57349905e-03 1.70146460e-03 1.62615735e-03] [-3.88705770e-03 9.26740056e-04 -3.56674616e-03] [-4.09257486e-03 -2.69646935e-03 6.28955897e-04] [ 3.37496421e-03 -9.52144582e-03 4.98815333e-03] [ 8.16813959e-04 -2.48556922e-03 -3.37492038e-03] [-7.66331711e-03 5.89278191e-03 1.34521730e-03] [ 3.32742217e-04 2.08255859e-03 1.26166248e-03] [-1.23306238e-02 2.48224880e-03 3.27688127e-03] [-2.66479065e-03 -2.46368489e-03 2.92713701e-03] [ 1.40626994e-02 6.05254670e-04 -1.08934293e-03] [ 8.12907528e-03 -3.93452262e-03 -2.18821516e-03] [ 1.89177247e-03 7.46041167e-03 -1.25493026e-03] [-8.95710524e-03 -2.81832823e-03 9.14147954e-04] [-2.33982254e-03 2.15321268e-04 8.52479287e-04] [-3.23595281e-03 2.88673757e-03 -1.13333312e-03] [ 8.77253223e-04 -3.93511454e-03 -4.22881625e-05] [ 4.92399043e-03 2.44153676e-03 8.40726566e-03] [ 1.41788332e-03 5.21253281e-03 8.42767042e-04] [ 5.24786199e-03 6.74025791e-03 -1.14529556e-02] [-6.63277025e-03 -7.83201136e-04 -2.11124454e-03] [ 2.05968376e-03 -4.87782780e-03 8.95254047e-04] [ 5.77081887e-03 -1.08588055e-02 -1.80252636e-03] [-2.83302095e-03 -1.91173180e-03 1.44311554e-03] [ 1.98488883e-03 5.45911037e-03 -5.15865915e-03] [ 8.23655567e-04 -2.82675354e-03 1.53603052e-03] [-5.35169017e-04 -9.11329079e-04 6.77532988e-03] [-1.02378186e-03 4.34027054e-03 -7.41534582e-03] [-6.06161725e-03 2.94882474e-03 5.50371022e-03] [ 5.86659652e-03 -5.72892861e-03 -3.67940882e-03] [ 4.54513854e-03 -7.41468488e-03 -1.03613963e-03] [-4.65636984e-04 3.16064216e-03 6.09033791e-03]] Final stress: [ 0.0059337 0.00302227 0.00053002 -0.00243876 -0.0007745 -0.00144878] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 0.02076057 0.01146566 -0.00439691] [-0.00013884 0.00083112 -0.00057061] [-0.00129629 -0.0439995 -0.00493344] [ 0.00158111 0.02741156 -0.00452591] [ 0.00805795 -0.0038624 -0.00144168] [-0.02613622 -0.01252204 -0.00452717] [-0.00072016 -0.00185339 0.00233475] [ 0.00972045 0.00377149 -0.0057977 ] [-0.02153725 0.02722302 -0.00547873] [-0.01156105 -0.01612762 0.00568323] [-0.01173685 -0.00150216 0.00951489] [ 0.01881926 -0.03081358 0.00837942] [ 0.00605738 -0.00433478 0.00102503] [-0.02135814 0.00539613 0.00042542] [ 0.01360202 0.00803675 0.01399664] [-0.00587767 0.0162485 0.00179631] [ 0.01063609 -0.01214346 0.00321225] [-0.00370102 -0.00926817 -0.01303651] [ 0.01358939 -0.00462139 0.0088279 ] [ 0.00473285 0.00203852 0.0001955 ] [-0.01988668 0.00274108 -0.0185999 ] [-0.01940288 0.00788014 -0.01182929] [ 0.0006992 0.0054877 -0.00340143] [ 0.03178069 0.0154682 0.01475635] [ 0.00668305 0.01589613 -0.00458356] [-0.00125098 0.00641053 -0.01466039] [ 0.00540398 -0.01462357 -0.01679699] [ 0.01656124 -0.01696282 0.00283942] [-0.01695665 0.01110628 -0.0008507 ] [ 0.01879954 0.00475003 0.01388782] [-0.01089128 -0.01285916 0.00643176] [ 0.00129767 -0.01312429 0.01531964] [ 0.00208062 0.01813177 0.01899889] [-0.01277102 0.01551588 -0.00028174] [ 0.01097055 -0.01308832 0.00181516] [-0.01661063 0.00589619 -0.01372771]] Final stress: [-0.00655496 -0.00379384 -0.00055083 0.00247469 0.00096895 0.00155952] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-0.00510244 -0.00167634 0.0011794 ] [ 0.02686068 -0.01302219 0.00467748] [-0.00120296 0.02450295 0.00399191] [ 0.00231175 -0.04415104 0.00493619] [-0.0205294 0.01193697 0.00442044] [-0.00444497 -0.00160547 0.00019854] [-0.02465715 -0.0056866 -0.00855289] [ 0.04879172 -0.0129465 -0.00370381] [ 0.03420222 -0.04671254 -0.00229552] [ 0.03477436 0.05935969 0.00524333] [ 0.00276725 0.00977285 -0.00129911] [-0.01655628 -0.02648181 -0.00111531] [ 0.00709301 -0.00031067 -0.01666123] [ 0.01108065 -0.00746216 -0.00133692] [-0.00940597 0.00965975 0.00924494] [-0.00476826 0.0028193 0.01420067] [-0.00300585 -0.0070214 -0.0027181 ] [ 0.00034892 0.00804079 -0.01000781] [-0.02873004 0.01967597 0.02132158] [-0.02280967 0.04520378 -0.00161697] [-0.00268897 0.0324766 -0.01037826] [ 0.00389645 0.01325059 -0.01735622] [ 0.00461068 -0.02357271 0.00467847] [-0.02692933 -0.05763151 0.01230626] [ 0.00796143 0.00848862 0.01002788] [-0.01321296 0.0031787 -0.0094912 ] [ 0.00110721 -0.01304143 0.0064839 ] [-0.00159212 -0.01182484 0.01623352] [-0.00542851 0.01020429 0.00234435] [ 0.00332982 -0.00315987 0.02231017] [-0.00334748 -0.00992919 -0.01057827] [ 0.01027761 0.00949691 0.00475472] [-0.00377768 0.01232107 -0.0053796 ] [-0.00622897 0.01622205 -0.02020485] [ 0.0088838 -0.0071899 -0.00270097] [-0.00387854 -0.00318472 -0.0231567 ]] Final stress: [-0.00690936 -0.0039856 -0.00068177 -0.00245755 0.00098714 -0.00180458] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-1.10126873e-03 -4.82072910e-04 3.65354720e-04] [-2.62830399e-03 1.30158327e-03 -4.57355364e-04] [ 3.35722209e-05 3.32160166e-03 5.19234852e-04] [-1.15129944e-04 2.72642101e-03 -4.34162636e-04] [-5.85751592e-04 4.36297567e-04 -3.97746946e-05] [ 3.99777908e-03 2.14024698e-03 6.74136732e-04] [-1.54144212e-03 -3.41502650e-03 9.25499465e-04] [ 9.58059507e-03 1.28912298e-04 -2.99146084e-04] [ 7.28604206e-03 -3.41484964e-03 -1.24638649e-03] [-9.52438084e-03 4.76049018e-03 -1.46926326e-04] [-4.99092258e-03 -1.67033329e-03 -2.48663720e-04] [ 1.06564103e-03 -3.08534461e-03 2.54434874e-04] [-1.45137358e-03 8.44895628e-04 -4.68446620e-04] [ 8.65340955e-05 -3.67917561e-03 -1.96820172e-04] [ 1.43535526e-03 9.92897754e-04 2.89010023e-04] [ 5.77037648e-04 -2.33216747e-03 5.11598200e-04] [ 1.61804597e-04 3.12127058e-03 -6.79643900e-05] [-6.88928799e-04 -2.12184972e-03 -5.06848856e-04] [ 4.31026253e-06 8.18406497e-03 1.11883675e-03] [ 1.46199463e-04 -7.18413892e-04 -3.32503384e-07] [-1.52402542e-02 3.05809730e-03 -9.70454060e-04] [ 1.53428038e-02 -2.93463551e-03 -1.27968785e-03] [-1.69066017e-03 -4.88601607e-03 -1.85807730e-04] [ 1.42259712e-05 3.41291636e-03 1.41800915e-03] [ 1.42749448e-03 -4.30302899e-03 -5.49638914e-04] [ 2.11590229e-03 3.27505707e-04 2.21508808e-03] [-1.74584865e-03 -1.28286842e-04 1.53109940e-03] [ 1.43656498e-03 -2.07269269e-04 -1.59354532e-03] [-1.11697408e-03 -4.13169270e-03 7.00597723e-04] [-2.27834601e-03 4.31077212e-04 -2.07623281e-03] [-1.41200390e-03 3.59607361e-03 3.56823788e-04] [-2.33027352e-03 -1.71694675e-03 -7.90627362e-04] [ 1.01830017e-03 -4.14871710e-04 -2.54658966e-03] [-9.76758373e-04 -1.72640452e-04 2.85736600e-03] [ 1.30847338e-03 3.44873508e-03 -1.22066627e-04] [ 2.37998521e-03 -2.41846524e-03 4.90388437e-04]] Final stress: [4.46714935e-03 4.43288508e-03 6.18858060e-04 2.03469081e-06 1.75858157e-03 5.56527229e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[-9.45624506e-04 3.48873631e-03 -4.81597199e-04] [ 6.13591749e-03 1.50078930e-03 9.13155728e-04] [-2.32558787e-03 -1.22355886e-03 -2.17649972e-05] [ 1.46145599e-03 -1.36997104e-03 7.28867114e-05] [ 7.14094478e-04 3.58574273e-03 4.86967459e-04] [-6.76874849e-03 1.94945333e-03 -1.12326752e-03] [-3.81383037e-03 -1.64478313e-04 6.51091120e-04] [ 2.84387060e-04 1.89413539e-03 -3.32054642e-05] [ 1.98911796e-03 -6.59657906e-03 -5.85193866e-04] [ 3.12307327e-03 1.52651625e-03 3.10190817e-03] [-5.11153264e-04 1.31518813e-03 1.31981497e-03] [ 2.08282442e-03 4.21881233e-04 2.59703912e-03] [-3.53810244e-03 1.12499076e-03 1.81309812e-03] [ 8.83517709e-04 -2.01935989e-03 1.40569964e-03] [ 1.34099161e-03 3.12726023e-03 2.77761277e-03] [ 1.91223891e-03 -1.02337175e-04 -6.32223244e-04] [-1.00935972e-04 4.88868505e-03 -2.92659851e-04] [-2.09299944e-03 -4.98076055e-04 4.08064342e-04] [-1.75452018e-03 1.51319764e-03 1.56815495e-03] [-4.57008134e-04 5.86284188e-03 2.80555769e-04] [ 3.47704570e-03 7.10738942e-04 -2.01340936e-03] [-8.99660898e-06 6.67152522e-04 2.80325898e-03] [-1.40619002e-03 -8.15707323e-04 1.16146183e-03] [-1.73708106e-03 9.02871941e-04 -2.29859767e-03] [-2.47250742e-03 -1.57948574e-03 2.87756646e-04] [-2.06246316e-03 -1.31451986e-03 -2.24360216e-03] [ 3.40611798e-03 -3.05651765e-03 -5.56841319e-04] [-3.15364982e-03 -2.41840017e-03 6.11195803e-04] [ 2.82081783e-03 -1.72277795e-03 4.23190368e-04] [ 3.03688485e-03 -1.54018166e-03 2.22609404e-03] [-4.89234763e-04 -2.58035598e-03 -1.67118395e-03] [ 4.33674320e-04 1.51327767e-03 -2.44971665e-03] [ 6.14717415e-04 -4.08157514e-03 -1.41491109e-05] [-1.23644198e-03 -3.65687150e-03 -6.25246755e-03] [ 6.14754037e-04 -2.81384838e-03 -1.02605706e-03] [ 5.43444460e-04 1.56114243e-03 -3.21306957e-03]] Final stress: [ 7.41907124e-03 1.45855145e-03 5.38912885e-04 8.99047823e-07 -3.22939750e-03 -1.04655677e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[-2.47272633e-03 -1.06086817e-03 2.52910532e-04] [ 4.84182498e-03 -1.57214484e-03 4.11001946e-04] [-4.44090610e-05 -9.11455675e-04 -1.86994536e-04] [ 2.29982083e-04 -4.10504485e-03 7.91477177e-04] [-2.72781678e-03 2.02637424e-03 4.03937302e-04] [ 2.27308447e-03 1.66709478e-03 2.07100414e-04] [ 1.42148312e-02 7.57629127e-03 1.38957593e-03] [-2.07380138e-02 6.80975120e-03 1.24203955e-05] [-3.30312221e-03 -1.36789509e-02 -1.73169748e-03] [ 1.28245002e-03 9.85277591e-03 -1.89709843e-03] [ 9.35285257e-03 3.18086022e-03 -1.12822186e-03] [-2.88187129e-04 -4.78018962e-03 1.87728195e-03] [ 5.98805722e-03 -7.86104390e-04 -2.18217731e-04] [ 3.81125713e-03 6.13367716e-03 6.31310144e-05] [-7.71048941e-03 -4.12228767e-03 -9.97624414e-04] [-3.36263707e-03 2.66912676e-03 -7.99442286e-04] [ 7.27529385e-04 -4.85916170e-03 -1.15059656e-04] [ 1.74449367e-03 2.93426024e-03 3.57773392e-04] [ 2.06285812e-03 1.08050656e-02 -9.26502494e-04] [-3.98810404e-03 -1.36171431e-02 8.49904685e-04] [ 1.11930819e-02 -2.32709045e-03 5.98606968e-04] [-7.08299633e-04 2.37940758e-03 4.07949160e-04] [-2.56113480e-04 1.18644100e-03 2.00629040e-04] [-1.30780732e-02 -8.08702894e-03 4.36898166e-04] [ 1.58236678e-03 2.78306632e-04 2.00422013e-03] [ 1.28817502e-03 4.12881389e-03 1.26332864e-03] [-5.38942381e-03 1.66993883e-03 -1.21834504e-03] [ 4.49727601e-03 2.12995303e-03 5.56904846e-04] [-1.20120469e-03 4.95926979e-04 -2.36867224e-03] [-9.02660201e-04 2.79957804e-03 -9.74294143e-04] [-8.41795209e-04 -2.38093389e-04 -2.17129393e-03] [-1.02896955e-03 -2.45157201e-03 -1.06173665e-03] [ 4.70171095e-03 -1.97823921e-03 1.00385780e-03] [-4.62582660e-03 -9.40106724e-04 -2.00080501e-03] [ 1.67062323e-03 2.17855091e-04 3.23408897e-03] [ 1.20541755e-03 -3.42601676e-03 1.47300744e-03]] Final stress: [-8.68791598e-03 -2.64166883e-03 -7.23821936e-04 6.90282953e-06 3.19215723e-03 1.27517591e-05] Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[ 1.68680177e-02 7.24392342e-03 -3.96483989e-03] [ 5.72338371e-03 -6.08547213e-03 1.44423663e-03] [-1.09232888e-03 -2.00705970e-03 -2.61346396e-04] [-1.59075204e-04 -8.50775007e-03 1.20029122e-03] [ 4.05266660e-03 -5.59451359e-03 -6.14700024e-04] [-4.02034026e-03 -3.93131113e-03 -1.29825642e-03] [-5.54228293e-03 -1.21264048e-05 -6.57659298e-03] [-4.11980797e-03 -5.34138838e-04 4.86914012e-03] [-3.62878238e-04 1.47280323e-03 4.65887926e-03] [ 5.76072166e-03 3.93996721e-03 7.60629220e-03] [-7.44173160e-04 5.18470371e-03 -1.36591105e-03] [-1.76068954e-03 2.32707923e-03 -7.15574916e-03] [-7.84179815e-03 4.10518717e-03 2.41270125e-03] [-7.28532522e-03 5.24382458e-03 2.40766034e-03] [-4.42538832e-03 2.43684736e-03 -7.00797762e-03] [ 5.10923321e-03 -1.21801377e-04 1.58311004e-03] [ 5.39774432e-03 -5.16848348e-03 -3.06214143e-03] [ 6.97219112e-03 1.57459987e-04 4.65619603e-03] [ 7.06466356e-04 -5.16506096e-03 1.28289331e-03] [-3.33263446e-03 6.47797980e-03 -8.04332262e-04] [ 1.85745492e-03 1.90690348e-03 -8.66127467e-04] [-2.44798157e-03 4.14466070e-03 6.20426532e-03] [ 4.61545288e-04 -2.68150097e-03 -2.95263462e-03] [-7.24211473e-04 -2.15580226e-03 -2.91011564e-03] [-4.96391996e-03 -2.04790875e-03 4.32076596e-03] [-6.75672858e-03 -2.13334580e-04 -3.01380738e-03] [-5.74905677e-03 2.20864897e-03 -2.28034754e-03] [-2.54424519e-03 1.29925371e-03 8.18177733e-04] [ 2.03914909e-03 -7.62679229e-03 -1.54530495e-03] [ 7.23826301e-03 5.48886910e-04 -2.37854681e-03] [ 7.33676533e-04 -4.34438103e-04 -2.69040448e-03] [ 5.69637922e-03 6.14914943e-03 1.01984627e-03] [ 6.83161127e-03 -4.53329552e-03 4.38889694e-03] [ 2.56320365e-03 -3.22799998e-03 5.46122084e-04] [-6.32600166e-03 3.81260350e-03 -1.80765642e-03] [-7.81284017e-03 1.38890774e-03 3.13731783e-03]] Final stress: [ 0.00590363 0.0029757 0.00046825 0.00148234 -0.000699 0.00288914] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-4.24814328e-03 -3.52125446e-03 5.39107618e-04] [ 3.88878921e-03 -4.55621293e-03 1.42101370e-03] [-3.11046144e-03 -7.67202528e-03 -1.37203449e-03] [-2.07937821e-03 -1.56826138e-03 1.07682706e-04] [-2.05278697e-02 6.74714893e-03 4.53530346e-03] [-5.48586548e-03 -4.69140765e-03 -1.05764062e-03] [-1.17437082e-02 -6.29921081e-03 3.54955402e-03] [ 2.85261571e-02 -8.61931473e-03 -4.42925390e-03] [ 1.34129548e-03 1.53890076e-02 8.65612741e-03] [-8.45399875e-03 1.61805867e-02 -3.39075743e-03] [-2.87301398e-03 -1.53019164e-02 7.18171613e-04] [ 2.18496262e-02 -8.61085017e-04 -7.95128462e-03] [ 1.17226763e-03 5.59525161e-03 2.39745982e-03] [ 4.67708098e-03 -3.47995814e-03 -7.19802670e-03] [ 3.71344781e-03 1.24217865e-03 5.40519588e-04] [-2.61733806e-05 -6.67301475e-03 2.39802929e-03] [-9.59681758e-03 -6.14472107e-03 1.83282204e-03] [ 6.35431848e-03 1.41482932e-02 -1.02838881e-03] [-7.71766685e-03 -1.56665069e-02 1.12597988e-02] [ 6.91764078e-03 7.94908779e-03 -3.28339665e-03] [-4.06833530e-03 4.01042843e-03 -9.93905422e-03] [-6.48348946e-04 1.42044343e-02 2.82131005e-04] [-6.62664576e-03 -6.26378271e-03 -6.06722674e-03] [ 7.37952410e-03 7.65219679e-03 7.12406521e-03] [ 8.25281498e-03 4.04234990e-03 -5.16293756e-03] [ 1.04065719e-02 -4.60466730e-03 -1.24891450e-02] [-4.65063790e-03 -2.54953639e-03 2.41953578e-03] [-2.95433535e-03 -8.61878850e-03 5.76531732e-03] [ 3.95686638e-03 1.36548605e-03 1.54339094e-03] [-1.17394437e-02 5.97923929e-03 -2.74126430e-03] [-1.04044520e-02 -8.44507219e-03 7.48221258e-03] [-1.40164489e-02 1.06792089e-02 5.62056915e-03] [ 8.38600197e-03 5.41698414e-03 2.50636433e-03] [ 3.75528889e-03 2.47837401e-03 -1.83715384e-03] [ 3.07563357e-03 -5.25125043e-04 -6.75721599e-03] [ 7.31841935e-03 -7.01839458e-03 4.00560454e-03]] Final stress: [ 0.00590373 0.00313943 0.00054761 -0.0015437 -0.00068547 -0.00287227] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-1.80122035e-02 -9.66964514e-03 4.54947282e-03] [-5.27546370e-04 6.23261739e-03 -1.27503794e-04] [-3.36010676e-03 -4.21966243e-03 -2.32067288e-04] [ 7.83351691e-04 1.91550190e-02 -4.19513988e-03] [-5.41211074e-03 -1.91278742e-03 1.61393411e-04] [ 2.66990920e-03 4.72241731e-03 2.89340585e-04] [ 4.73906045e-03 -1.48608680e-02 4.79317225e-03] [-4.36298581e-02 1.04746621e-02 -6.39819966e-03] [-7.02625025e-03 -1.67544989e-02 1.47556240e-03] [ 3.43526202e-03 1.46425727e-02 -4.51300252e-03] [ 4.80484065e-02 -2.13156861e-04 4.02659144e-03] [ 1.31273649e-02 8.03155031e-03 3.03875030e-04] [ 4.90363627e-03 -2.16590493e-03 -4.96275283e-03] [ 3.93646773e-03 4.86114101e-03 -1.97268407e-03] [-2.54508508e-02 -2.71553193e-02 -1.00070032e-03] [-1.19222363e-02 7.56675663e-04 5.00215239e-03] [-4.06141957e-03 5.06756003e-03 -1.66110480e-03] [ 2.60896556e-02 2.25888624e-02 4.11749737e-03] [ 2.49008466e-02 -4.02698746e-03 6.75654942e-03] [ 1.37430414e-02 3.74607664e-03 -1.37112705e-02] [ 1.76362080e-02 -1.19849687e-02 -5.80541450e-03] [-3.20888899e-02 4.71008201e-03 -7.27777396e-03] [-1.22107462e-02 -1.63405908e-02 8.98365138e-03] [-5.08785597e-03 8.04107474e-03 1.13158410e-02] [-5.37515016e-03 -8.01346785e-03 2.31152002e-03] [ 7.12187336e-03 -1.68392334e-03 7.32010635e-03] [-2.79911158e-03 1.59215811e-03 -1.64297866e-03] [-7.27632253e-05 3.38955027e-03 4.96385775e-03] [ 2.26081565e-03 6.91740688e-03 2.32043766e-03] [ 4.02274217e-03 -5.15659925e-05 -8.18287291e-03] [ 6.46437986e-03 -1.18120974e-03 -8.12901115e-03] [-5.39943265e-03 5.08631512e-03 -3.58706384e-03] [ 2.65693730e-03 4.10781855e-03 6.06922262e-03] [ 7.42044835e-03 4.58502304e-04 4.58020112e-04] [-3.82341525e-03 -1.17424861e-02 -4.65888591e-03] [-7.70045972e-03 -2.60501940e-03 2.84016251e-03]] Final stress: [-0.00696418 -0.00388615 -0.00087736 0.0015303 0.00097391 0.00309599] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 9.88080247e-04 1.15643170e-04 -4.79541335e-05] [-1.85219610e-04 1.58703029e-03 -7.04327407e-05] [ 2.07204343e-04 4.99729308e-03 1.12466045e-03] [ 1.19710386e-03 -1.34264629e-03 1.11839734e-04] [ 4.64113920e-03 -2.47735885e-03 -1.21306352e-03] [ 7.27716921e-04 9.35006330e-04 4.67566905e-05] [ 1.27520666e-02 -1.10338912e-02 2.96664799e-04] [ 6.23171882e-03 1.30436310e-02 1.83478328e-03] [-2.29735792e-02 4.79165788e-03 -3.37754113e-03] [-1.81350457e-02 -1.12662262e-02 4.54436644e-05] [-9.67130665e-03 -1.50183437e-02 -2.03521956e-03] [ 8.04169369e-03 8.64386531e-03 3.00660813e-03] [-7.15176203e-03 -5.70412248e-03 -1.13020414e-03] [ 2.49996166e-03 7.12139948e-03 6.94152735e-04] [ 8.47973128e-03 -6.46219243e-03 1.01326721e-03] [ 1.05643997e-02 1.80122227e-03 -5.05077621e-05] [-5.62535734e-03 -4.68394529e-03 2.18753745e-04] [-8.93704651e-03 7.80974346e-03 -1.02626214e-03] [ 4.85842273e-03 -4.97527787e-03 2.84092349e-03] [ 4.02992765e-03 -7.02093278e-03 1.85531884e-03] [-7.90213160e-03 2.18374226e-04 -1.47385418e-03] [-1.21663461e-03 -4.72912213e-03 -3.60837417e-03] [ 5.39770541e-03 1.80297472e-02 -1.61538216e-03] [ 1.21109843e-02 5.68714731e-03 1.54817866e-03] [ 2.48217562e-03 3.75209181e-03 -3.73822251e-03] [ 5.21628937e-04 -4.91265302e-05 1.27705538e-03] [-1.16359202e-03 -5.49180810e-04 -1.66699917e-03] [ 4.06700108e-03 1.06818548e-03 3.51352855e-03] [-1.81025152e-03 -4.90999601e-04 -2.19190973e-04] [ 4.31736596e-04 7.75214671e-05 -7.45458571e-04] [-3.85279239e-03 -3.21737969e-03 4.53721264e-03] [ 1.63753663e-04 3.21524741e-04 -5.15674217e-04] [ 1.31135615e-04 1.43643169e-03 6.59973843e-04] [-3.15054667e-03 -6.12975826e-04 -3.59537682e-03] [ 2.34912753e-03 -3.07579771e-04 1.30550845e-03] [-1.09914961e-03 -1.49621486e-03 1.99087593e-04]] Final stress: [-0.00712457 -0.00412018 -0.00078755 -0.00160567 0.00085763 -0.00296986] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[-0.0046287 -0.00714078 0.0049215 ] [-0.05996606 0.01509801 -0.00694537] [ 0.0210806 0.09210366 0.01614767] [-0.00978271 0.11567805 -0.02200285] [-0.00062209 0.04477447 -0.0030478 ] [ 0.02481708 0.02123429 0.00735639] [-0.01927157 -0.07555499 0.01600717] [-0.17772889 -0.03882183 0.01884011] [ 0.09839441 0.08836041 -0.02051474] [ 0.00523862 0.01102453 -0.08101004] [-0.05476773 -0.11626365 0.10638018] [ 0.03649802 0.07244237 -0.03471134] [-0.06830965 0.06593946 -0.00125303] [ 0.03689575 -0.07151959 0.05724273] [ 0.11534801 0.03822488 -0.06923518] [ 0.10678224 -0.08331902 -0.05758764] [ 0.00502902 -0.06340204 -0.00510017] [-0.05157279 -0.05329655 0.07358463] [-0.01579502 0.02390858 -0.11517904] [ 0.09533777 -0.0928169 0.07122688] [ 0.07780006 -0.08643507 0.03600086] [-0.07346241 -0.03205159 0.09279206] [-0.05088538 0.08554383 0.03456193] [-0.04087357 -0.06652926 -0.11952488] [-0.02890032 0.02403983 0.03325982] [-0.02687456 -0.10693782 0.05940154] [-0.08508227 -0.06795567 -0.04740116] [-0.07809153 0.11350354 -0.0853454 ] [ 0.05909669 0.01685027 -0.00553257] [ 0.10830421 0.14918968 0.03045171] [-0.07430716 0.05942683 -0.04133951] [ 0.0756656 -0.07997074 0.00411858] [-0.00583401 -0.03574422 0.0308473 ] [-0.00251219 -0.06269639 0.05735977] [ 0.13967486 0.1039519 -0.10614831] [-0.07669431 -0.00083846 0.0713782 ]] Final stress: [0.00711945 0.01086403 0.00143748 0.00026125 0.00045417 0.00072615] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-6.30073594e-03 -1.77627244e-03 4.81355085e-04] [-1.12840219e-03 2.57342266e-03 8.43530061e-05] [ 1.85903604e-04 -5.21230952e-04 -8.36366746e-06] [-7.70402082e-04 -2.23749638e-03 2.77123504e-04] [ 3.63979526e-03 -8.78846332e-04 2.64614987e-05] [ 2.79671347e-03 3.85302736e-03 3.86528650e-04] [ 9.97585343e-05 3.07512661e-03 -6.22772159e-04] [ 2.15573774e-03 -4.73518966e-03 4.39645837e-04] [-2.68736646e-03 6.23625656e-04 -1.10963325e-03] [ 1.37808123e-03 3.83706272e-03 8.10050937e-04] [-4.54192746e-03 2.08750236e-03 -7.26212287e-04] [-1.71269023e-03 -2.14528494e-03 5.98546125e-04] [-7.61241438e-04 1.18161878e-03 -2.01197204e-03] [ 7.49127845e-04 7.75692021e-04 -2.33643679e-03] [-2.12744188e-04 -2.20122703e-03 -1.06300752e-03] [-3.17446691e-03 1.55327997e-03 -1.03359828e-03] [ 3.16318220e-03 -1.83784025e-03 1.86211269e-03] [ 4.46795568e-04 -1.11855501e-05 4.39875750e-03] [ 2.42314729e-03 -4.51456016e-03 -5.18905635e-03] [ 1.65971770e-03 1.20199498e-04 -3.79229717e-03] [-4.14511325e-03 -9.72619598e-04 -1.15593804e-03] [ 2.97541475e-03 1.86579952e-03 1.59422960e-03] [-2.16223868e-04 -5.61874934e-03 2.89491344e-03] [ 4.93523070e-03 -4.42814435e-03 5.76737060e-03] [ 7.74518039e-05 -1.55669382e-03 -2.24354346e-03] [ 1.63378784e-03 1.97176212e-03 3.48565714e-03] [-5.08954157e-03 3.52881256e-03 3.35103639e-03] [ 1.53133849e-03 -4.63530852e-04 4.69576579e-05] [-1.42480379e-03 4.58504401e-03 2.71399276e-03] [ 3.76410117e-03 4.39839054e-04 -1.19251070e-03] [-9.91440943e-05 4.04853830e-03 -4.06054518e-04] [-1.95857488e-03 -1.01258469e-04 -2.17216745e-03] [ 3.31647250e-03 -2.28843736e-03 -2.28951325e-03] [-2.05234738e-04 2.04661509e-03 -3.59347257e-04] [ 1.75923827e-03 -1.87434910e-03 -6.16480390e-04] [-4.26238287e-03 -4.05170714e-06 -8.90187824e-04]] Final stress: [-8.45303114e-03 -1.41319891e-02 -1.69444749e-03 5.10177878e-06 -1.65418444e-03 -1.28238133e-05] Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.17859311e-05 5.69119170e-06 -3.34587062e-04] [ 3.95369583e-05 -8.19710879e-04 1.31499726e-03] [-6.44554415e-04 6.31900059e-04 -7.37919554e-04] [ 2.46529616e-04 -3.32201308e-04 1.06447807e-03] [ 1.72992990e-04 1.74341822e-03 -3.96338143e-04] [ 3.08573568e-04 3.45731936e-04 3.02207432e-04] [ 7.32752510e-03 4.72357173e-03 2.39998757e-04] [ 1.32255774e-03 -2.61821858e-04 1.07127769e-03] [-3.71768776e-03 -3.14964548e-03 9.76049074e-04] [-5.13347243e-05 -7.45840112e-04 -6.48194068e-05] [ 1.76083166e-03 4.87918835e-04 -1.29442329e-03] [-2.29762052e-03 4.07406627e-03 1.57840804e-03] [ 7.49410235e-04 -1.03171158e-03 -2.60051110e-04] [-1.19333821e-03 8.41253884e-04 -5.96172139e-04] [ 1.22906143e-03 -1.09408278e-04 1.23988336e-04] [-7.00895062e-05 -9.27059009e-04 -4.44666777e-04] [-5.44885699e-04 1.08482981e-03 -5.05066732e-04] [-5.09493376e-04 -9.23514744e-04 -9.66094139e-04] [ 1.46445693e-03 5.76624800e-03 -5.87961783e-04] [-2.34040908e-03 -4.88910735e-03 -1.17560283e-04] [-4.04706487e-03 -5.00267298e-04 1.25694363e-03] [ 1.82890706e-03 -3.86997266e-03 -7.54588812e-04] [-2.25655475e-03 1.75768601e-03 -8.79957645e-04] [-4.50375811e-04 -2.48975553e-03 -1.43489239e-04] [-6.73389022e-05 2.83134699e-04 2.09008173e-04] [ 1.17650909e-05 1.09297538e-03 2.62375063e-04] [ 1.21357987e-03 -7.10376476e-05 -6.85248533e-04] [ 2.56691705e-04 -1.32535373e-03 -1.01949541e-03] [-7.58095618e-04 5.73851604e-04 -3.96457689e-04] [ 4.84151312e-04 -1.25104602e-04 -3.28710801e-04] [-7.48533767e-04 6.98465059e-04 -4.24686821e-04] [ 1.48079527e-03 2.77586792e-04 1.17126379e-03] [-1.56211829e-03 -1.08508137e-03 9.83034263e-05] [ 1.09335555e-03 5.94913097e-04 -7.75207269e-04] [ 9.29970841e-05 -6.93508084e-04 1.17028533e-03] [ 1.53990207e-04 -1.63314103e-03 8.73918554e-04]] Final stress: [0.02845028 0.03031671 0.0166037 0.00223157 0.00043452 0.0008766 ] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-3.25061707e-02 5.19621266e-03 1.79742970e-02] [-8.00402728e-02 -4.91815982e-02 -6.87186268e-02] [ 5.72905771e-03 1.27356788e-01 -1.19631646e-01] [-8.39749220e-03 -5.40518897e-02 2.94712348e-02] [ 6.90764740e-02 2.05794782e-01 8.55053231e-02] [ 6.30691123e-02 4.88595568e-02 4.59483989e-02] [ 1.51663490e+00 1.33487425e+00 1.37808578e-01] [-1.94242780e+00 6.32318636e-01 1.80567619e-01] [-1.05878280e-01 -2.34919782e-01 -1.53968272e-01] [ 1.16672861e-01 2.19125089e-01 -2.01195701e-01] [-3.44916634e-01 -1.89845089e-02 -1.30491772e-01] [-2.47956303e-02 -1.23958968e-01 -1.30706708e-01] [-7.76439402e-02 -3.09912479e-02 1.45799838e-02] [ 4.48080437e-02 1.22868977e-01 7.33474229e-04] [ 1.58773877e-01 -2.45446577e-02 -5.08883198e-02] [ 1.46988609e-01 1.10227888e-02 9.93985808e-03] [-7.18838397e-02 2.79830055e-02 -9.03105625e-02] [-1.07736333e-01 -5.58085162e-02 -1.74038891e-01] [ 9.00862044e-01 -7.68071566e-01 1.85178550e-02] [-1.09924131e+00 2.81622037e-01 3.38006326e-02] [ 7.24438640e-01 -1.09528511e+00 -8.83075126e-02] [-7.78410079e-01 5.92087706e-01 -1.78357793e-02] [ 1.06536985e-02 -1.24387504e+00 -1.91413638e-02] [ 7.48962804e-01 5.39541353e-01 7.38122771e-02] [ 5.49850391e-02 -6.29473643e-02 7.27696164e-02] [ 1.17673683e-01 -3.15070849e-02 5.58374536e-02] [-4.46491234e-02 -6.66437644e-02 -2.22799486e-02] [ 3.02217751e-02 4.96323226e-02 1.34682065e-01] [ 6.81375772e-02 -1.20898801e-02 5.02187417e-02] [-4.84893560e-02 -1.06815465e-01 -1.40775565e-02] [-9.85579872e-02 -4.82265069e-02 1.45897274e-02] [ 6.94622724e-02 -2.79140015e-02 1.26281335e-01] [-1.33999792e-02 -3.93959161e-02 9.50602157e-02] [ 3.38295393e-02 -8.00171286e-02 -4.94458643e-02] [-5.24666519e-03 -3.57640843e-02 5.93686318e-02] [ 3.24088196e-03 1.27105771e-02 7.35712081e-02]] Final stress: [ 0.02553495 0.03166742 0.00777998 -0.0026728 0.00066402 -0.00286913] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-0.02116322 -0.01205761 0.00527789] [-0.00938758 0.00310175 -0.00122348] [-0.0008397 0.01636572 0.00177687] [ 0.00654668 -0.01235494 0.00214855] [-0.00272074 0.00660617 0.0008721 ] [ 0.03068534 0.01543965 0.0068277 ] [ 0.15032416 0.09651974 -0.0073579 ] [-0.14157664 -0.00074866 0.01473952] [-0.07983578 0.08829991 0.00678394] [-0.12865054 -0.06543252 -0.00083467] [ 0.10584051 0.0071746 -0.01706203] [ 0.05849016 -0.07638756 -0.01155306] [ 0.01049703 0.01765725 0.00141283] [ 0.0035959 -0.00805192 -0.01174268] [-0.02052551 -0.00152014 -0.03329735] [-0.01986818 -0.0190295 -0.00190234] [-0.00030816 -0.00422731 0.01561927] [ 0.02541241 0.00980311 0.02007074] [ 0.01687353 0.02378261 -0.00125104] [ 0.01869524 -0.17129833 0.00499146] [ 0.03155528 -0.06770151 0.00620252] [ 0.01429605 -0.02146178 0.00228122] [-0.0241345 0.16409718 0.00441504] [-0.0462356 0.05021773 -0.01346315] [-0.00626578 0.0045422 -0.0115241 ] [ 0.0203778 -0.00132336 -0.00455285] [ 0.00854971 -0.01325364 0.005657 ] [ 0.00525731 0.00962443 -0.01883342] [ 0.00361044 0.02596051 -0.00955296] [-0.00779228 0.00126883 0.01108359] [ 0.00968588 -0.01249902 0.01280875] [-0.0106804 -0.00805749 0.00375757] [-0.0053766 0.00744968 -0.00863244] [-0.00888047 -0.00411468 0.01964573] [ 0.00673659 -0.03091162 0.00596447] [ 0.0072117 -0.01747948 0.00044674]] Final stress: [-0.00510463 -0.00811505 -0.00081922 0.00243218 -0.00100224 0.00214193] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 0.00335984 -0.0005082 -0.00020946] [-0.01177566 0.00519761 -0.00186531] [ 0.00104599 0.00375182 0.00041355] [-0.0008967 0.00183556 -0.0004203 ] [ 0.00271236 -0.00545471 -0.00059903] [-0.0068258 -0.00557007 -0.00125909] [-0.01764753 -0.03521807 0.00606909] [-0.03810324 0.0092977 0.00705661] [ 0.03548234 -0.02512337 -0.00754706] [ 0.01246252 0.03069543 -0.00412002] [ 0.03785193 0.00478456 -0.00475848] [-0.02450892 0.02924822 0.00729587] [ 0.00435256 -0.00785023 -0.00143393] [-0.003699 0.01293791 -0.00266453] [-0.00378089 -0.01148178 -0.00599351] [ 0.01703854 -0.00655288 0.00341765] [-0.00178532 0.01219196 0.00270246] [-0.00950088 0.00190804 0.00573513] [ 0.02541645 0.00429906 -0.00075821] [ 0.0016607 0.04509087 -0.00354078] [ 0.00065603 -0.00347529 0.00546406] [-0.01303079 -0.01131728 -0.00109278] [-0.00877539 -0.06172945 0.00357004] [-0.00824281 0.01181448 -0.00616471] [-0.00186265 -0.00907558 -0.00870107] [-0.00357749 0.00163421 0.00364333] [ 0.0089219 -0.00474662 -0.0133476 ] [-0.00369932 0.00105737 0.00712 ] [ 0.00076124 -0.00629055 -0.00396445] [ 0.00432562 0.0019537 -0.00891681] [ 0.00246097 0.01145742 0.00760595] [ 0.001461 -0.00352977 -0.00098274] [-0.00473961 0.00529969 0.01128174] [ 0.00484429 -0.00158703 -0.00336877] [-0.00187673 0.00712627 0.00366473] [-0.00048553 -0.00207099 0.00666845]] Final stress: [-0.00399072 -0.00664901 -0.00073496 -0.00238069 -0.00075358 -0.00151588] Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-1.41315018e-02 -6.72399935e-03 2.29485643e-03] [-9.90145001e-03 -8.47738655e-03 6.92454450e-04] [-2.60758961e-02 -1.40429079e-02 -2.80203572e-03] [-1.46803681e-02 5.05112707e-03 -1.59156933e-03] [-2.18569640e-02 -3.90127566e-03 2.84834316e-03] [-1.72519852e-02 7.08269299e-04 -2.15819931e-03] [ 5.57062831e-03 -2.82847395e-02 2.20914468e-03] [ 3.16480887e-02 6.76546674e-02 1.71128340e-02] [-4.04978687e-03 -2.62548838e-02 -6.82375523e-03] [ 4.08649042e-02 -5.26404637e-03 6.57327672e-03] [-4.19847990e-02 -3.27684347e-03 -2.35881378e-03] [-5.28375223e-02 2.08699380e-02 -1.58552599e-02] [ 8.75111530e-03 -6.82380503e-03 6.61736349e-03] [-5.11310835e-04 8.68745440e-03 -6.76731832e-03] [ 9.26641432e-03 -1.51814444e-03 -6.77005606e-03] [ 2.31933388e-03 -8.23906793e-03 1.87682121e-02] [-9.08750795e-05 -1.86615338e-03 -1.09013636e-02] [ 1.25435324e-02 1.05925348e-02 6.83750032e-03] [ 1.26796593e-02 -2.38552040e-02 2.38141042e-02] [-1.10548366e-02 7.16863266e-03 -3.39096955e-02] [ 1.25852612e-02 3.01815424e-02 1.17932064e-02] [ 2.57476551e-02 9.74497597e-03 1.06428859e-02] [ 2.10908832e-02 -1.11030731e-02 -1.78044636e-02] [ 2.42802112e-02 6.55830070e-03 1.42361643e-03] [-2.52649143e-03 1.03052890e-02 -2.25148854e-02] [-1.66230778e-02 5.72844437e-03 -8.14050102e-03] [ 1.48955509e-02 -6.83894402e-03 1.06540825e-02] [ 1.90870659e-03 -1.65852774e-02 2.10572531e-02] [ 2.06935424e-03 1.14187019e-02 -1.86137227e-02] [ 1.43354483e-02 -1.48040133e-02 -1.11989791e-02] [-5.64474738e-03 -2.13714665e-02 5.52780483e-03] [-4.26799964e-03 1.12609065e-02 5.55313750e-03] [ 1.92038554e-03 1.45263026e-02 8.15110860e-03] [ 1.91782151e-02 -5.00148924e-03 2.25133208e-02] [ 3.81872800e-03 -1.10416659e-04 -7.36150321e-03] [-2.19844636e-02 -6.11394932e-03 -9.51238377e-03]] Final stress: [ 4.66726350e-03 4.33426192e-03 5.18971094e-04 -5.91076619e-05 -1.75560427e-03 -2.02445831e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-3.01438507e-03 -2.19838895e-03 4.84989373e-04] [ 4.05392975e-03 -2.34378326e-03 3.40782759e-04] [ 4.49439247e-05 2.26407137e-03 3.50934370e-04] [-3.13977217e-04 -1.96311033e-03 2.61828409e-04] [-3.72822612e-03 1.54653394e-03 4.70824739e-04] [ 2.63316162e-03 1.25551789e-03 1.83890517e-04] [ 6.37916675e-03 6.78293307e-03 2.27143600e-03] [ 1.78998789e-03 -1.10292782e-02 -1.22302549e-03] [-6.89481500e-03 6.29321513e-03 -1.32542895e-03] [-1.05701882e-02 -9.34313480e-03 -2.77213037e-03] [ 2.43755792e-03 3.43548086e-03 -5.34477277e-05] [ 4.09169117e-03 -1.86867488e-02 1.58611556e-03] [ 1.71942677e-04 -3.99956615e-03 1.17859069e-04] [-1.98925383e-03 2.15587684e-03 -6.11533868e-04] [ 2.43184478e-03 1.86522402e-03 -8.62603113e-05] [ 4.96325056e-03 2.26560992e-03 6.22661165e-06] [ 7.55979723e-04 -5.48995641e-03 1.18503178e-04] [-5.96517065e-03 3.59620753e-03 1.68438948e-04] [ 1.60053140e-03 7.36410268e-03 1.80482447e-04] [ 2.98892788e-03 -1.24517828e-02 9.27810050e-04] [-5.00688369e-03 2.65202055e-03 5.88325778e-04] [-8.32809212e-03 3.16189389e-03 1.49279930e-03] [ 1.37515490e-03 2.02559258e-02 -6.30312441e-04] [ 1.11612198e-02 1.86818692e-03 -5.32996636e-04] [-1.70138166e-03 2.34154070e-03 2.75208012e-03] [-2.52768736e-03 3.43074616e-04 -4.25849724e-03] [ 2.70858011e-03 -4.56580037e-03 -5.33613805e-03] [-4.11251308e-03 -4.08598584e-03 3.04203559e-03] [ 2.49059823e-03 2.52351912e-03 -1.89745498e-03] [ 1.50464577e-03 -6.30447623e-04 2.99295357e-03] [ 2.66854794e-03 -2.28992433e-03 -1.89106833e-03] [ 2.84145482e-03 8.73938890e-04 2.60242400e-03] [-3.90566673e-03 4.17881861e-03 5.11440229e-03] [ 2.91020285e-03 4.35809008e-03 -4.27097226e-03] [-1.55450883e-03 -2.09617829e-03 1.69094912e-03] [-2.39057087e-03 -2.07696332e-04 -2.85682514e-03]] Final stress: [-5.73910449e-03 -5.57322313e-03 -7.70164521e-04 4.37489607e-06 1.63198433e-03 2.13515582e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-2.67650079e-03 -1.27021343e-02 8.61448839e-04] [-1.93279041e-03 -2.43221186e-03 -3.06645618e-05] [ 4.08256917e-03 2.22131892e-03 1.97676466e-04] [-5.64076458e-03 -1.73855450e-03 2.09873341e-04] [-5.72450480e-03 -8.30229141e-03 1.81044859e-04] [ 8.09667884e-03 3.66468277e-03 1.59445035e-03] [-1.35808813e-02 -2.50840448e-02 -7.49546302e-03] [ 7.87489429e-03 -7.25295343e-03 4.90003493e-03] [-1.82294099e-03 -3.17876896e-03 4.80561460e-04] [-9.33738690e-03 -1.94821000e-02 -9.87882838e-03] [-8.05021012e-03 1.77683894e-04 -4.50585349e-03] [ 7.66669444e-03 -5.37019765e-03 1.20157857e-02] [ 1.67986345e-03 -8.74053650e-03 8.08103908e-04] [-6.94627516e-03 -2.34930020e-03 -3.73741407e-03] [ 5.41348384e-03 5.63469657e-03 6.38807196e-04] [ 6.35854833e-04 3.13566083e-05 -6.14499415e-03] [ 1.50178999e-03 2.73307553e-03 1.02003879e-03] [-7.70468230e-04 8.67274314e-04 4.26996849e-03] [-7.38870459e-03 8.40692664e-03 1.40660012e-03] [ 6.93336068e-03 1.12306505e-03 -6.37237850e-04] [ 2.87674559e-03 1.75782205e-02 -3.93993202e-04] [ 2.97392012e-03 -1.03057121e-02 -4.61454161e-03] [ 4.56118187e-03 1.43607883e-02 -1.75592719e-03] [ 1.01363363e-02 -5.54590373e-03 6.09741670e-03] [-1.60790445e-03 6.10776386e-03 -2.26207918e-03] [ 8.84480052e-03 -2.91944959e-03 -4.23592163e-03] [ 2.64506910e-03 4.13250598e-03 8.15215988e-03] [-4.96822195e-04 4.57011264e-03 -1.88662310e-03] [ 5.23424662e-03 9.61113862e-03 -6.02260298e-03] [-9.86199008e-03 -2.39857483e-03 7.18860776e-03] [ 8.77351294e-03 6.19247726e-03 4.98012271e-03] [-3.49241533e-03 1.05583682e-02 -5.50904553e-03] [-8.87120667e-04 2.08726700e-03 1.99392692e-03] [-1.91693768e-03 3.15691469e-03 -3.59246674e-03] [-9.73543942e-03 5.59252120e-03 2.20183792e-03] [ 1.93905511e-03 8.99457530e-03 3.50519035e-03]] Final stress: [-2.65296856e-03 -8.99880501e-03 -8.72543456e-04 2.72990474e-05 -3.19171878e-03 -3.94922794e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.13675997e-02 1.11691946e-03 8.11495869e-03] [ 5.70750112e-03 -2.93783184e-03 1.39785606e-03] [-6.18923874e-04 1.41229342e-03 5.27065642e-03] [-2.62616431e-03 -1.32165150e-02 -1.62613884e-03] [-2.38082509e-03 7.83804669e-04 -3.13977581e-03] [-7.04313401e-03 -2.04954454e-03 -9.97463909e-03] [ 1.06538832e-02 2.48364058e-02 5.15805830e-03] [-1.43661871e-02 -1.41089212e-02 -2.51325284e-03] [-2.22757272e-02 1.89139606e-02 -8.34292457e-03] [-4.80462610e-02 -7.21233448e-02 1.87369043e-03] [ 2.53956627e-02 4.56349921e-03 -1.05815742e-02] [-4.74151056e-03 1.05273443e-02 -2.85319426e-03] [ 1.35980331e-02 2.01623699e-03 4.77540738e-03] [ 6.73177860e-03 8.62433447e-03 -1.07891305e-02] [ 4.47330275e-03 1.04445276e-02 5.94023942e-03] [ 7.35258163e-03 6.62752103e-03 6.00747965e-05] [ 1.66112924e-03 -1.50341448e-04 -1.00465658e-03] [ 1.11077818e-02 -3.69613025e-03 7.22662367e-03] [ 7.21584282e-02 -5.59860664e-02 3.25803779e-03] [-2.61539124e-02 1.40958360e-02 3.74415048e-03] [-3.88462811e-02 1.79528473e-03 -5.81699731e-03] [-5.64652995e-02 -1.33335033e-02 1.18112221e-02] [ 3.52425382e-02 -6.72283332e-03 -9.75467556e-05] [ 2.40420739e-02 6.64011263e-02 6.95738651e-03] [ 2.02236263e-03 -6.13043021e-03 -9.92592887e-03] [-1.75770507e-03 6.01138183e-03 1.02388973e-02] [-5.42853807e-03 1.42546576e-03 -9.34287930e-03] [-6.00729713e-04 6.21119764e-03 1.52435419e-03] [ 8.03884584e-04 8.55235404e-03 -2.58979450e-03] [-3.82577927e-03 3.81603673e-03 -1.57299004e-02] [ 7.41717231e-03 4.34028870e-03 7.54228966e-03] [ 3.90892668e-03 -7.80101606e-03 9.36096375e-03] [ 5.65414593e-03 1.77004943e-02 -1.01296320e-02] [ 2.28810036e-02 1.13173888e-03 -6.05827355e-03] [-1.72977510e-02 -8.92545290e-03 1.34975110e-03] [ 3.03013876e-03 -1.41661211e-02 1.49116214e-02]] Final stress: [0.02895441 0.03092899 0.01616046 0.00090466 0.00043015 0.00176017] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.0064376 -0.00724249 0.01540782] [ 0.00464799 0.0131278 -0.00228938] [ 0.04974139 -0.0188432 -0.01161884] [ 0.00056506 -0.00056758 -0.02782138] [ 0.00078266 -0.00648179 -0.00188995] [ 0.00870014 -0.0013346 -0.01352885] [ 0.01009193 0.03831228 -0.00307978] [-0.02698168 0.06092837 -0.00533461] [ 0.17640083 -0.12291699 -0.02614575] [-0.11266244 -0.03679749 0.02718951] [-0.1495368 0.07867394 -0.01954114] [-0.01515499 0.06967635 0.01761695] [-0.00548845 0.0073635 -0.00867705] [-0.00816045 0.01029281 -0.00561162] [ 0.00971343 -0.00777986 -0.00036235] [-0.01697565 0.00334062 0.005387 ] [-0.01480737 0.00069926 -0.00420423] [ 0.00352491 -0.01591678 0.01894849] [-0.17448139 0.06766089 0.06403277] [-0.05204207 0.00914453 0.00481788] [ 0.04743034 -0.04129739 0.00135301] [ 0.08802797 -0.00883567 0.03112371] [ 0.06016723 -0.12075979 -0.00515086] [ 0.12495294 0.00181506 -0.03423795] [ 0.00299173 0.01169624 -0.01685974] [-0.00414253 0.00644574 0.01364994] [-0.00272059 0.00232802 0.01002756] [-0.00246731 0.02891275 0.00420884] [-0.02145473 0.00162202 -0.01355058] [ 0.01749072 0.00536666 -0.00977677] [-0.0142524 0.0153535 0.01422045] [ 0.02705711 0.0037146 -0.00194189] [ 0.00949036 0.00880248 0.01131758] [ 0.00370642 -0.00224819 -0.00792312] [-0.00285692 -0.03853021 -0.00425297] [-0.02773497 -0.0157254 -0.01550273]] Final stress: [ 0.02743524 0.031125 0.01622415 -0.00077196 0.00038563 -0.00187261] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-5.72040466e-04 1.93244594e-04 2.39856967e-04] [-2.13552562e-03 1.25606402e-03 -2.44903703e-04] [-7.55779806e-05 3.32684034e-03 4.43717705e-04] [ 5.11834513e-05 1.14151439e-03 -2.14638840e-04] [ 8.14147016e-05 6.19735884e-05 7.91155264e-05] [ 5.79627254e-03 3.39571586e-03 1.25094292e-03] [-1.54436529e-02 -2.63436242e-02 -9.91081324e-04] [-1.16555961e-02 5.95774129e-04 -9.34489711e-04] [ 1.58052322e-02 -1.30017905e-02 1.28283951e-03] [ 1.68519487e-02 2.54212774e-02 6.05080313e-04] [ 7.26270942e-03 3.19937839e-04 6.11553827e-04] [-8.90773356e-03 6.39594508e-03 -1.28991676e-03] [-8.38013087e-04 -5.36338652e-03 -1.24039264e-03] [-8.43112301e-04 3.30750572e-03 -1.87536918e-03] [ 3.62572030e-03 -2.95866000e-03 2.93274972e-03] [-2.75981778e-03 -2.32717855e-03 1.38539307e-03] [-3.66298029e-03 1.21739380e-03 1.35537841e-03] [ 3.75670420e-03 4.22906618e-03 -3.09813440e-03] [-5.86305025e-03 3.57703213e-03 3.26252338e-03] [-1.29997809e-03 2.24271390e-02 8.56240539e-04] [ 1.60587997e-02 1.10562703e-02 -3.76821643e-03] [ 3.76364529e-03 -5.84358457e-04 -3.03371423e-03] [-4.70496078e-03 -2.43085647e-02 -7.72301971e-04] [-1.24828021e-02 -8.51852548e-03 3.71421882e-03] [-2.96329367e-04 -1.15353870e-03 1.06610031e-03] [-6.27442992e-04 1.61082716e-03 -2.62465208e-03] [ 1.87111204e-03 2.93985615e-03 8.69246292e-04] [ 1.16851402e-03 -1.31770610e-03 1.19206428e-03] [ 1.32658892e-03 -9.68500407e-04 -1.11400296e-03] [-8.15378701e-04 -3.98581431e-03 3.92105329e-04] [ 3.14984855e-04 2.74966387e-04 -1.10379316e-03] [ 2.46217720e-04 -2.16340752e-03 2.66812338e-03] [-3.17062093e-03 -3.88756670e-03 -1.24406022e-03] [-1.56361142e-03 7.86097921e-04 -8.69157649e-04] [-8.01518104e-04 8.23555019e-05 1.50639675e-03] [ 5.38694771e-04 3.26582463e-03 -1.29482181e-03]] Final stress: [-0.00418096 -0.00690156 -0.00083116 0.00159333 -0.00075184 0.00290223] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-5.76703666e-04 8.26544664e-04 9.23565923e-05] [ 5.63271354e-03 -3.70644442e-03 1.26406300e-03] [-5.16908787e-04 -1.19894223e-03 -2.10000902e-04] [ 5.81141149e-04 -3.00591408e-03 4.45825671e-04] [-1.02258593e-03 7.12131641e-04 3.54008583e-04] [-2.11606794e-03 -1.17178737e-03 -2.65179510e-04] [ 2.17713756e-03 -3.26443666e-03 4.51392546e-03] [ 1.27220533e-03 1.17555066e-03 -2.27486149e-03] [ 1.26536192e-02 -1.45284150e-02 -3.44713950e-03] [ 3.84475776e-03 1.74984745e-02 -2.67938029e-03] [-9.89464693e-03 -5.36728362e-03 1.71800446e-03] [ 1.75836222e-03 1.19101163e-02 1.69249142e-03] [-2.63509142e-03 -5.68008981e-03 -4.24357711e-03] [-8.60681347e-03 -6.51159233e-03 1.50846533e-03] [ 8.34014569e-03 1.04725997e-02 3.95056444e-03] [ 2.07057193e-03 4.13101393e-03 4.79896542e-03] [ 5.83073696e-03 5.11762558e-03 -2.33155410e-03] [-5.88359296e-03 -6.40218841e-03 -4.80919938e-03] [ 2.09321548e-03 1.57060841e-02 4.49961543e-03] [-6.49265965e-04 9.69280187e-03 -2.02935938e-04] [-1.28686366e-02 -3.55176143e-06 -3.60462264e-03] [-4.05403480e-03 -3.53450453e-03 -4.00098129e-03] [-3.96923762e-03 -1.69997122e-02 2.09079179e-04] [ 7.69730068e-03 -5.99867352e-03 3.49133513e-03] [-3.05268168e-03 -1.57184282e-03 2.61403175e-03] [-1.16067996e-03 -4.36865717e-03 2.63743897e-03] [-1.37884399e-03 -3.64090240e-03 -6.30918999e-03] [-2.53164234e-03 5.00953706e-03 2.27235012e-03] [ 4.26192325e-04 -1.04660484e-03 1.33854347e-03] [ 2.27483539e-03 -1.12900233e-04 -5.27064813e-04] [ 3.49889642e-03 1.29451898e-03 -2.50438208e-03] [ 7.48533162e-06 4.58718791e-03 -1.81734333e-03] [ 8.25987997e-04 3.69177007e-03 5.21362433e-03] [ 1.33289754e-03 -4.02829887e-03 -1.96143151e-03] [ 4.58257178e-04 5.06092969e-04 -7.02535172e-04] [-1.85902566e-03 -1.89307649e-04 -7.23309715e-04]] Final stress: [-0.0040506 -0.00704776 -0.00083809 -0.00159048 -0.00071501 -0.00290593] Minimization converged after 14 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-4.85802379e-04 -3.39523430e-04 1.25987000e-04] [-1.99846354e-03 1.09154755e-03 -3.03422324e-04] [-1.07839307e-04 -3.95770356e-03 -5.45184928e-04] [-4.01308375e-04 3.22401333e-03 -6.82261814e-04] [ 8.23623059e-04 -9.21361476e-04 -1.98178462e-04] [-8.23272652e-04 -6.23411888e-04 -2.07449490e-04] [-2.15264323e-03 2.24510451e-03 8.70535338e-04] [ 5.63855581e-03 -1.89974685e-04 -2.06729488e-04] [-4.54729077e-04 -2.89655677e-03 9.32515802e-04] [ 2.46545129e-03 -3.26430040e-03 -1.20016331e-03] [-4.43314708e-03 4.54754431e-04 2.24094622e-04] [ 1.18501710e-03 5.38241994e-03 3.60854042e-04] [ 4.07565040e-04 -1.51717547e-03 1.85479611e-03] [ 2.03870193e-04 1.41497299e-04 1.23078517e-03] [-3.31896957e-04 1.42345821e-04 2.12925091e-03] [-7.59713233e-05 2.47712129e-03 -1.37092880e-03] [-5.57822949e-04 -3.30658970e-04 -1.59741925e-03] [ 1.25881709e-03 -5.73956347e-04 -1.28000002e-03] [ 6.61449621e-04 -7.29788393e-04 4.10745291e-03] [-7.25547920e-04 3.44364867e-03 1.83885342e-03] [ 1.05263821e-03 -1.74764630e-03 1.58828190e-03] [-5.14283725e-04 -1.13646474e-03 -3.44798793e-03] [ 1.02668085e-03 -3.96387867e-03 -3.11235830e-03] [-1.11749899e-03 2.22227916e-03 -1.32750116e-03] [-2.88150013e-04 2.38702939e-03 3.32912417e-04] [-3.20124759e-04 6.62391799e-04 -1.10591333e-03] [ 9.36846829e-04 6.13442202e-05 7.51042266e-04] [ 3.18799338e-04 2.04946398e-03 -2.82746555e-03] [-4.11505131e-04 -1.92108868e-04 -1.04192893e-03] [-1.27265814e-03 1.28881961e-03 5.24882083e-04] [-2.66321211e-04 -1.88698727e-03 -2.63222593e-04] [ 6.44116953e-05 -6.46940272e-04 2.45599578e-04] [-3.62339647e-04 5.45706282e-04 9.26699033e-05] [ 1.52545242e-04 -3.02464133e-03 2.72531959e-03] [ 1.85290728e-04 7.24821853e-04 8.13899194e-04] [ 7.19764319e-04 -6.01230273e-04 -3.16165712e-05]] Final stress: [ 5.52637252e-04 6.25275781e-04 1.13176981e-02 2.52598225e-03 -6.62517047e-06 1.45896449e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-0.00761584 -0.00062089 0.00100354] [-0.00346334 0.00649618 -0.00134621] [ 0.00040266 0.01768136 0.00331893] [ 0.00253695 -0.01302933 0.00182829] [ 0.01322156 -0.00321381 -0.00306739] [ 0.01164281 0.00728816 0.00176691] [ 0.0064883 0.00243699 0.01561842] [-0.02242044 0.00737515 0.00771204] [-0.00105066 0.02266011 0.00145707] [-0.00279043 -0.00429339 -0.01203129] [ 0.01962918 -0.00591544 -0.00863667] [ 0.01400121 -0.01300364 -0.00424761] [ 0.0050437 -0.00480333 -0.00947174] [-0.0068344 -0.00084642 -0.00856756] [-0.00131022 -0.00508483 -0.00444961] [ 0.01532856 -0.00145161 0.00777153] [ 0.00536553 -0.00017916 0.00913221] [-0.0214781 0.00749361 0.00511038] [ 0.0036423 -0.00922727 -0.00358693] [-0.00423722 -0.01459442 -0.00310745] [-0.00095546 0.00294911 -0.00738031] [-0.0081063 0.00708988 -0.00012755] [ 0.00384658 0.01877164 0.00422827] [-0.00664922 -0.01320421 0.0128548 ] [-0.00782492 -0.01182655 -0.0058176 ] [ 0.01479579 0.00531077 -0.00820391] [-0.00876335 0.02068957 -0.0039657 ] [-0.01406461 -0.01196668 -0.00343958] [ 0.00101525 0.00824017 -0.00585307] [ 0.00917346 -0.01150988 -0.01048851] [ 0.00738121 0.00991854 0.00407703] [-0.01839178 -0.00444268 0.01223221] [ 0.00321802 -0.02028263 -0.00117375] [ 0.01303773 0.01058817 0.00346759] [-0.00336611 -0.01061337 0.00927966] [-0.0104484 0.00512013 0.00410359]] Final stress: [ 3.41179004e-04 4.24002044e-04 1.12393606e-02 -2.55029725e-03 1.54155300e-05 -1.41979901e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 4.17538852e-02 3.32677122e-02 -1.21819795e-02] [-6.38647509e-03 -2.40834293e-02 -2.04812488e-04] [-6.32416753e-04 1.07002449e-02 -9.68171620e-04] [ 8.10576577e-03 -4.15043909e-02 9.05042831e-03] [ 2.49930432e-02 1.58410930e-02 -5.71088642e-06] [ 9.25139390e-04 -9.73121585e-03 1.64346214e-03] [-6.69743629e-02 4.80286051e-02 -1.01227481e-02] [-7.04206364e-02 -7.08166332e-02 8.93790521e-03] [ 6.05722313e-02 9.87657044e-02 4.48686038e-03] [-7.06387023e-03 5.44290183e-02 1.78462420e-02] [ 2.10795205e-02 1.08162539e-02 -2.90580851e-03] [ 1.90095321e-02 -8.50498111e-02 -1.40450954e-02] [ 1.80343193e-02 -2.42603448e-02 2.77834064e-03] [-1.52958602e-01 -2.15983577e-01 1.19788180e-02] [ 1.49533623e-01 2.44957827e-01 -1.50602846e-02] [ 1.59614087e-02 1.43326817e-02 8.05736858e-03] [ 2.04192075e-01 2.79222617e-01 4.07653287e-03] [-2.02150748e-01 -3.27392965e-01 -1.13245154e-02] [ 3.79565854e-02 2.74716183e-04 1.73044168e-02] [-1.67963514e-02 -2.84464328e-02 1.00609236e-02] [ 5.73607010e-03 3.00274848e-02 -2.45668420e-02] [-4.49750212e-02 4.64499440e-02 -2.33000861e-03] [-4.16025221e-02 2.54524877e-02 1.25355480e-02] [-2.96210867e-02 -1.03348747e-02 -9.58656538e-03] [-7.62941520e-04 1.35169418e-02 2.26874208e-02] [-1.42528662e-02 -1.51135351e-02 -2.41400562e-02] [ 4.24757473e-03 -2.31644437e-02 -7.61028345e-03] [-1.46170701e-02 -2.33330836e-02 -1.70608176e-03] [-5.65906787e-04 3.59211987e-03 -7.84832183e-03] [ 1.66813933e-02 -7.70941476e-03 1.59865368e-02] [ 7.69926299e-03 1.42242683e-03 2.90663126e-03] [ 1.16376479e-02 -2.20152304e-03 7.37730100e-03] [ 4.83542986e-03 -1.19787552e-02 -1.30313326e-02] [-4.43886614e-04 -9.94860630e-03 -1.82046687e-02] [ 9.38803538e-03 -5.83010845e-03 1.36979826e-02] [ 7.88222078e-03 5.78526611e-03 4.43056813e-03]] Final stress: [-0.00094004 -0.00228881 -0.01145081 0.00231538 0.00019027 0.00047702] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.55585497e-06 -3.17817229e-03 3.02924559e-04] [ 1.11780903e-02 -9.58768504e-03 2.59945245e-03] [ 1.67213226e-04 9.29785165e-03 1.63823231e-03] [-5.20765131e-03 -1.32883709e-02 1.61142756e-03] [-1.08020710e-02 4.10416523e-03 2.32461301e-03] [-7.77464758e-04 3.71073428e-03 5.40269472e-04] [-1.89230284e-02 -1.99290526e-02 -8.43086438e-03] [ 8.35266125e-02 -8.30037445e-03 3.21745492e-04] [-1.08084316e-02 2.59513264e-02 1.00591756e-02] [ 2.62267311e-02 1.81079419e-02 -4.01406721e-03] [-4.53319034e-03 -2.00541945e-03 8.51422500e-03] [-2.88366680e-02 1.88382448e-02 -1.25351485e-02] [ 5.83994824e-03 -1.54681499e-02 1.41315705e-03] [-9.49119658e-03 -2.70834357e-03 -5.76963253e-03] [-5.46612830e-03 -2.11241298e-04 5.25576671e-03] [-9.66904404e-03 1.38675650e-02 -5.23260630e-03] [ 4.79755848e-03 -1.64082514e-02 7.21336605e-03] [ 1.70269242e-02 1.93866030e-02 -7.03172502e-03] [-3.33287635e-02 -4.58808159e-02 -8.28867735e-04] [-3.89620903e-03 -1.38271689e-03 -4.90246224e-03] [-1.74144387e-02 1.92093491e-02 -5.74238764e-03] [ 5.72739321e-03 2.90368839e-02 4.65365267e-04] [ 1.89070897e-02 -2.36300736e-02 6.10896266e-03] [-3.59236286e-02 -2.34444193e-02 6.40574440e-03] [-3.93486351e-03 2.43147948e-03 -2.90084172e-03] [ 6.62859980e-03 6.45855600e-03 -2.66980338e-03] [ 3.95399411e-03 -2.73438571e-04 8.39534438e-03] [-1.06474695e-02 1.03434709e-02 -3.40317037e-03] [-2.71729756e-04 3.79488427e-03 -5.48534492e-03] [-2.93565067e-03 -2.21776599e-03 1.29087608e-02] [ 1.09941731e-02 -1.30129980e-03 -3.43809383e-03] [ 9.01504438e-04 -1.83309690e-04 4.93353315e-04] [-2.79670905e-04 -2.44987454e-03 -7.21978995e-04] [ 1.14339280e-02 -3.26911436e-03 5.99620022e-03] [ 3.35528490e-03 5.03295992e-03 -3.07850364e-03] [ 2.48380912e-03 5.54587373e-03 -6.38258795e-03]] Final stress: [-1.00675787e-03 -6.09537840e-04 -1.14910292e-02 -2.33750901e-03 -1.68204440e-05 -1.89381528e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 3.82290851e-04 1.61506907e-03 -1.77405624e-04] [ 5.68862664e-03 -7.36245914e-05 4.88757622e-04] [-4.67230913e-04 -9.12406652e-04 -2.26326017e-04] [ 9.08210761e-04 -2.65663173e-03 5.89803985e-04] [-2.59433333e-03 3.35657590e-03 6.09846424e-04] [-3.54802554e-03 9.98433652e-04 -2.56040482e-04] [ 2.40921997e-03 9.44956807e-04 8.76193895e-10] [-5.33513443e-04 -6.97047971e-04 -3.41851264e-04] [-1.46204423e-03 7.73878665e-03 -3.24820768e-04] [ 6.96311524e-04 -3.69372519e-03 5.47025964e-04] [-5.98322310e-03 -1.53181916e-03 7.37429135e-04] [ 5.43069759e-03 3.92717372e-03 -6.40285090e-04] [ 1.77504716e-03 -1.59450368e-04 -1.48342453e-03] [ 1.10238306e-03 -2.90121678e-03 1.57462881e-03] [-2.59447206e-03 5.87499004e-04 2.69396836e-03] [-4.86191463e-03 6.48375651e-05 -1.52000875e-03] [-3.39773883e-04 -8.63251599e-04 -1.19018235e-03] [ 4.87687600e-03 -4.82380788e-04 -2.19206916e-04] [-1.16508935e-03 2.81421561e-03 4.50484236e-04] [ 6.73045843e-03 -5.35761970e-03 1.19934754e-03] [-5.02508867e-03 -8.07244730e-03 2.50274285e-03] [-1.24812852e-03 -4.70332170e-03 -5.95327329e-03] [-3.63149921e-03 -3.29166940e-03 -2.95180806e-04] [ 3.02290495e-03 1.62210861e-03 2.61780619e-03] [ 3.01898295e-03 1.73466047e-03 -2.82697121e-03] [ 2.46147511e-03 1.50715704e-03 8.67407464e-05] [ 1.87745550e-03 -2.66065944e-03 6.07507098e-04] [-1.07105206e-03 -7.25183133e-04 -1.43923891e-03] [-2.14021012e-03 -5.54901943e-04 2.57696338e-03] [-4.37758422e-03 1.88612329e-03 -3.96297544e-04] [ 2.17340761e-03 -7.29553946e-04 5.56500316e-04] [-1.32128305e-03 -9.15494920e-05 2.23456872e-03] [-3.47193625e-03 5.19942243e-03 2.55448040e-04] [ 1.38876646e-03 4.14091992e-03 -2.05859033e-04] [-1.60291656e-03 2.11807959e-03 -1.14261211e-03] [ 3.49620456e-03 -9.75584150e-05 -1.69058559e-03]] Final stress: [-9.13994142e-04 2.09012640e-03 1.13337144e-02 -6.87878774e-06 2.52545591e-03 5.75209529e-05] Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-1.30709818e-01 -1.20445807e-01 2.78030370e-02] [-1.41577220e-01 -1.61273056e-01 -7.06662215e-03] [-2.81326272e-01 -1.99906181e-01 -3.97117554e-02] [-1.85549100e-01 2.54054133e-01 -4.89827287e-02] [-1.26179972e-01 6.12465161e-02 2.77270221e-02] [-1.28935036e-01 2.07137058e-01 -3.61972586e-03] [-2.11187261e-01 -7.02743202e-02 -2.35083561e-01] [ 2.56678677e-01 -1.14988410e-01 1.82440873e-01] [ 3.22075865e-02 1.81523169e-01 5.38779498e-02] [ 2.49782714e-01 1.53159914e-01 2.53998300e-02] [ 1.81111435e-01 -2.52524565e-01 2.26651879e-01] [ 3.90494186e-01 -2.44296874e-01 -2.25763720e-01] [-4.89117307e-01 -1.43170094e-01 -6.64037292e-02] [ 7.47549419e-02 -1.37862053e-01 -1.84424175e-02] [ 7.89970991e-01 -1.07872412e-01 8.80431513e-02] [ 6.96780784e-01 1.28704107e-01 5.67181928e-02] [ 5.84324657e-02 1.29809540e-01 -2.66078552e-02] [-4.64165085e-01 1.37171477e-01 -4.82307030e-02] [-2.65623521e-03 -2.61984498e-01 4.25665301e-02] [ 2.03416706e-01 2.23458421e-01 -1.32030908e-01] [-4.55810520e-02 -1.93049259e-01 8.57921247e-02] [-5.36548483e-01 1.17519229e-01 9.80242011e-02] [-5.14429429e-01 1.53203764e-01 -1.35786135e-01] [ 2.31006892e-01 2.49162554e-01 3.13615819e-02] [ 1.19336764e-01 1.31472988e-01 -1.75407410e-01] [-2.53952172e-01 -9.95493365e-02 3.96186442e-02] [ 2.88679784e-02 5.63938818e-02 1.53498821e-01] [ 3.35118824e-02 -2.11213242e-01 1.62203612e-01] [-1.50781332e-02 2.45658536e-01 -5.14401035e-02] [-7.75227349e-03 -1.26874658e-01 -8.48121999e-02] [ 7.99519948e-02 -1.51370108e-01 -6.14867953e-04] [-9.49879874e-04 8.48052923e-02 -1.37395153e-01] [ 9.05257235e-02 1.44389349e-01 1.93482352e-01] [ 2.56716996e-02 -1.19597633e-01 1.07101515e-01] [ 1.18806941e-01 -4.54120893e-02 -2.20073845e-01] [-1.25615634e-01 1.02794668e-01 5.51621227e-02]] Final stress: [-0.00306706 0.00447179 -0.01187785 0.00014844 0.00181739 0.00173181] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-2.58643085e-03 5.19637664e-03 -6.54496173e-04] [ 7.62883439e-03 -2.16045359e-03 2.33427551e-03] [ 1.67973467e-03 -1.75768601e-03 5.69438406e-05] [ 1.69338084e-03 -2.55309251e-03 -2.38446229e-05] [ 2.00862260e-03 7.95492991e-03 8.83554882e-04] [-6.09157433e-03 -4.54370637e-03 -2.28333415e-03] [-2.37020751e-02 1.75439384e-02 8.64142702e-03] [ 2.82478494e-03 -2.03696548e-02 -4.05015861e-03] [ 3.42418389e-02 -1.23488017e-02 -4.88142840e-03] [ 4.65319948e-02 -5.62459921e-03 5.20402312e-03] [-1.24535750e-02 2.83505168e-02 4.73450382e-03] [-4.75133661e-02 3.78260575e-03 -9.47173375e-03] [ 5.24041392e-03 -6.51199042e-03 -2.69839232e-03] [-1.97283580e-03 1.10982037e-02 3.35409111e-03] [-2.34416444e-03 -2.15294420e-03 -4.09403246e-04] [-8.32025662e-03 8.65068797e-03 2.41814804e-03] [ 1.36204525e-03 -1.19103330e-02 -1.19223971e-03] [ 7.03077137e-03 6.55429356e-03 -1.70143688e-03] [-2.97593836e-02 2.99302108e-03 2.14910274e-03] [-1.16900464e-02 1.14156520e-02 -2.28246557e-03] [ 3.80631268e-02 4.92001697e-03 -5.27393337e-04] [-1.67476638e-02 -1.75403354e-02 -7.00277117e-03] [ 8.53961036e-03 1.78941635e-02 4.41285893e-03] [ 6.10244231e-03 -3.66372932e-02 3.83525771e-03] [ 7.91011208e-04 4.97207769e-03 -2.94035367e-03] [-4.44341328e-03 -1.54916910e-03 8.27544794e-03] [ 3.40701978e-03 -7.07543515e-03 -3.51576122e-03] [-8.34192152e-03 -6.90629232e-03 1.28045923e-03] [-4.97060270e-03 2.96114936e-04 6.60218705e-03] [ 6.88312720e-03 -4.17823513e-03 -8.29798068e-03] [ 1.57257635e-03 -5.86109795e-03 -4.03386100e-03] [-1.84980239e-03 -1.16695602e-03 5.34753585e-03] [-4.11398992e-03 9.86639090e-03 -5.95711585e-03] [ 8.63945897e-03 7.94027342e-03 5.99353138e-03] [ 3.36190355e-03 4.31619884e-05 -1.23457345e-03] [-7.01596390e-04 1.37565071e-03 -2.36460437e-03]] Final stress: [ 1.01631923e-03 -2.31460969e-03 -1.14295681e-02 -4.06741405e-05 -2.36202100e-03 -1.28033150e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.86314313e-03 6.10339142e-03 -6.80771136e-03] [ 4.91381206e-03 -7.09235223e-03 -2.95451073e-03] [-1.17640808e-03 -8.21133128e-04 9.45751339e-03] [ 4.56268606e-03 1.73445716e-03 1.98399433e-03] [ 8.84834710e-04 -5.68029984e-03 3.85510466e-03] [ 2.19031055e-03 -6.94908643e-04 3.26181231e-03] [-1.42628044e-02 -3.86228708e-02 2.41640405e-03] [-1.38328101e-02 -6.55287829e-04 1.51051916e-03] [-1.45129357e-02 1.28127311e-02 7.12166627e-03] [ 2.84152400e-03 3.38551571e-02 -7.33273027e-04] [ 4.36532571e-04 -1.54269113e-02 -5.94806950e-03] [-7.23287485e-03 2.93421822e-02 -5.36306921e-03] [ 3.88506361e-03 6.47961875e-03 -3.53386328e-03] [-3.11386029e-03 6.63334588e-03 -3.44849234e-03] [-3.40265913e-03 -2.95145297e-03 -1.64609612e-03] [-4.10672687e-03 6.02171262e-03 -1.31784712e-03] [ 2.30919963e-03 -9.64283500e-04 -2.09669532e-03] [ 3.43433052e-03 4.01761343e-03 -3.97834855e-03] [ 3.06767769e-02 -3.19726931e-02 8.33788298e-05] [-9.11017781e-03 3.46875639e-02 7.39337570e-03] [ 1.61947975e-02 1.62468081e-02 1.98045709e-03] [ 5.01928759e-03 -2.74401166e-02 7.65323263e-03] [ 8.72398722e-03 1.57929444e-02 3.95141568e-03] [-1.70779945e-02 -2.64431688e-02 -2.86097101e-03] [-2.84037177e-03 -3.01270251e-05 -2.91035412e-03] [-2.50655920e-03 -4.50894820e-03 3.65095538e-03] [-3.98644805e-03 7.87423201e-04 1.83876175e-03] [ 4.54943200e-03 4.79754582e-04 -1.04968151e-03] [-4.48699779e-03 1.63678778e-04 1.26347923e-03] [ 1.08890848e-03 1.91813793e-03 -2.42849140e-03] [-1.22369900e-03 -3.08351537e-03 -1.42665974e-03] [-1.38035233e-03 4.02581376e-03 1.98621745e-03] [ 2.56120600e-03 -3.28010279e-03 -2.90414113e-03] [ 7.16330582e-03 -1.87906458e-03 8.61252894e-04] [ 1.21411835e-03 1.76518466e-04 -2.23647385e-03] [-1.25957682e-03 -9.73161602e-03 -6.62479151e-03]] Final stress: [ 2.78409701e-02 2.77845873e-02 2.63921728e-02 9.27795548e-04 -4.74369149e-05 1.64079701e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[-1.84064325e-02 -1.44062282e-02 2.80951581e-03] [-3.74205633e-02 2.12275672e-02 -6.22883874e-03] [ 2.01073181e-03 7.85580419e-03 1.30248039e-03] [ 4.46424492e-04 -2.95039997e-02 3.78767672e-03] [ 2.06333821e-02 -1.80118382e-02 -4.21039205e-03] [ 1.04565683e-02 -1.84723603e-03 3.92991666e-04] [ 3.24306968e-02 8.98575779e-02 -1.03476254e-04] [ 9.84443067e-02 2.47984073e-02 -5.32106035e-03] [ 8.64894803e-02 -2.45179164e-02 5.29284394e-02] [-1.50995149e-02 -9.85128674e-02 -2.55696110e-03] [-7.97593162e-02 -1.62089697e-03 3.50430046e-03] [-5.34521221e-02 6.62993564e-02 -4.53678638e-02] [-4.75608561e-03 1.14434167e-02 -3.75582215e-02] [-2.27571106e-02 -5.30775991e-03 -2.79341142e-02] [ 2.21499124e-02 -8.61014194e-03 -1.81187439e-02] [ 6.01532507e-02 -1.52848034e-02 5.27428194e-02] [-2.82864412e-03 -2.37341797e-02 2.69223424e-02] [-4.59092530e-02 5.47017479e-02 5.85095328e-03] [-5.25384031e-02 -2.73829412e-02 -1.04725956e-02] [-4.59233590e-02 -3.72422122e-03 -1.23235494e-02] [-1.04686162e-01 -2.39900685e-02 -5.06007455e-02] [ 3.60458216e-02 -7.09323453e-03 2.12773803e-02] [ 4.34931395e-02 4.78265085e-02 9.52551881e-03] [ 7.84298910e-02 -8.27939407e-03 3.99431775e-02] [ 1.35768045e-02 1.21273510e-02 1.02164269e-02] [-1.68048756e-02 6.79488926e-03 -3.36940402e-02] [-2.30227978e-02 1.70135393e-02 1.12075103e-03] [ 5.47923905e-04 -1.95072308e-02 -3.72801363e-02] [-1.70176030e-02 4.09984343e-02 -3.55560301e-03] [-1.67601792e-03 -9.38999881e-03 6.03936119e-03] [-2.48275695e-02 -1.02692662e-02 -1.01054816e-03] [ 9.95213070e-03 1.84288322e-03 2.75504128e-02] [ 2.96006489e-02 -2.15104369e-02 -1.03090921e-02] [-5.18264124e-03 5.98842720e-03 4.33989722e-02] [ 2.48598910e-02 -4.41899780e-02 -2.85281828e-03] [ 2.34746691e-03 7.91872755e-03 1.85280209e-04]] Final stress: [ 0.00095396 0.00033761 0.01127577 -0.00145717 -0.00011171 -0.00319152] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-4.88637644e-03 -5.12489465e-03 1.48885371e-03] [-2.33397990e-03 1.37781863e-03 -2.27364151e-04] [ 1.23738917e-03 -7.91314049e-04 -6.90624182e-05] [ 1.69519202e-03 4.57516096e-03 -8.93521615e-04] [-1.54358896e-03 7.59325577e-04 1.37340218e-04] [ 2.70823747e-03 -4.02857098e-04 4.02850869e-04] [ 6.56545618e-03 4.52751567e-03 2.85408230e-05] [-3.30165229e-03 9.69658798e-04 1.76903549e-03] [-1.30897916e-03 -2.49238222e-03 -1.12584109e-03] [-5.10049986e-03 -1.10110541e-04 5.67698005e-04] [ 8.24887945e-03 -9.58069783e-04 -3.42570353e-03] [ 1.21176586e-03 5.20542848e-04 1.68747782e-03] [ 1.55803754e-03 2.14377845e-04 -1.79172403e-03] [-1.69901965e-03 -3.13597166e-03 -8.03873314e-04] [ 1.22574624e-04 1.06455131e-04 -1.97437989e-03] [-2.75015316e-03 -4.43074024e-04 1.79258258e-03] [ 3.10321322e-03 5.66218699e-03 1.75663126e-03] [ 1.32695626e-04 -2.19741055e-03 3.03359524e-04] [-2.40797752e-04 3.53227239e-03 -1.28106898e-03] [-7.22638645e-04 -1.22823696e-04 2.53212686e-03] [-4.30543596e-03 -4.08120568e-03 -3.49976243e-03] [-3.25705932e-03 -1.14928315e-03 5.75457398e-04] [ 9.22467827e-04 1.06486980e-03 -9.71161204e-05] [ 1.75384533e-05 4.77879497e-04 1.96147225e-03] [-9.93655890e-04 -6.40707536e-04 4.24493101e-04] [ 1.50154766e-03 -1.84346732e-03 2.11550830e-03] [-8.39740105e-04 -3.81851539e-04 -5.47382419e-03] [-2.56239271e-03 -3.20631353e-03 1.33994544e-03] [-9.57675334e-06 1.33258553e-03 6.24556545e-04] [ 2.31393397e-03 -1.66356586e-03 -1.15050025e-03] [ 1.20772945e-03 8.11478052e-04 4.78035459e-04] [-8.90916228e-04 -1.15999452e-03 -9.84708589e-04] [ 1.68075424e-03 1.75445063e-04 2.83525481e-03] [ 1.50427475e-03 4.13298368e-03 -1.81540352e-03] [ 1.65539259e-03 -5.67538889e-04 -4.40303823e-04] [-6.40617333e-04 2.32279840e-04 2.23293748e-03]] Final stress: [-9.37937188e-04 -8.86235556e-04 -1.14990962e-02 1.61723387e-03 3.81287481e-05 3.07865674e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 1.14465767e-03 9.14939926e-04 -1.30348086e-04] [ 1.26250328e-03 -9.35276443e-04 1.89905581e-04] [-1.43926253e-05 6.34341306e-04 2.07721777e-04] [ 5.20437911e-05 -1.60635287e-03 2.32057905e-04] [ 4.93753697e-03 -2.52529775e-03 -1.19556183e-03] [ 5.39003113e-04 1.93734760e-04 -2.98085034e-05] [ 6.39809202e-04 1.03654535e-03 2.53955109e-04] [ 3.72209866e-03 2.89651659e-03 1.32831009e-03] [-4.18520315e-03 1.20057871e-03 1.90489912e-03] [ 1.23654670e-03 -2.75723815e-03 -1.78646999e-04] [-3.77995012e-03 1.69940681e-03 -1.17863176e-03] [-2.59163209e-04 -4.08573432e-04 -2.03283461e-03] [-2.50657353e-03 -1.28685909e-04 1.43920970e-03] [-2.00469845e-03 1.63873274e-03 -3.25130139e-04] [ 2.22490922e-03 8.80395640e-04 -2.96297635e-03] [ 8.72073701e-05 3.57058579e-04 -9.12209949e-04] [ 7.45563581e-04 -6.33963190e-04 4.42224082e-04] [-6.39814637e-04 -6.61020109e-04 2.08272298e-03] [-1.32022250e-03 -3.29948241e-03 -1.99090531e-04] [-1.45035925e-04 1.35047887e-03 1.53067133e-03] [-6.65197735e-04 -1.88627474e-03 3.61062374e-04] [ 8.21715935e-04 3.58142507e-03 -7.06958974e-05] [ 7.92079936e-04 -1.78001933e-03 -1.42321113e-03] [ 5.71682645e-04 2.77236127e-03 4.74028762e-05] [-2.62539207e-04 1.22605081e-03 -1.49473395e-03] [ 7.43844462e-04 -1.35682959e-03 1.25418820e-03] [ 1.38827325e-04 1.79889567e-03 -2.66924620e-03] [-1.22490836e-03 1.25256000e-03 -1.04530146e-03] [-9.12644007e-04 -9.65000337e-04 -3.57368431e-06] [ 1.03699580e-03 -1.53003072e-03 -2.86042215e-03] [-3.97916483e-04 -1.37218479e-03 1.55551235e-03] [-1.38653004e-03 1.91423165e-05 -8.54506038e-04] [ 1.02402464e-03 -9.20588597e-04 1.83271528e-03] [-8.06010483e-04 -5.35464006e-04 1.10705117e-03] [-1.89828727e-04 8.02567236e-05 1.18334034e-03] [-1.02042113e-03 -2.31138780e-04 2.61397899e-03]] Final stress: [-9.79441773e-04 -8.69940600e-04 -1.15148798e-02 -1.58129170e-03 1.29546981e-05 -3.05663959e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.02609249 -0.01138922 -0.03744868] [-0.10945657 0.10715758 0.27012278] [-0.02097481 0.10828334 -0.11649098] [-0.21074863 0.11716421 0.29654663] [ 0.03391199 0.14026341 0.18766395] [-0.09430889 0.00268948 0.11166771] [-0.15807564 -1.2192343 0.08293055] [ 0.17899116 0.35778296 0.11040355] [ 0.3497861 0.12619261 0.02082589] [ 2.39415497 2.20722603 -0.25776864] [-0.98129981 0.15135592 -0.0801494 ] [-0.1922766 0.10465507 0.13648572] [-0.11647752 -0.04971416 0.12479138] [-0.01575536 -0.1073528 -0.01173669] [ 0.07102557 0.13424475 -0.03287929] [ 0.11131874 0.10558404 -0.25439421] [ 0.08160845 -0.02124 -0.0494392 ] [-0.08880944 0.10289955 -0.04757641] [ 1.09396799 -0.31664332 -0.23503176] [-0.37623803 0.95689907 0.02380359] [-0.64500312 0.34409678 -0.04763314] [ 0.19571716 0.14658655 -0.11471304] [-0.06410745 -1.21045811 0.01177604] [-1.46042 -1.77572981 0.21679679] [-0.09305501 -0.09239768 0.09450525] [-0.20618688 0.08190075 -0.22119816] [-0.08268357 -0.18592386 0.10931423] [ 0.09735611 -0.16678095 -0.0086105 ] [-0.12058048 -0.10408275 0.04535567] [ 0.16721867 -0.15409154 0.00893236] [-0.1303193 0.310619 0.00966034] [-0.07324764 -0.05188789 -0.06189287] [ 0.11966538 0.03744442 -0.06566402] [ 0.07479162 -0.05904485 -0.11018777] [ 0.12660048 -0.06616711 -0.01141941] [ 0.11781785 -0.05090714 -0.09734825]] Final stress: [ 0.02951949 0.02998644 0.01413536 0.00552013 0.00022623 -0.00502988] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-2.63512346e-03 -1.17817317e-03 -1.16058827e-04] [ 7.35060273e-03 -2.07256692e-03 1.41038940e-03] [-4.02529116e-06 -1.01088629e-02 -2.56002146e-03] [ 3.95484317e-04 3.56793727e-04 -1.01847858e-04] [-1.69093204e-02 8.32585141e-03 5.20373767e-03] [-3.14649219e-03 -2.04267971e-03 -6.93260705e-05] [ 8.04368382e-03 1.75660321e-02 -2.64739809e-03] [ 3.53458188e-03 -6.34292452e-03 5.91383530e-04] [ 2.81836895e-03 1.28308112e-02 4.62820611e-03] [-1.10905422e-02 -1.68883010e-02 3.06709991e-03] [-5.02481365e-03 -7.87411863e-03 -4.51161287e-03] [ 1.33962625e-02 -1.00822352e-02 -1.46562655e-03] [ 1.85665342e-03 3.35329865e-03 -2.84806791e-03] [ 1.38232370e-03 7.82548517e-03 5.02753919e-04] [-8.26306712e-03 2.16875858e-03 8.00766227e-03] [ 1.85271088e-03 -1.12153008e-03 3.53966528e-03] [ 5.77576552e-03 -4.08470144e-03 -3.33600094e-03] [-1.09390741e-04 -6.33845680e-03 -5.88682847e-03] [-4.89572292e-03 1.83226420e-02 -7.91581391e-03] [ 1.00414747e-02 -8.76091627e-03 2.62992620e-03] [-2.05078012e-02 -1.35230075e-02 5.63892802e-03] [ 2.38418471e-03 6.11313767e-03 9.06212886e-03] [ 9.73134171e-03 7.83033332e-03 -4.02611133e-03] [ 1.66492269e-04 -1.29765929e-03 -6.24411311e-03] [ 5.45425430e-03 4.59328387e-03 1.55232032e-03] [ 3.15956640e-03 -5.86020372e-03 -1.96485717e-03] [-4.80199749e-03 1.58764535e-02 -3.06245282e-03] [-4.50428451e-03 3.53799256e-03 -2.51310760e-03] [ 1.66773629e-03 -4.82816529e-03 6.74513512e-03] [ 3.77896077e-03 -7.73458770e-03 -2.34397810e-04] [-2.63109949e-03 -3.62780918e-03 9.44105944e-04] [-2.71570248e-03 8.78959532e-03 2.60696704e-05] [ 5.45785831e-03 -1.45709794e-02 4.23252861e-03] [ 3.03348479e-03 -4.00127522e-03 -2.26776660e-03] [ 2.92060902e-04 5.54537787e-03 -6.24495748e-03] [-4.33446967e-03 9.30330685e-03 2.34326031e-04]] Final stress: [ 1.18587051e-05 -7.14078621e-05 1.22573528e-04 -4.90152331e-03 -1.37308170e-04 -3.01997638e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-0.07335545 -0.06672363 0.01924163] [ 0.01621249 -0.02371195 0.00545904] [ 0.00726389 0.10576438 0.01669659] [-0.01625007 -0.0556531 0.01004034] [-0.03383848 0.01278673 0.00626463] [ 0.08968707 0.05089424 0.01369502] [-0.01526805 -0.13788686 -0.04327456] [ 0.39727812 0.01853085 0.01733449] [-0.1559876 0.02717127 -0.01884206] [ 0.06204868 -0.04821756 0.0182941 ] [-0.06343547 -0.03748892 -0.00928059] [ 0.02124527 -0.01810296 -0.01351255] [-0.05889616 -0.03352487 -0.03544081] [-0.04355902 0.0244562 0.018248 ] [-0.00794963 0.00491628 -0.00672317] [ 0.07479357 -0.12818675 0.03134891] [-0.00493027 0.12196326 -0.02622557] [ 0.04948705 0.00953885 -0.0129155 ] [-0.13257881 0.0278301 0.04215848] [ 0.05212264 0.00409096 -0.02162501] [-0.37256551 0.05941959 -0.05378216] [-0.0050703 -0.02015686 -0.02176247] [-0.04804795 0.03486829 0.02814238] [ 0.21652705 0.06741606 0.05309819] [ 0.0101469 0.02366341 -0.01574944] [ 0.10367826 0.05644717 -0.00479943] [-0.04928317 -0.05309702 -0.06797039] [ 0.0439564 0.02176593 0.03093632] [-0.0292432 -0.06420285 0.08679327] [-0.01221996 -0.02852114 0.01899833] [ 0.01997624 -0.05086796 -0.0050282 ] [-0.09839535 -0.04221481 0.02016011] [ 0.02441858 0.03502246 0.07525722] [-0.03673575 -0.00896642 -0.01287855] [ 0.05641139 0.08766308 -0.1068944 ] [ 0.01235659 0.02331456 -0.03546219]] Final stress: [0.00026162 0.00151679 0.00089505 0.0020829 0.0029838 0.00305514] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 3.53119155e-04 3.29497698e-04 1.58501191e-04] [ 1.78214493e-04 -1.55820708e-04 -2.03807931e-06] [-2.42012621e-04 6.57413732e-05 2.58304246e-04] [ 1.15618400e-04 -2.12552645e-04 -2.01282586e-04] [-2.54504910e-04 -1.05556100e-04 1.10292365e-04] [-3.12992146e-04 4.11057053e-04 4.37398927e-05] [-2.16150604e-03 -1.61936177e-03 1.18550431e-04] [-2.34021786e-03 1.42668145e-03 -6.10355653e-05] [ 3.01988810e-05 4.14876713e-04 -5.24648726e-04] [-4.19194860e-04 -2.70839933e-03 1.88691767e-04] [ 1.30146806e-04 4.34377138e-04 -3.84336259e-04] [-1.86422645e-03 1.18476203e-03 -3.12270233e-04] [-4.55131502e-05 1.66665772e-04 1.13515467e-04] [-2.74634043e-04 2.36365464e-04 -4.96360784e-05] [-1.12105244e-04 -1.10682123e-04 2.06723628e-04] [-3.48952881e-04 2.20055807e-05 -7.43486675e-05] [ 1.39697341e-04 1.39100157e-05 -7.42120592e-05] [-4.61948845e-04 -1.74046081e-04 -1.43306720e-04] [ 2.65683301e-04 1.67875200e-04 2.43145016e-04] [ 8.01688716e-04 9.41489277e-04 5.78564508e-04] [ 3.62670669e-03 -3.63310339e-05 -6.94048283e-04] [ 9.34848518e-04 -4.56331057e-04 -6.37829844e-04] [ 1.52217642e-03 5.43611255e-04 1.21322258e-04] [-4.27918815e-04 1.37569359e-03 -2.05115964e-04] [ 2.40676993e-04 -1.09708955e-04 -1.36890216e-04] [-1.37214695e-04 -5.63062820e-04 2.43198107e-04] [ 4.50427045e-04 -3.72096147e-04 3.14755104e-04] [ 2.33160745e-04 -3.27538946e-04 -1.57033933e-04] [ 1.55701297e-04 -3.94051927e-04 1.52799574e-04] [-9.56919298e-05 -1.45341085e-04 1.08367370e-04] [-2.63433838e-04 -4.00935603e-04 3.09310904e-04] [-2.15375834e-04 -3.85417931e-05 3.15140766e-04] [-1.23405321e-04 -3.00950096e-04 9.40533802e-05] [ 1.81497261e-04 4.00300594e-04 8.62949718e-05] [ 9.03232089e-05 -2.30968879e-04 4.25366790e-05] [ 6.50964209e-04 3.27366899e-04 -1.49774410e-04]] Final stress: [ 0.02894573 0.02720456 0.01676123 0.00222126 -0.00220403 0.00085561] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-1.16532956e-02 -5.64114614e-03 -8.06910867e-07] [-9.66071272e-03 1.65575721e-02 -1.93250072e-03] [ 5.54510975e-03 -5.23021979e-02 -1.24344831e-02] [ 2.57418739e-03 4.72524731e-02 -7.98887822e-03] [-1.03096568e-02 1.14932602e-03 3.50284381e-03] [-1.20866178e-02 -1.32021091e-02 -1.51767528e-03] [ 1.61356280e-02 -1.23851617e-03 4.15314349e-03] [ 3.32318878e-02 -2.33376271e-02 -3.43541541e-03] [ 3.13645350e-02 -2.02483192e-02 4.04739049e-03] [-1.10053037e-03 -1.28128378e-02 1.20350123e-02] [-2.07671253e-02 6.55367810e-03 -2.08825470e-02] [-2.26959341e-02 2.59337718e-02 1.66949894e-02] [-1.72879044e-02 2.34390826e-02 -1.33676056e-03] [-1.38441332e-02 -1.30109377e-02 -3.08105422e-03] [-9.24767631e-03 -9.50153542e-04 -2.70475879e-02] [ 2.13643049e-02 -1.56758842e-02 6.45662918e-03] [ 2.96822891e-02 4.66274833e-02 -1.34096653e-03] [ 2.09781403e-03 -3.64000709e-02 3.50675616e-02] [-3.10500768e-04 -1.54880817e-03 -2.80108761e-02] [ 2.07363627e-02 1.08639710e-02 -2.65819267e-02] [-1.15418928e-02 -2.54153441e-03 2.90559095e-04] [ 5.41629450e-03 3.56850196e-03 2.51648616e-02] [-6.93186518e-03 -8.75480742e-03 2.29545331e-02] [ 8.14857983e-03 6.34427318e-03 1.02160142e-03] [ 1.10764013e-02 -3.74021266e-04 3.07523519e-03] [ 2.45092848e-02 9.50472739e-03 1.14325649e-02] [ 5.24516031e-03 2.08704944e-02 -2.53911737e-03] [-1.71898641e-02 -3.04557753e-02 8.24496074e-03] [ 1.06774801e-03 -9.64961181e-03 1.52598896e-02] [ 3.08935774e-02 -3.81681173e-03 -3.29133547e-03] [-1.27772097e-02 8.23417408e-03 1.13705783e-02] [-2.63300707e-02 -1.38072816e-02 -1.65273960e-02] [-6.96344381e-03 -2.07426533e-03 -3.03792174e-03] [ 1.03074820e-02 2.38190399e-02 -2.28030425e-02] [-5.11396685e-03 3.19602582e-03 -1.06268160e-03] [-4.35842464e-02 1.39281221e-02 4.08061915e-03]] Final stress: [-0.00138988 0.00158687 0.00011955 -0.00248117 0.00242765 -0.0020439 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-5.25358919e-02 -3.75326302e-02 6.53073085e-03] [ 2.39629341e-02 -1.66516036e-02 6.42304602e-03] [-2.07025499e-04 3.42040737e-02 4.27164632e-03] [-1.04854816e-02 -4.10753481e-02 4.84520093e-03] [ 3.33139002e-03 -4.87241447e-03 1.00683731e-03] [ 6.82806723e-02 4.02443485e-02 1.57565370e-02] [-5.98355316e-03 7.83084606e-03 1.27357586e-02] [ 2.93263242e-01 4.87029636e-02 5.15055201e-02] [-6.45635932e-02 -1.09731955e-01 -8.64126098e-03] [ 2.55019974e-02 -7.57420749e-03 -4.03696507e-02] [-3.03147389e-01 3.49261029e-02 -5.29196466e-02] [-9.87847366e-03 6.68159599e-02 1.52861192e-02] [-1.04362152e-01 1.47227010e-01 1.77786153e-02] [ 1.31124970e-01 -1.60576697e-01 1.57837212e-02] [-4.10393594e-02 -7.78289513e-03 3.63591488e-02] [ 3.95316782e-01 -6.91787955e-01 -6.98480651e-03] [-4.18386696e-01 6.89377189e-01 -4.46602328e-02] [ 3.68407949e-02 2.77124677e-02 -3.23930268e-02] [-8.70764305e-02 5.36485434e-02 4.68075663e-02] [ 4.28687041e-02 2.05392382e-02 1.92210639e-02] [-1.93366831e-01 -4.27394710e-02 1.50689691e-02] [ 1.46122794e-01 -5.30349604e-02 -4.83154223e-02] [-2.81566693e-02 -5.83324113e-02 -1.84761855e-02] [ 1.65604861e-01 2.23216434e-02 -1.10086222e-02] [ 1.43865509e-02 3.35139073e-02 -1.19896228e-02] [ 4.23931563e-02 2.36673007e-02 -2.10349513e-02] [ 1.73692354e-02 -6.32089457e-02 -9.77680362e-03] [ 4.19408304e-02 -1.15571958e-02 -1.32226987e-02] [ 5.41757691e-02 3.90815745e-02 -2.15705451e-02] [-8.93726226e-02 -1.00007024e-02 -2.65411596e-03] [-5.76812229e-04 -4.93136705e-02 2.93624168e-02] [-3.39043556e-02 -1.28815749e-02 3.34011441e-03] [-3.35471398e-02 6.76779619e-02 1.86450451e-02] [-5.91348449e-02 2.22552859e-02 7.71448075e-03] [-3.75654328e-02 -2.81194695e-02 2.32836008e-02] [ 7.08060701e-02 2.70276911e-02 -7.70854687e-03]] Final stress: [ 9.74435115e-04 -4.13896604e-03 5.76851119e-05 -2.43155074e-03 -2.36431884e-03 -1.88207954e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-9.29137216e-04 -1.38396036e-04 1.32114323e-04] [ 3.11748957e-03 1.13148628e-03 3.41526746e-04] [ 2.68671328e-03 -5.25210620e-05 9.69729773e-05] [-1.41407275e-04 9.68347541e-04 -3.82328942e-04] [-8.73344912e-04 2.77454887e-03 3.31851127e-04] [-4.74042554e-03 -3.33129723e-03 -1.36288294e-03] [ 1.62774397e-04 -2.23368987e-03 -2.82824212e-03] [ 2.84915178e-03 3.01486799e-03 6.84364193e-04] [-5.12942953e-04 -7.21954942e-03 1.69244575e-03] [-5.20939575e-03 -3.44604930e-04 -2.69066855e-04] [ 2.38535423e-03 -6.35683153e-03 -1.44010700e-03] [ 2.11944635e-03 1.94496722e-03 1.68059468e-03] [ 1.92693260e-03 -5.24772776e-03 -1.24410518e-03] [-2.44829152e-03 4.40135125e-03 8.13833729e-04] [ 3.32585820e-04 -1.75083499e-04 1.68147358e-03] [ 7.45016934e-03 -5.15455630e-03 -9.83075149e-04] [-4.31812317e-03 6.09126893e-03 -2.01577037e-04] [-4.43549615e-03 4.36309767e-04 5.29149967e-04] [-7.53597169e-03 2.70073397e-03 -3.13710115e-03] [-1.67320437e-04 -9.37438289e-04 6.68834340e-04] [ 4.67217538e-03 1.68275002e-04 3.27279980e-03] [ 3.55549938e-03 -3.33910945e-03 -3.33503447e-03] [ 2.39008241e-03 7.21371867e-04 1.04761807e-03] [-6.80356782e-03 -2.62459031e-03 1.97640113e-05] [ 2.78822191e-03 4.15243118e-03 -6.45825479e-04] [ 1.73622940e-03 -1.92092820e-03 -5.25872493e-04] [ 1.59208072e-03 6.68957973e-04 5.01684543e-05] [-3.13889260e-03 2.95094517e-03 -1.11598348e-03] [-2.62599900e-03 1.39258573e-03 1.44956788e-03] [-4.00182567e-04 -2.96278255e-04 2.46674597e-03] [ 1.41737570e-03 -1.05033632e-03 -1.19376504e-03] [ 1.55732705e-03 -5.35921293e-04 3.13938939e-04] [ 2.71373510e-03 3.16961781e-03 1.87130763e-03] [-2.39719163e-04 3.02764718e-03 -1.62442388e-03] [-9.32519440e-04 2.04413194e-03 1.26271409e-03] [-6.07238920e-07 -8.00985914e-04 -1.18395036e-04]] Final stress: [-4.29632071e-04 -3.38344220e-04 -6.70451039e-05 3.98869671e-03 1.05718705e-05 4.54633256e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-0.00645727 -0.01825236 0.00111843] [-0.00101782 0.01093967 0.00099943] [-0.01589606 -0.09741966 -0.01510653] [ 0.0162559 0.01686526 -0.00257369] [-0.00745243 -0.00661212 0.00330229] [-0.04818628 -0.02557755 -0.00802506] [-0.060083 -0.01375444 -0.00630116] [ 0.28568634 0.02105507 0.0136641 ] [-0.0725883 0.24199522 0.00548551] [-0.07335307 -0.06414885 0.02304665] [-0.07898973 -0.04806059 -0.01490164] [ 0.16556997 -0.25477839 -0.00675148] [-0.0889859 0.01551623 0.01575989] [ 0.01078672 0.05767757 0.01164442] [ 0.06818569 -0.00825452 -0.02803983] [ 0.04889244 -0.00030781 0.00281627] [-0.00983724 -0.05548065 -0.01191379] [-0.01046067 -0.00540689 0.02117283] [-0.04593062 -0.09098101 0.01796774] [ 0.0088346 -0.18598092 0.03183864] [-0.15069829 0.09677666 -0.05016581] [-0.0591139 0.14021806 -0.01702217] [ 0.02697307 0.27856785 -0.03627106] [ 0.05664993 -0.03809759 0.04053265] [ 0.02163203 0.01565922 0.00610062] [-0.05714453 0.0363705 -0.02462103] [-0.01611103 0.04117058 -0.02740365] [ 0.04104985 0.00078979 0.00449003] [-0.05149485 0.00252877 0.01123412] [ 0.05940308 0.00203504 0.01896932] [-0.02082059 -0.01803602 0.00617422] [ 0.07604948 -0.03353672 0.01006873] [ 0.01070896 -0.03983188 0.01029367] [-0.01786245 -0.00604204 0.00408789] [ 0.05691819 -0.00345651 -0.01966837] [-0.06111221 0.03585102 0.00799784]] Final stress: [ 0.00086844 -0.00104763 0.00039072 0.00117264 0.00051766 -0.00189007] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[ 0.01617519 0.00136261 -0.00764313] [ 0.06145161 -0.04189451 0.01090012] [ 0.01953597 0.07235353 0.01054157] [-0.011274 -0.15795346 0.02346211] [-0.0051173 -0.00239788 0.00397988] [-0.00827047 0.00369565 -0.00159638] [ 0.21540268 -0.09919679 0.00758989] [-0.22782818 0.188127 0.0241757 ] [-0.0745394 0.06700733 -0.06299842] [ 0.00594411 0.30853196 -0.05137353] [ 0.13951403 -0.22649869 -0.02158686] [-0.20783081 0.34377234 0.07838351] [ 0.00595169 0.00856735 0.01341127] [-0.03395259 0.15609258 -0.02248478] [ 0.07720051 0.04992782 -0.04741156] [ 0.01123184 -0.03165126 -0.0210399 ] [ 0.02719656 -0.14485598 0.01831066] [-0.10738935 0.00177545 0.04616194] [ 0.14903428 0.10280349 0.01327944] [ 0.10247714 -0.1892148 -0.04545582] [-0.0420842 0.03818194 -0.00703756] [-0.10606315 -0.19373984 -0.01498129] [-0.10948611 -0.36577563 0.04886187] [ 0.13313154 0.00908909 0.01814036] [ 0.0704199 0.04910263 -0.01670963] [-0.06644191 -0.00720552 0.04854705] [-0.09233885 -0.05502179 -0.03529907] [ 0.00119166 0.01140784 0.04884664] [-0.02348241 -0.02003276 -0.00621884] [ 0.04730703 0.05723968 -0.04038755] [-0.05816587 -0.04118691 0.01838778] [ 0.08127759 0.0345402 -0.07802112] [ 0.10375759 0.0663277 0.05579207] [-0.03550848 0.02553219 -0.07805413] [ 0.01642503 0.03464825 0.00437706] [-0.07485289 -0.05346081 0.06515064]] Final stress: [ 0.00311283 -0.00086149 0.00082893 -0.00115665 0.00081984 0.00299343] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-2.64371771e-03 -2.29822301e-03 1.05163297e-04] [ 3.01978905e-04 -1.50828746e-03 4.11865545e-04] [ 3.84847493e-04 -5.86656696e-03 -1.42035193e-03] [-1.09506029e-04 5.29231303e-05 5.36176237e-06] [-1.17145824e-02 3.76009674e-03 3.23641102e-03] [-1.65197298e-03 -1.46292687e-03 4.97745612e-07] [ 5.29723022e-03 -3.39048612e-03 -2.43643526e-03] [ 1.25542011e-02 8.19733767e-04 -7.59494357e-04] [ 3.40881739e-03 -1.45587285e-02 2.15674129e-03] [-4.07968607e-04 -8.22657995e-03 1.43250010e-03] [-5.51905526e-03 -3.42292375e-03 9.62945890e-04] [ 6.11033605e-03 -2.40823003e-03 -2.68409181e-03] [ 8.89097213e-03 -3.25004646e-04 -1.00354504e-03] [-1.17062987e-04 4.88173378e-04 1.65659767e-03] [-1.31763404e-02 -1.31526919e-03 1.91856741e-03] [-7.12043515e-03 2.03887575e-03 1.26087424e-03] [ 2.35349253e-03 -2.82465598e-03 -1.75387354e-03] [ 1.35261415e-02 3.80788389e-03 -2.54692130e-03] [-7.17315759e-03 1.23319699e-02 2.96793959e-03] [-6.63777902e-03 8.93689947e-03 2.63143672e-03] [-8.13494099e-03 1.03002750e-02 -4.61607969e-03] [-2.76094190e-03 -3.10424381e-03 -2.46134759e-03] [ 6.10798522e-04 6.16426887e-03 -2.43890195e-03] [ 4.82108587e-03 -4.00195890e-03 3.64799369e-03] [ 1.73425780e-03 7.96257494e-04 -5.66521553e-04] [-3.76150978e-04 1.03823428e-03 5.69141771e-04] [-2.47860669e-03 -1.71166854e-03 -1.00291245e-03] [ 5.48552880e-03 1.46219379e-03 4.37968661e-04] [ 2.29728911e-03 3.04719052e-03 -2.86366717e-03] [ 1.25838732e-03 4.07887418e-03 5.52220812e-04] [ 1.30221877e-03 4.32235827e-04 -1.06425456e-03] [-3.15780752e-04 -5.08834052e-05 -1.53160354e-04] [ 3.69756725e-03 1.45088707e-04 2.21849722e-03] [-4.82638681e-03 -3.26959726e-04 8.69201972e-04] [-5.83367655e-06 -1.34993897e-03 6.69445823e-04] [ 1.13506914e-03 -1.54763886e-03 6.01863309e-05]] Final stress: [-2.62159313e-04 -2.86217513e-04 -3.96116787e-05 -3.95277582e-03 6.81279011e-05 -4.58868214e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-9.29125529e-04 -3.79835312e-03 6.03046796e-04] [-7.31873826e-04 1.85288465e-03 1.31072033e-04] [-5.55519439e-04 1.42646258e-03 4.52914528e-04] [-1.82085026e-04 7.81953700e-03 -2.11791714e-03] [-1.19020571e-03 -3.18968902e-03 -2.10801577e-04] [-3.71941448e-04 1.17920789e-03 -1.66110795e-04] [ 7.60738108e-03 8.86043122e-03 2.02459233e-05] [ 4.32439497e-03 -2.47073873e-03 -4.94608635e-04] [-9.16770579e-03 4.67051723e-03 8.94862578e-04] [-8.58123261e-03 -1.13161952e-02 -1.04565261e-04] [-4.85410927e-03 -7.64640637e-04 8.03792091e-04] [ 5.88868574e-03 -1.22889261e-02 -1.09056698e-04] [ 5.51941581e-03 7.04783570e-04 -2.34499121e-03] [ 2.36147435e-04 2.96785443e-03 -3.76412347e-04] [-8.90211470e-03 -2.01704007e-03 3.00538526e-03] [ 4.51685915e-03 -1.47581687e-03 1.01506792e-03] [-1.41227855e-04 -1.25902064e-03 -5.04045791e-04] [-1.42110783e-03 -2.60769511e-04 -3.95858018e-04] [ 2.72419234e-03 -7.39321095e-03 9.43282963e-04] [-3.44491094e-03 -8.40751142e-03 -1.69900646e-03] [-1.84705130e-03 -1.85888011e-03 6.38224436e-04] [ 1.24893871e-03 -2.03587065e-03 -3.48201354e-03] [-3.43916443e-03 1.20102115e-02 8.46904086e-04] [ 1.33167250e-02 7.81977635e-03 1.95923756e-03] [-1.45342847e-03 6.25144876e-03 4.43120653e-04] [ 1.94957809e-03 -2.92490100e-03 -1.07248414e-03] [ 5.66317420e-03 -2.41178601e-03 5.25360919e-04] [-4.23228080e-03 -1.13430071e-03 3.47136477e-04] [ 1.38545023e-03 6.08890550e-03 -1.02446733e-03] [-1.37779669e-03 -2.58385080e-03 1.12082973e-03] [ 1.11260358e-03 -3.46931592e-03 -1.97162236e-03] [ 9.02961074e-04 -6.61429891e-04 2.29338012e-03] [-4.38751443e-03 6.68927051e-03 1.58484067e-03] [ 3.62518099e-03 5.87047011e-03 -2.22727966e-04] [-1.70522773e-03 -2.79044187e-03 1.44379207e-03] [-1.10606463e-03 3.00927838e-04 -2.77580753e-03]] Final stress: [-3.02144632e-03 3.09659508e-03 1.44889475e-04 -1.39457816e-05 4.93361057e-03 7.16554667e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-0.03516834 0.01462545 0.00381495] [ 0.02528151 -0.01295158 0.00696814] [-0.00157399 -0.00111598 0.00053545] [ 0.00643957 0.0112147 -0.00021066] [-0.00631085 0.03307136 0.00403974] [ 0.00194985 -0.00923638 -0.00302717] [ 0.00532808 0.02235257 0.01874828] [ 0.00836055 -0.00200144 -0.00285024] [ 0.0266585 -0.00321594 -0.02372072] [ 0.01652689 -0.00410413 0.03519949] [-0.01804559 0.0137702 -0.02923243] [-0.01894156 -0.00052179 -0.00373532] [ 0.00960075 -0.02182117 0.00870051] [-0.02846957 -0.03201687 -0.00438608] [ 0.04023577 0.04726578 -0.00488845] [-0.00912323 -0.0168535 0.00326975] [-0.00702058 0.02471694 0.0011188 ] [-0.0019938 -0.01423874 -0.01072109] [-0.01597613 0.02183908 0.00225564] [-0.00784619 -0.01274671 0.01399704] [ 0.01718321 0.01135013 -0.01374363] [ 0.02830639 -0.00338735 0.00836763] [ 0.01026724 0.02728748 -0.00728661] [ 0.00255183 -0.00555051 0.00241672] [ 0.00963238 0.01203639 -0.00588151] [-0.01210917 -0.01068792 0.00601667] [-0.00885109 -0.01403641 -0.01238064] [-0.01608664 -0.03562086 0.01323031] [ 0.0060511 0.00173501 0.01127543] [-0.00714854 -0.00150636 -0.00600809] [ 0.00602877 0.00292631 0.02442375] [-0.022268 -0.00229744 0.00616142] [-0.01216511 0.00196189 -0.03020779] [-0.01006683 -0.01187987 -0.01380618] [-0.00519886 -0.02004457 0.024133 ] [ 0.02396169 -0.01031779 -0.02258609]] Final stress: [ 0.00288311 -0.00346272 0.00017443 0.00018666 -0.00488212 -0.0001306 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.34904438e-02 -7.89435175e-03 3.79032033e-03] [-7.82817231e-03 4.81496947e-03 -5.92652278e-04] [ 1.07926788e-03 -9.67565992e-03 -1.75818432e-03] [-2.33314007e-05 2.39389814e-02 -5.59211619e-03] [-4.44211851e-03 1.44645074e-03 1.28688737e-04] [-9.26433496e-03 -9.40329683e-03 -1.60024272e-03] [ 4.33878492e-02 3.91877338e-03 9.53677030e-03] [ 2.13592336e-02 2.66777279e-02 -5.38958243e-03] [-8.49368457e-03 -2.73311291e-02 5.56377374e-03] [-2.71872488e-02 -3.56009519e-03 -7.58220318e-03] [ 6.75714197e-03 -7.23686938e-03 3.22129295e-04] [ 9.91003244e-03 2.03766704e-02 1.17395427e-03] [ 1.39215964e-02 -2.01307059e-03 9.73403383e-04] [-3.42204195e-03 -1.81338399e-03 -1.42412332e-02] [ 1.25131710e-02 8.44213305e-03 2.75858035e-03] [-1.75059689e-02 1.32657714e-02 2.43712182e-03] [ 1.07968964e-02 -5.81170743e-03 1.13175660e-02] [-7.68104595e-03 -1.34399692e-02 -1.58571398e-03] [-4.01604637e-02 2.51297136e-02 -1.83489239e-03] [-4.98157103e-03 -1.22221770e-02 9.33268822e-03] [-1.21580236e-02 1.07864669e-03 -1.22147362e-02] [ 3.19332768e-02 -3.06881504e-02 4.59937113e-03] [ 3.55465419e-03 1.60734218e-02 -1.12293163e-02] [-1.33742689e-03 -8.81528454e-03 9.94765069e-03] [ 5.43696793e-05 -1.05898289e-02 1.26228960e-02] [-3.63020957e-03 8.75954646e-04 -7.07876729e-03] [-1.77109748e-03 1.37710057e-02 -1.11866467e-02] [ 3.19213233e-03 -4.38491185e-04 6.24947048e-03] [ 5.36098621e-04 1.35745545e-02 4.06280853e-03] [-4.89752684e-03 -2.22370429e-03 8.18684450e-03] [-1.15152536e-03 1.00813741e-02 -8.95060022e-03] [ 4.41117346e-03 -5.71398108e-03 4.66489507e-03] [ 3.35906618e-03 -1.13958632e-02 1.08691505e-02] [-3.22464677e-03 -3.20232251e-03 -7.52450439e-03] [ 2.09088452e-03 -1.45108229e-02 -4.16621038e-03] [ 3.79403776e-03 4.51401078e-03 -6.01048125e-03]] Final stress: [-2.16693081e-03 9.84895103e-04 -1.10627802e-05 1.66562789e-03 2.56780236e-03 3.00238875e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 0.01084337 -0.00132622 -0.00071473] [-0.00090331 -0.0234966 0.00117934] [-0.00580384 0.03771461 0.00896321] [-0.0183763 -0.00845521 0.00145877] [ 0.02333175 -0.01231717 -0.00662565] [ 0.00796369 0.01634203 0.00117164] [-0.01839179 0.00377683 -0.03689799] [ 0.00747621 -0.00146369 0.01246799] [ 0.00352497 -0.01157471 -0.00563554] [ 0.00202336 -0.03025087 -0.00399206] [-0.06501979 -0.01033165 0.03237643] [-0.02660706 0.04085242 -0.00432021] [-0.01528424 0.00222161 -0.00715024] [ 0.0096704 -0.01515874 0.03623833] [-0.01115273 0.00321387 0.00656852] [-0.00976295 -0.00091445 -0.01076364] [-0.00965755 0.00809847 -0.02069442] [ 0.03195905 0.00207222 -0.00975751] [-0.01497304 -0.03526624 -0.00482665] [-0.04065541 0.02390137 -0.00679202] [ 0.03181523 0.00764465 -0.00763511] [ 0.00933579 0.01353309 0.00108099] [ 0.03807384 -0.01685694 0.01188737] [-0.01633574 -0.01871289 0.00735222] [ 0.00079311 0.00262728 0.0017124 ] [ 0.02519724 -0.01013442 -0.00296248] [ 0.00262028 -0.0061867 0.01089207] [-0.003803 0.03852354 0.01549678] [ 0.0069642 -0.00583865 -0.00926656] [ 0.01457598 0.00757554 0.0233842 ] [ 0.00632784 -0.00634947 -0.02799844] [-0.00281348 0.01181071 0.00051858] [ 0.01424328 -0.00355193 0.01793636] [ 0.01970602 -0.01810875 -0.00211821] [-0.00138835 0.0233323 -0.02155333] [-0.00551704 -0.00694525 -0.0009804 ]] Final stress: [-2.11347123e-03 1.48657964e-03 -9.01360363e-05 -1.60929480e-03 2.54304270e-03 -3.35832428e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.00177669 -0.02074611 0.00347335] [-0.00397679 0.00585916 -0.01252115] [-0.00727868 0.00440046 -0.00124509] [ 0.00062607 -0.00652133 -0.00540284] [-0.00153709 -0.00470524 0.0012731 ] [ 0.01386583 -0.004284 -0.00885756] [ 0.00800403 0.02608129 -0.01699791] [ 0.08995848 0.03030935 -0.00315271] [-0.02428273 0.03069419 -0.00181473] [-0.00259626 0.01008005 -0.00252795] [-0.04614479 0.01969515 -0.02244947] [ 0.00496139 -0.00679526 -0.00864912] [-0.004298 0.01873404 0.0056464 ] [ 0.01518077 -0.01174423 0.00675954] [-0.01311025 0.002696 -0.00645999] [ 0.00883867 0.01502789 0.00145501] [ 0.00483363 0.00614431 -0.00606099] [-0.00146165 -0.00072127 0.0027244 ] [-0.021463 -0.02874951 0.00906012] [ 0.0084099 -0.03260717 0.00780812] [-0.04776621 -0.03779307 -0.00854738] [ 0.0434357 -0.03792887 0.01018312] [ 0.00745322 0.04190807 -0.00065196] [-0.01478807 -0.01279487 -0.00494138] [-0.01276959 0.01182038 -0.00066613] [-0.00244009 -0.01382027 0.00082753] [ 0.00299212 0.01190325 0.01178053] [ 0.00023296 -0.00060491 0.00838429] [-0.00227686 -0.0089019 0.00976606] [-0.00065742 0.01073479 0.02084973] [-0.00851526 -0.00374578 0.01140204] [ 0.00234452 0.01019242 -0.00180504] [ 0.00722311 -0.00512337 -0.00173096] [-0.00789773 -0.00163639 0.00095631] [ 0.00278863 -0.00658859 0.0045143 ] [ 0.00033476 -0.01046866 -0.0023816 ]] Final stress: [ 0.02887483 0.0270684 0.01685295 0.00109159 -0.0021847 0.00181814] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-5.44300346e-02 -2.04736059e-02 3.75687585e-03] [ 1.75445076e-05 3.41801457e-02 -1.94032807e-04] [-4.47101466e-03 -5.96825884e-02 -1.39549172e-02] [ 1.27488388e-02 1.05438710e-02 -3.89907937e-03] [-1.30404029e-01 1.14209196e-01 3.55654774e-02] [-3.20159713e-02 -2.39438968e-02 -1.85423424e-03] [-6.96037432e-02 -1.03608192e-03 6.76808025e-02] [ 1.87914061e-01 -3.26612889e-02 -2.39696056e-02] [ 1.15846187e-01 -3.56710552e-02 -3.82715847e-02] [-3.33357526e-03 1.18362360e-01 -5.46723748e-02] [-1.08879169e-01 -6.51739159e-02 -6.36735048e-04] [ 8.65618869e-02 1.34001023e-01 1.99973926e-02] [ 4.61555426e-02 4.80401953e-02 1.59349641e-02] [ 4.17346760e-02 2.41257523e-02 3.17142467e-02] [-9.03591054e-02 -2.05382747e-02 -1.49985082e-02] [ 3.26419625e-04 -5.87381007e-02 -1.08904339e-02] [ 6.73806499e-03 6.04689133e-03 -5.36045760e-02] [ 1.12554361e-01 1.40370687e-02 2.12251348e-02] [-3.90303940e-02 1.14001106e-02 8.19269148e-02] [-3.80468748e-02 -1.09238125e-01 -1.12942323e-01] [-8.62517722e-03 7.14625368e-02 6.85211905e-02] [-5.86714261e-02 -3.93877687e-04 -6.04441734e-02] [-1.77931217e-02 -3.84055544e-02 8.26145254e-02] [ 5.39451156e-02 -4.17104055e-02 -5.32385074e-02] [ 2.85956534e-02 -1.41478164e-02 -4.27074484e-02] [-4.70059508e-03 -3.28644583e-02 3.18227881e-02] [ 3.30202584e-02 -3.08989472e-03 5.13521580e-02] [-1.88757144e-02 -9.32931274e-03 3.81482433e-02] [ 2.85439487e-02 -2.64604563e-02 -3.08811524e-02] [-5.03468268e-04 2.75859803e-02 -3.13844737e-02] [-1.71512040e-02 -4.87590319e-02 2.28937594e-02] [-1.10474795e-02 7.61586438e-03 -2.37036368e-02] [-2.77944118e-02 7.29962891e-03 -1.67745831e-02] [ 2.46213352e-03 -3.02111656e-03 -1.72933560e-02] [-1.64561460e-02 3.43576790e-02 1.89528650e-02] [-4.97203761e-03 -1.79294455e-02 1.42083979e-02]] Final stress: [ 0.00213114 -0.00346777 -0.00019515 -0.00245701 -0.00220806 -0.00367219] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 1.74096312e-02 1.82906280e-02 -4.20862104e-03] [ 1.23625970e-02 -1.20384614e-02 2.24567075e-03] [ 4.89344195e-03 3.27366427e-02 5.02742165e-03] [-6.23581286e-03 9.46211388e-03 -6.44410837e-04] [-1.13205619e-02 1.37418046e-02 7.53647194e-04] [ 1.15085114e-01 6.76028239e-02 2.65604525e-02] [-5.51879529e-03 -7.65442986e-02 -1.69177053e-02] [-1.06850394e-01 -5.43603816e-03 9.34287508e-03] [-1.20405156e-02 4.14840653e-02 -3.69211407e-02] [ 1.26684477e-02 5.70064357e-02 -7.89491698e-03] [ 1.45113646e-01 2.35518426e-02 -4.96957108e-03] [-6.37988245e-03 -3.15926236e-02 3.53010010e-02] [ 4.48382263e-02 -4.65436129e-02 2.29519773e-04] [-4.64523075e-02 5.35987001e-02 3.19222505e-03] [-1.16733863e-02 -8.67155339e-03 -1.14061323e-02] [-8.44016837e-02 2.90044954e-02 -1.55424196e-02] [ 4.92128366e-02 -5.85840370e-02 2.14735937e-03] [ 2.42183413e-02 1.07937725e-02 9.09676335e-03] [ 1.31288686e-01 -1.03997519e-01 1.81974489e-02] [ 2.79704907e-02 1.08292361e-01 2.85757309e-02] [-4.46706025e-02 -5.59677738e-02 -3.87540508e-02] [-1.82219811e-01 1.22009622e-01 -2.54471245e-02] [-2.20341146e-02 -1.79659630e-01 -2.97121081e-02] [-1.56483217e-02 3.86078001e-02 4.66488375e-02] [ 1.91957511e-02 -3.28532819e-02 1.41178283e-02] [ 1.98134599e-02 7.87857918e-03 1.37317267e-02] [ 1.69565797e-02 -2.43939737e-02 -1.56054236e-02] [-5.15492929e-02 2.18417443e-02 3.49248644e-03] [-2.05680201e-02 -9.54270712e-03 -5.76721858e-03] [ 4.84068689e-03 -1.83236664e-02 1.17505287e-02] [-1.47381920e-02 2.01336979e-02 -2.07010193e-02] [-2.06018401e-02 -1.91593651e-02 -1.16896588e-02] [-2.66432110e-02 2.15989272e-02 1.77830640e-02] [ 3.53643939e-02 -9.48580260e-03 -1.75259873e-04] [ 2.37098132e-02 -2.58786867e-03 6.88910046e-03] [-1.53953995e-02 -2.25384423e-03 -8.72690633e-03]] Final stress: [ 0.00132678 0.00202617 -0.00010635 0.00345325 0.00062883 0.00548194] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 0.02184833 0.00922403 -0.00213439] [ 0.02017584 -0.02239192 0.0049534 ] [-0.00163761 -0.0054165 -0.00081966] [-0.00647487 0.02168764 -0.00306084] [ 0.03251645 -0.02585342 -0.00978532] [-0.00562149 -0.01014605 -0.00098247] [-0.03179568 -0.04546047 0.01680174] [ 0.00482686 -0.02353764 -0.01059506] [ 0.01422388 0.03413988 -0.00028067] [-0.0035249 -0.0122095 -0.02413011] [ 0.04533702 0.00199192 0.01399584] [-0.01992969 0.01524969 0.00835447] [ 0.02338457 -0.01025121 0.0011664 ] [ 0.0090053 0.03166707 -0.01279613] [-0.01027121 -0.00652099 -0.00726439] [-0.01293034 0.01067242 0.01192013] [-0.02752942 -0.0223645 0.01108288] [ 0.01347776 0.01649765 -0.0021182 ] [ 0.00629218 -0.01724271 -0.01412655] [ 0.0075396 0.03371663 -0.00801121] [-0.0154853 0.02182792 -0.0117113 ] [-0.01773609 0.03082996 0.03640239] [ 0.01172337 -0.02779354 -0.00138819] [-0.01153357 0.04034533 0.00295196] [-0.01092048 -0.01751093 0.01194989] [-0.01252432 -0.00661143 -0.00203198] [ 0.01490541 0.00795826 -0.00210253] [-0.01494568 -0.03234588 0.01432587] [-0.00056946 0.00222078 0.00510343] [ 0.00111414 -0.00864961 -0.00844375] [-0.01096446 0.01634642 -0.00528484] [ 0.00662012 -0.01347851 -0.01277756] [-0.00130141 -0.00472036 0.00169507] [-0.01076656 0.02921902 -0.01091547] [ 0.00105396 -0.0082018 -0.00973404] [-0.00758223 -0.00288769 0.01979119]] Final stress: [ 2.23125956e-04 3.21244660e-04 -1.28208169e-04 -3.11674000e-03 -2.34662292e-05 -5.85996699e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-5.06976680e-04 -1.27280028e-06 -1.21988851e-04] [ 2.73958360e-03 -7.63748151e-04 6.00532065e-04] [-2.21330708e-04 -2.69145769e-03 -3.29117886e-04] [ 3.35545702e-04 -2.03087965e-03 2.00407015e-04] [ 5.76317847e-04 6.60511013e-04 1.48294707e-04] [-4.50061067e-03 -2.26602742e-03 -9.01554942e-04] [-1.19238759e-02 2.57304827e-03 8.67431289e-04] [-9.88091037e-03 -3.76663872e-03 9.95337067e-04] [ 8.66555525e-03 1.19371667e-02 -1.68973896e-03] [ 5.78792115e-03 5.98981279e-03 -1.69893979e-03] [-2.67544059e-03 -5.95308159e-04 5.17611544e-04] [-5.44481324e-03 -8.31459703e-05 1.18149613e-03] [-1.62443058e-03 3.08304663e-03 -1.78362872e-03] [ 2.75564384e-04 -2.63080674e-03 3.77144915e-04] [ 1.86675069e-03 2.72014707e-03 1.67163070e-03] [ 1.68577579e-03 -1.16806854e-03 2.00370370e-03] [ 3.69473301e-04 4.30379507e-03 5.23676454e-04] [-1.28839679e-03 -1.62896869e-03 -2.39028965e-03] [ 1.94012942e-02 -3.00711667e-03 2.35232665e-03] [ 1.15076985e-03 -3.67271848e-04 -8.87058698e-05] [-8.11418596e-03 2.52059133e-03 -2.64120794e-03] [ 7.72685772e-03 2.08352080e-03 -1.05004089e-03] [ 5.34232144e-04 -9.06389617e-03 -2.40494981e-04] [-6.19319972e-03 -1.87828291e-03 7.23732734e-04] [-1.58831269e-04 -5.35710727e-03 -2.99625611e-04] [ 5.05405498e-04 1.53916630e-03 1.24595197e-03] [-1.31634981e-03 -2.28108495e-03 6.23679600e-04] [ 1.86090783e-03 -2.20852639e-03 3.60845838e-04] [ 5.44569858e-04 -4.99795377e-03 -1.31849908e-03] [-5.70503247e-04 1.88363815e-03 -3.60576039e-04] [-6.61831020e-05 3.82864561e-03 -8.92842819e-04] [-1.18207895e-03 -1.63855224e-03 -1.08203039e-03] [ 3.83311185e-03 1.41261275e-03 1.72246427e-03] [-3.42451515e-03 1.18247937e-03 -9.85230276e-04] [ 8.17412993e-05 4.32112264e-03 4.55694909e-05] [ 1.15125485e-03 -1.61318975e-03 1.71267656e-03]] Final stress: [ 7.51857422e-03 3.69155603e-03 6.88799924e-04 1.90973804e-06 -8.99335115e-04 -7.74819581e-06] Minimization converged after 50 steps. Minimization converged after 18 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 18 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 51 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[ 5.55001105e-04 6.99570188e-04 -4.69025793e-04] [ 3.99118263e-03 -1.62566997e-03 8.23871090e-04] [ 2.11587464e-04 -3.69877424e-03 -4.02316855e-04] [ 2.46458976e-04 -3.08377174e-03 3.70192443e-04] [ 3.63783978e-04 -4.75453283e-05 2.62366650e-04] [-4.93133938e-03 -3.33811145e-03 -1.22047052e-03] [-2.31680136e-03 -3.85237521e-03 -1.51939160e-03] [ 3.16306478e-03 -2.29457726e-03 -5.72519980e-05] [-2.75787963e-04 1.79359830e-03 6.79288875e-05] [ 2.11805771e-03 2.13011666e-03 1.92887431e-03] [-1.96079038e-03 2.11174965e-03 -1.27789898e-03] [-9.73517120e-04 -1.57841561e-04 1.07380566e-03] [-2.59275823e-03 1.09698831e-03 -1.41737251e-04] [ 1.17978919e-03 -2.36888045e-03 -1.52145119e-03] [ 8.12114287e-04 1.46704120e-03 -4.78153476e-04] [ 3.55295303e-03 5.77291543e-04 4.31061814e-04] [-1.80453625e-03 3.05570635e-03 1.05894557e-03] [-1.33092083e-03 2.18258113e-04 9.11405262e-04] [ 3.80424174e-04 -9.37490507e-04 1.24482884e-03] [ 5.06343577e-03 -1.09933701e-04 -3.20178582e-04] [ 6.26835149e-04 6.08771069e-04 -2.13140618e-03] [-2.76138723e-04 -8.74889058e-05 -1.17977427e-03] [-3.33165230e-03 -3.84252442e-04 2.04832214e-04] [-3.91677576e-04 -3.97954756e-04 1.98195629e-03] [ 8.68743636e-04 2.19336375e-03 2.17655898e-03] [-1.24589896e-04 -1.01800690e-03 3.94153830e-04] [ 9.44133134e-04 1.58772764e-03 8.95428813e-04] [-1.80665883e-03 -4.53250511e-04 6.62282450e-04] [-5.84615708e-04 1.70924242e-03 3.11163577e-04] [-1.84132370e-03 -4.89693147e-04 3.32584161e-04] [-4.51588368e-04 -3.28967923e-04 -1.28324548e-03] [ 7.26425379e-04 2.41732982e-03 -1.93331136e-03] [-1.62868849e-04 2.23415236e-04 -1.34352527e-04] [ 3.22656998e-04 1.53692165e-03 -2.66805785e-03] [-7.28302983e-04 -6.45593249e-04 9.27776457e-04] [ 7.59221064e-04 1.89308735e-03 6.78006608e-04]] Final stress: [ 0.00368533 0.00187446 0.00033495 0.00153231 -0.00043361 0.00091414] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[-8.92670161e-06 9.35847331e-04 2.63315328e-06] [-2.06026705e-03 2.10624436e-03 -5.59042454e-04] [-1.04436426e-04 8.48660529e-04 9.98182804e-05] [ 3.12685811e-04 2.19310242e-03 -2.88961229e-04] [ 3.13920705e-04 3.20006899e-04 -8.33087952e-05] [ 1.14692325e-03 7.90210116e-04 2.50421877e-04] [-2.55671212e-03 -4.73569118e-04 7.54155991e-04] [ 1.97765665e-03 -4.49364303e-03 -8.12625593e-04] [ 1.09065100e-03 1.49569810e-03 5.29456898e-04] [ 5.97749099e-04 -4.57051992e-03 7.53172348e-04] [ 8.51180463e-04 4.27700175e-03 -5.69216920e-04] [-3.38571433e-03 2.18008584e-03 -4.77773929e-04] [ 3.14731105e-04 -4.42079620e-04 7.93760990e-04] [-1.18708212e-03 1.72203917e-03 -6.93958388e-04] [-2.67536900e-04 -1.20766278e-03 -4.17023478e-04] [-2.33709514e-04 -2.88629632e-04 -7.25126018e-04] [ 6.08678497e-04 -2.27749397e-03 -3.84339560e-05] [ 6.17956693e-04 5.31251530e-04 1.16068940e-03] [-7.57338214e-04 -1.69907349e-03 -3.45215558e-04] [-8.51160047e-04 8.01191302e-04 -1.02802964e-04] [ 1.11376312e-03 2.85694337e-03 8.99254859e-05] [ 1.79418402e-03 -1.39913411e-03 -5.42424910e-04] [ 3.40670217e-03 -7.00554605e-04 -2.30129734e-04] [-4.13382907e-04 -7.65582203e-04 1.09226322e-03] [ 6.42112410e-04 1.06241368e-03 -8.09625042e-04] [-1.25523012e-03 -3.47547965e-04 -1.89709922e-04] [-1.64364290e-03 5.22420597e-04 2.72463245e-04] [-1.47499489e-04 -4.79100135e-04 -6.18303466e-04] [ 4.72519235e-04 -2.31612364e-03 8.85725101e-04] [-3.80359565e-04 -4.79431247e-04 -2.51267459e-03] [-4.46579086e-04 -1.06434833e-03 1.21701435e-03] [ 6.68260619e-04 -6.32863779e-04 1.06123563e-03] [ 1.01158894e-03 8.39268807e-05 -1.34630345e-03] [ 1.30435197e-04 -4.98274673e-05 7.19828360e-04] [-1.55346046e-03 1.50680026e-03 8.69178923e-04] [ 1.81338985e-04 -5.46659097e-04 8.10917142e-04]] Final stress: [ 0.003673 0.00188114 0.00034943 -0.0015433 -0.00047061 -0.00093858] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-9.73421026e-03 -6.30346662e-03 2.31933307e-03] [ 1.86622804e-02 -8.43863712e-03 2.66393494e-03] [ 7.65848523e-03 2.13799040e-02 3.09124869e-03] [ 1.44629720e-03 -2.53997557e-02 4.68898267e-03] [-1.33587559e-02 3.78227694e-03 1.86213145e-03] [ 1.89345121e-02 3.36632715e-03 2.97129951e-03] [-4.41588278e-02 -9.58830135e-02 -1.06274965e-02] [-8.17343752e-04 -4.06010709e-03 -1.35238468e-02] [-2.83544504e-02 2.92605140e-02 4.73326001e-03] [ 4.41554003e-02 9.34753648e-02 6.15197758e-03] [ 6.49645496e-03 4.56389741e-03 4.53624467e-04] [ 2.48784524e-02 -2.35241905e-02 -1.09177363e-03] [ 9.95586908e-03 -7.92197066e-03 7.99977801e-04] [-2.84184227e-04 1.13431379e-02 -4.34041630e-03] [-7.04385685e-03 -1.66527501e-03 5.97418319e-03] [-7.61170324e-03 -1.61232300e-03 -2.77954949e-03] [ 6.78086221e-03 -4.20854692e-03 5.70970797e-05] [-4.34820553e-03 4.85835247e-03 -6.58544505e-03] [-3.48727836e-03 7.46907595e-03 3.23815465e-03] [ 4.04855308e-02 1.40378451e-02 2.18161986e-03] [ 3.52820388e-02 5.56145749e-02 -1.63866525e-02] [-8.16645341e-04 -2.25578544e-03 -1.24506178e-03] [-3.05619673e-02 -2.96767814e-02 -1.97388106e-03] [-2.84202686e-02 -5.83011728e-02 2.12132402e-02] [-1.08613170e-03 -3.65857048e-03 1.57352907e-03] [-1.40859326e-02 1.05450078e-02 -1.68751299e-02] [-8.09518632e-03 -1.20439754e-02 -1.29018159e-02] [ 1.25814957e-03 -5.55162542e-03 -3.38118981e-03] [-4.86113263e-03 1.45731017e-02 4.44053635e-03] [ 2.18081282e-02 5.09526553e-03 1.66128152e-02] [ 3.47079800e-03 8.18291646e-03 4.89093177e-03] [ 9.89315323e-03 -7.51729279e-04 1.11374681e-02] [-2.52763139e-03 1.73578147e-02 9.49709407e-03] [-1.18355794e-02 8.19858528e-03 -3.33703751e-03] [ 3.93724275e-03 -1.22760639e-02 -4.53929486e-05] [-3.36143638e-02 -9.57097188e-03 -1.54577505e-02]] Final stress: [-0.00439828 -0.002614 -0.00033816 0.00161909 0.00064381 0.00100794] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-7.21420142e-05 -3.13342208e-04 1.51079163e-04] [-4.54126598e-05 2.05603712e-04 4.01994138e-05] [ 9.85935380e-05 1.59574847e-04 -1.26686553e-04] [ 1.39342462e-04 1.48749119e-04 -2.75808293e-04] [ 5.86495293e-06 1.15799697e-04 -5.07088216e-05] [ 4.05518016e-05 -2.18839803e-04 6.71874204e-05] [-2.72829411e-04 -6.18026706e-04 2.28256443e-04] [ 6.08143843e-05 -1.12398668e-04 -3.28121668e-04] [ 1.00756005e-03 -9.48058599e-04 7.18594965e-05] [ 1.37694114e-04 1.50793845e-04 -1.38267291e-04] [-4.73463848e-04 4.03535960e-05 -1.24848208e-04] [-6.02773943e-05 6.63301570e-04 9.52982413e-06] [ 3.78179258e-05 1.28318616e-04 -8.77403375e-06] [-3.69311703e-05 4.23352538e-05 1.49120164e-04] [ 3.22979513e-05 6.46686650e-05 -1.79475766e-04] [-1.24183136e-04 -5.64462671e-05 5.88128528e-05] [-7.08668884e-05 7.22679997e-05 9.19435934e-05] [ 1.42256175e-04 1.52129384e-04 -8.36580861e-05] [-9.02565984e-04 -2.04232036e-05 2.23398976e-04] [-7.14597720e-04 1.54027448e-03 -2.69912956e-04] [ 4.30401885e-04 -8.97118254e-05 2.99735758e-05] [-3.50423010e-04 -8.79606124e-04 9.16642278e-05] [ 1.41077523e-04 5.05345031e-04 -8.49623846e-05] [ 2.26878865e-04 -5.77755526e-04 -4.40890450e-05] [-3.19243328e-05 -1.60691573e-06 -2.65830036e-05] [ 1.95230187e-05 -1.76123582e-05 5.44253005e-05] [ 1.80516617e-04 1.32909695e-04 -1.03681992e-04] [ 2.16449941e-04 2.42935468e-04 4.90923713e-05] [ 8.91697127e-05 -1.04724002e-05 1.41673037e-04] [ 6.35655250e-05 -9.70946884e-05 -1.95488188e-05] [ 3.13544834e-06 -5.27097793e-05 8.33850236e-05] [ 3.36377808e-05 -9.66220774e-05 1.46920699e-05] [ 1.47530923e-04 -7.82750978e-07 -3.92060009e-05] [-2.09578544e-04 -7.51588291e-05 1.99586458e-04] [ 6.59832994e-05 6.82070309e-05 5.91500563e-06] [ 4.45322231e-05 -2.46899276e-04 1.42538505e-04]] Final stress: [ 0.02659317 0.02777632 0.01666078 -0.00137615 0.00027296 -0.00054948] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[ 1.42109457e-03 -1.49590953e-03 -3.20424614e-04] [ 1.96110318e-04 -1.58100514e-03 2.95051029e-04] [-6.99023138e-04 -3.67872338e-03 -5.32708739e-04] [ 7.97525757e-04 -2.30831865e-03 3.09797566e-04] [ 1.91075268e-03 -3.14783335e-03 -2.74981374e-04] [-2.78682176e-03 -3.60014914e-03 -7.32287530e-04] [ 4.28815353e-03 -1.08609339e-03 1.33482740e-03] [ 8.80307556e-05 8.89383567e-03 2.60925746e-04] [-4.24449190e-03 -9.16011902e-04 -2.38042123e-04] [-2.46435622e-03 2.33752804e-03 -7.85692038e-04] [-2.24192560e-04 -2.74643862e-03 3.80903993e-05] [ 1.96643457e-03 2.99875969e-03 7.30049484e-04] [-2.56164402e-03 1.10096152e-03 2.60247300e-03] [-6.41511261e-05 2.91866755e-03 6.65209811e-04] [ 2.66653675e-03 8.75453267e-04 -2.05511305e-03] [ 4.15851041e-04 8.20244162e-04 -2.17822092e-05] [-5.49270864e-04 1.72690427e-03 -3.07767627e-04] [-5.53156069e-05 4.63988508e-04 -6.80243793e-06] [-5.03339758e-04 1.92683553e-03 3.69054229e-03] [ 1.92489858e-03 -5.70879375e-04 5.36832117e-04] [-1.22230591e-03 -1.70057215e-03 -2.51625917e-03] [-1.52496593e-03 2.68203103e-03 4.19528001e-03] [ 1.69422390e-04 1.89258441e-03 -3.94638769e-04] [ 1.48511406e-03 3.77303104e-03 -5.85761861e-03] [-1.78972573e-03 3.27806442e-03 1.38713168e-03] [ 3.31501148e-04 -6.14923140e-04 -2.12287809e-03] [ 2.94800871e-04 -1.58777079e-03 5.38233565e-04] [ 4.68330019e-04 -1.09169941e-03 -1.65999931e-03] [ 1.63718884e-03 1.92113791e-03 -1.66326782e-03] [-1.13147137e-03 -1.93819088e-04 1.25188199e-03] [-3.64694040e-03 -3.88271304e-03 2.41922388e-03] [-1.28620390e-03 1.64201996e-03 -2.57713159e-03] [ 1.37884031e-04 -3.42121218e-03 -1.34236331e-04] [-5.43056518e-04 -4.57607195e-03 4.98322478e-04] [ 2.82494339e-03 -2.92856095e-03 -1.82946848e-03] [ 2.27270339e-03 1.87665818e-03 3.27722747e-03]] Final stress: [ 2.74073211e-03 2.74639210e-03 3.36356380e-04 -2.49191470e-06 1.06525056e-03 1.51597962e-05] Minimization converged after 45 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-1.74618055e-01 -6.14585746e-02 1.34722953e-02] [-2.09435482e-02 1.56814664e-01 -8.11439201e-03] [ 5.72134185e-02 -8.15318995e-02 -1.11142284e-02] [-1.18697075e-01 -1.84850210e-01 2.37741289e-02] [ 1.50385827e-01 -4.54370840e-02 -9.51151675e-03] [ 7.33426568e-03 2.08313627e-01 1.08011036e-02] [ 5.50325920e-01 -1.78419164e-01 -7.68708104e-02] [-1.14208811e-01 3.82702102e-01 -6.37962079e-03] [-4.17533297e-01 -2.49210966e-02 7.00150487e-02] [ 8.41000674e-02 9.75167959e-01 -7.80280966e-02] [ 6.30043083e-02 -7.88715826e-01 6.61618368e-02] [-4.33168048e-01 1.07009932e+00 7.61717610e-03] [-2.00591131e-02 4.99860455e-03 -2.24131165e-01] [-6.89092202e-04 -1.48757377e-01 1.71056038e-03] [ 9.55850631e-03 1.12645889e-02 2.19090845e-01] [-3.23167833e-03 3.60329054e-02 -1.13796077e-01] [ 8.35937600e-03 -8.26086111e-02 -1.90266139e-02] [ 8.17202540e-03 5.65432482e-02 1.31686576e-01] [-2.78266804e-01 2.99078994e-01 -2.72640496e-01] [ 3.59161330e-01 -7.72802424e-01 -2.59425284e-02] [-7.66179645e-02 -3.41513685e-01 2.80692684e-01] [ 8.16202021e-01 -1.21658089e+00 -1.67889605e-01] [-3.15573918e-01 -4.60868577e-01 1.47997942e-02] [-2.09928780e-01 -3.13551086e-01 1.79139382e-01] [ 6.16865227e-02 7.99118222e-02 8.92022035e-02] [-4.90157974e-03 -1.41342145e-02 1.75082623e-01] [ 5.96686918e-02 2.62118680e-01 7.72580314e-02] [-5.20061374e-02 2.73965646e-01 -7.11198731e-02] [-7.87928535e-02 1.34193253e-01 -7.19942463e-02] [-2.71275539e-02 -2.01980893e-02 -1.72091317e-01] [ 1.23080649e-01 2.21502374e-01 -3.76558566e-01] [ 1.35183345e-01 1.01353172e-01 -9.65412915e-02] [-8.12324402e-02 1.47665005e-02 1.36941599e-01] [ 9.32099006e-02 8.86524652e-02 -5.09764741e-02] [-9.09248414e-02 2.29209597e-01 2.56502305e-01] [-6.81245838e-02 1.29659284e-01 9.87787269e-02]] Final stress: [-0.01074005 -0.01359907 -0.00238265 -0.00029229 0.00015744 0.00586729] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 4.37021265e-03 2.60304057e-03 -9.67288504e-04] [-6.04701578e-04 -1.60984954e-03 -1.64487668e-05] [-5.14868000e-04 1.15987567e-03 1.11160739e-04] [-1.27039609e-03 -1.16637914e-03 2.94764207e-04] [ 2.53889677e-03 -6.55561674e-04 -3.53877543e-04] [-6.45695251e-04 1.38574269e-03 1.13102757e-04] [ 1.61387924e-04 3.66555971e-03 -1.65305097e-03] [ 4.91982821e-03 -3.39076475e-03 4.50240078e-03] [ 4.98938532e-03 -3.67623153e-03 3.46220588e-03] [-1.73562311e-03 6.70410256e-03 -9.63548117e-04] [-8.49803230e-03 -3.67555124e-03 4.21613680e-04] [ 1.86012506e-03 8.33462537e-03 -6.01941677e-03] [-2.05514835e-03 3.62967952e-03 -1.86949142e-03] [-6.30082097e-04 2.67016729e-04 -3.31096555e-04] [ 2.51521683e-03 -1.19517307e-03 -5.08950176e-03] [ 2.87087465e-03 -3.75546444e-03 8.73148112e-04] [-2.28490968e-04 -7.45028025e-04 1.63462415e-03] [-1.63292626e-03 1.15087697e-03 3.77494238e-03] [-5.66087212e-03 -2.84603635e-03 -6.78925550e-05] [-3.79151193e-03 4.47132689e-03 -4.93105253e-04] [-2.58326062e-03 -3.67403500e-03 2.26047810e-03] [ 2.38909811e-03 8.40411074e-04 2.81914082e-04] [-7.44288346e-04 -4.25514156e-03 -9.30316862e-04] [ 1.48920679e-03 -1.92056199e-03 -1.63313295e-03] [ 1.62152516e-03 -3.87583513e-04 -2.47577025e-03] [ 1.95618996e-03 1.36481225e-03 -8.59549684e-04] [ 3.26173014e-04 1.22481600e-03 -3.00008201e-04] [ 1.76292800e-04 -1.08852032e-03 -3.90579231e-03] [ 1.02063650e-03 -4.07146477e-03 -4.22489905e-03] [ 8.40514885e-04 9.48876996e-04 -2.27686187e-03] [-7.66742579e-04 -1.43803876e-03 -3.81828515e-04] [-2.56604595e-03 -8.72533393e-04 2.50948738e-03] [ 1.27864891e-03 -2.30638648e-03 3.32459479e-03] [ 1.48633334e-03 9.22504259e-04 6.89941435e-03] [-2.02153113e-03 4.66895757e-03 8.25023483e-04] [-8.60330193e-04 -6.11919312e-04 3.52400303e-03]] Final stress: [ 0.00361523 0.00183584 0.00031545 0.00093541 -0.00048264 0.00181915] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 4.29464803e-03 3.90066519e-03 -8.43243373e-04] [ 3.94510120e-03 -1.22417829e-03 9.37758774e-04] [-1.95244432e-03 -2.99955152e-03 -2.65487758e-04] [-1.08174807e-03 -2.91441247e-03 1.71511343e-04] [ 7.58465211e-03 -6.84282666e-03 -1.53246682e-03] [-3.73730811e-03 -2.85105073e-03 -1.05704322e-03] [-7.59401744e-03 -2.19625392e-02 6.74968488e-03] [ 1.05916822e-02 4.08819782e-03 -7.54999452e-03] [-1.31915122e-03 -3.74983818e-03 5.56800091e-03] [ 1.29481118e-02 2.07995786e-02 -2.46269776e-03] [-8.91048246e-03 -8.78310797e-03 2.56646897e-03] [ 5.80444489e-03 9.76641840e-03 -2.81564802e-03] [ 1.48655111e-03 -7.21067637e-04 1.32810722e-03] [-1.82176685e-03 5.88696254e-03 -8.64432100e-04] [ 7.63817712e-03 2.25131232e-03 -3.73610590e-03] [ 2.15151477e-04 -7.70362112e-04 2.42941947e-03] [-2.01169778e-03 -9.72825658e-04 -3.04082548e-03] [-7.11934709e-03 -1.09477523e-03 5.06459622e-03] [ 1.66255689e-02 -1.54674926e-02 7.13487289e-04] [ 4.53595311e-03 3.45936940e-02 -3.48820613e-03] [-9.20662261e-03 1.55537393e-03 4.39529103e-03] [-1.66482673e-02 1.54036752e-02 3.64058471e-03] [-2.79897606e-03 -3.16087571e-02 -2.68132447e-03] [ 1.11488495e-02 -7.88112020e-05 -3.65023432e-03] [-1.06603252e-02 -9.76973998e-03 4.29883553e-03] [-5.44644490e-03 6.93877403e-04 -2.42623471e-03] [ 4.05378942e-03 -3.00884043e-03 -4.83384935e-03] [ 1.22729117e-03 4.50264365e-03 -1.94713007e-03] [-5.93067333e-03 7.92721455e-04 2.81133515e-03] [-3.44771627e-03 -4.52047475e-03 -7.37919282e-03] [ 2.80616697e-03 1.27070392e-02 -9.63825811e-05] [ 1.55181013e-03 6.02077417e-04 -1.38933806e-03] [-5.23749817e-03 7.82330234e-03 3.91606248e-03] [-5.13154941e-03 -7.31347545e-03 1.80604870e-03] [ 5.34097455e-03 -1.31889157e-03 5.55513067e-04] [-1.74288712e-03 2.60547914e-03 5.10713173e-03]] Final stress: [ 0.00388467 0.00202693 0.00030732 -0.00095894 -0.00047139 -0.00190429] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 5.11927889e-03 1.12090490e-03 -1.12624358e-03] [ 4.30589478e-04 -8.88796078e-04 3.52466692e-05] [ 2.71250377e-03 1.29592415e-03 9.75465203e-05] [ 1.59520199e-03 -5.12237697e-03 1.11542373e-03] [ 1.03035158e-03 8.67285297e-06 -2.43549611e-05] [ 3.60675268e-04 -2.90561659e-03 -7.82219228e-05] [-3.19906204e-04 2.58361467e-03 4.09946212e-04] [ 2.82716676e-03 -5.09436805e-05 -2.56114035e-03] [-1.96775427e-03 -6.24504594e-04 2.58560230e-03] [-7.24833141e-04 6.51492709e-06 -4.32115876e-04] [-2.81547076e-04 -5.99858459e-04 1.80800193e-03] [-4.09079869e-03 4.85365532e-03 -1.92860463e-03] [ 3.01823359e-03 -4.27331539e-03 2.37456496e-04] [ 9.74681874e-04 8.41695206e-03 6.46602227e-04] [-4.76871034e-03 -8.00238475e-03 -2.68322725e-03] [-2.35102045e-03 4.89175144e-03 -3.03542501e-04] [ 3.20172862e-04 -5.87902684e-03 2.67030775e-03] [ 1.43606427e-03 5.60757109e-03 -6.49551444e-04] [-8.55576026e-03 -3.08253137e-04 -9.96691138e-04] [-1.62849534e-03 -5.43414562e-03 2.08436353e-03] [ 1.25760074e-03 -3.42644100e-04 -3.31696737e-03] [ 3.01350829e-03 3.64571224e-03 1.11164038e-03] [ 1.73472082e-03 1.82712155e-03 2.51233838e-03] [-5.01788076e-03 2.44094495e-03 -1.41019890e-03] [-2.14756350e-03 -1.15108377e-03 2.80810772e-03] [ 2.34380965e-03 -5.20565592e-04 1.04857553e-03] [ 1.44029855e-03 -3.90323490e-03 -2.98177596e-03] [-2.57640583e-03 4.20692896e-04 -3.49840578e-03] [ 1.51377537e-03 1.08479287e-03 1.01261495e-03] [ 3.09903104e-03 2.06542972e-03 1.91310161e-03] [ 1.23892828e-03 2.73123634e-03 4.71364365e-04] [-8.14677484e-04 4.68483940e-04 -8.67983345e-04] [-9.72970173e-04 3.17175987e-05 -7.22772221e-04] [ 9.72920439e-04 -5.40025995e-04 2.76692940e-04] [-6.41274239e-04 -2.29947555e-03 -1.16436504e-03] [ 4.20084253e-04 -6.55441487e-04 1.90122903e-03]] Final stress: [-0.00454686 -0.00251746 -0.00052325 0.00101647 0.00050911 0.00189004] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 7.70945867e-04 9.72999905e-04 -1.37171131e-04] [-9.27517767e-04 9.24927432e-04 -1.69154489e-04] [ 2.54795224e-04 4.72538429e-03 9.60011617e-04] [ 3.70182726e-04 -8.69005919e-04 1.26696736e-04] [ 4.70421736e-03 -2.42257032e-03 -1.03674593e-03] [ 1.32007025e-03 1.92748615e-04 1.22952963e-04] [ 3.27150134e-03 -6.55942403e-03 3.11773889e-05] [ 3.06438811e-04 2.34572793e-04 1.16466777e-03] [-1.49345368e-03 -4.92864722e-04 -1.11050413e-03] [ 1.75794926e-03 1.29807976e-03 -5.97067222e-04] [-7.24836847e-04 1.26690216e-03 -5.45569421e-04] [-2.07766468e-03 1.06434570e-03 1.09258420e-03] [-1.57055541e-03 -3.50237631e-03 -2.49826298e-04] [ 3.68703554e-04 -2.83386819e-04 2.86077055e-03] [ 1.86494911e-03 -2.34711985e-03 -1.35945814e-03] [ 7.85605345e-04 6.85657797e-05 5.79496837e-04] [-2.39314942e-03 3.96290463e-03 -2.97849344e-03] [-1.09775179e-03 1.02552775e-03 1.22576526e-03] [ 3.55789325e-03 -3.63894348e-03 7.69378884e-04] [-6.94719314e-04 -1.12767487e-05 1.81117666e-04] [ 1.00774783e-03 9.77192614e-04 1.38455800e-03] [-4.81057412e-05 -1.75242433e-04 -7.61482573e-04] [-1.75560256e-03 5.20864695e-03 -4.84821795e-05] [-5.91057586e-03 -4.85086913e-04 -1.53028975e-03] [-7.75730415e-04 1.68305577e-03 -1.15796419e-03] [ 5.76238505e-04 -2.84117414e-04 1.68111665e-03] [-1.00497657e-04 -1.86088980e-03 2.27077329e-04] [-1.53275943e-03 6.23980061e-04 6.74437401e-04] [-1.04897203e-03 -2.23486539e-03 1.01394956e-05] [-9.12858042e-04 4.29724850e-05 -2.86365240e-03] [ 3.82374785e-04 -1.41242306e-03 1.15633957e-03] [-7.40815743e-05 -8.31182726e-05 -1.78034319e-03] [-3.81855665e-04 2.85924302e-04 -3.11597209e-04] [ 1.56014390e-03 -2.04184400e-04 -4.45740276e-04] [-3.30318592e-04 2.53675899e-03 -2.29682495e-04] [ 9.91249344e-04 -2.28594098e-04 3.06493613e-03]] Final stress: [-0.00451472 -0.00258119 -0.00051478 -0.00101076 0.00050869 -0.00189817] Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 48 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[-7.45375206e-04 -7.97981498e-04 2.21630869e-04] [ 8.56668334e-04 -3.39676424e-04 8.76402181e-05] [ 1.90533985e-05 4.17863523e-03 6.08411914e-04] [-4.21703706e-05 -2.56450985e-03 4.78262750e-04] [-1.11729387e-03 3.48477488e-04 1.19731700e-04] [ 2.19238587e-03 7.30739176e-04 3.56737608e-04] [ 5.78628406e-04 8.68224870e-04 -3.89295943e-04] [-1.93943763e-03 9.09296393e-04 -8.52541710e-04] [-4.16929982e-03 -4.55066201e-04 8.09019309e-04] [-5.11850017e-04 -1.19040469e-03 2.94415052e-05] [ 2.74159467e-03 -9.00945500e-04 1.89658319e-04] [ 4.29104809e-03 6.81782541e-04 -6.34243229e-04] [ 7.04087845e-04 -2.88693050e-04 8.36944292e-04] [-6.57775611e-04 1.19177610e-03 1.93372695e-04] [-4.82418144e-04 8.70064369e-04 1.13132066e-03] [-1.41196015e-03 -1.15939045e-03 -6.03489673e-04] [ 9.74836663e-04 -1.20006239e-03 -5.72147437e-04] [ 1.01110150e-04 4.97199705e-05 -8.79813465e-04] [ 7.87736670e-04 4.31128609e-04 8.34754495e-04] [ 6.67838928e-04 -2.72127531e-03 4.85555073e-04] [ 2.05615275e-03 -1.40082685e-03 4.85755247e-04] [-1.31024520e-03 -5.23282785e-04 -3.73225564e-04] [-5.74379063e-04 2.54707149e-03 -1.82617985e-05] [-2.08844576e-03 9.54523568e-04 -3.86993171e-04] [ 1.51923544e-03 8.22237647e-04 -1.20346023e-03] [ 7.31311159e-04 2.37151483e-03 -1.56276585e-03] [-8.88225673e-04 1.77905574e-03 -1.89202470e-03] [-3.69388735e-04 -1.84240878e-03 3.85200911e-04] [ 8.70776592e-04 -1.77556507e-03 4.62293433e-04] [-4.30689265e-04 -4.24239481e-04 -5.99194872e-04] [-1.38202048e-03 -8.40221118e-04 1.56538053e-03] [-7.40877350e-04 -1.74945357e-03 8.40864347e-04] [ 1.48383472e-04 -1.87193956e-03 1.19072773e-03] [-1.49128187e-04 1.65593250e-03 -1.16179730e-03] [-6.45216329e-04 2.04523089e-03 -2.69887646e-04] [ 4.15348416e-04 -3.89468831e-04 8.64389799e-05]] Final stress: [0.00184379 0.00366177 0.00036381 0.00154099 0.00047251 0.00095309] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-1.60582349e-03 -4.93584268e-05 2.01660196e-04] [ 2.01313178e-03 -8.41744071e-04 3.56053467e-04] [ 6.19818115e-04 2.29261112e-03 4.49137010e-04] [ 1.01176620e-03 -2.72998482e-03 4.16509783e-04] [-1.54725181e-03 5.27717527e-04 3.41290563e-04] [ 1.31816858e-03 8.00366719e-04 2.12554721e-04] [ 1.47921798e-03 5.90184522e-04 2.48368470e-03] [ 3.77948161e-03 1.61332461e-03 -6.53684821e-04] [-2.27598260e-03 2.67690663e-03 -7.34481610e-04] [ 3.26890781e-04 1.05158134e-03 -3.14558329e-03] [-9.15013991e-05 -1.33603601e-03 -2.65752056e-03] [ 5.92922997e-04 -4.20221398e-05 -2.62750375e-04] [-2.08623662e-03 1.25387975e-03 -4.53640124e-04] [-4.39358271e-04 -1.29575710e-03 -2.30143113e-03] [-7.77232422e-04 1.70704494e-03 4.45630817e-04] [ 2.08938185e-03 -1.44532342e-03 -6.87194464e-04] [-1.89127460e-04 1.37664546e-03 1.33585351e-04] [ 7.73737110e-04 -1.30364143e-03 -1.71456737e-03] [ 1.14139279e-03 1.28045600e-03 1.88596449e-03] [ 3.83599072e-03 2.26472108e-03 1.14866263e-03] [-6.26951354e-03 -4.06103978e-03 1.36244734e-04] [-6.20091727e-04 -2.28429305e-03 -1.84800707e-03] [-3.31528397e-03 -3.81344663e-03 -1.41425222e-03] [ 3.91237915e-03 2.87094074e-03 -4.37300253e-04] [ 6.66221284e-04 1.96463078e-03 2.37549601e-03] [-2.12605040e-03 -4.34413274e-04 -7.54324191e-04] [-1.42241629e-03 1.02442375e-03 -2.72863195e-04] [-1.65409426e-03 -1.07277658e-03 1.66159876e-03] [-1.90475656e-04 -7.97438715e-04 -1.76134896e-03] [ 5.16622995e-04 -2.23354669e-03 -2.52193780e-03] [-5.42746837e-04 -1.64267178e-03 2.01416802e-04] [ 7.36065417e-04 1.26194956e-03 1.73784730e-03] [ 5.48771523e-04 -1.53612917e-03 7.75811170e-04] [ 5.35647152e-04 1.13386611e-03 -1.17359363e-03] [ 6.77506100e-04 -1.35707915e-04 4.49441110e-03] [-1.42192738e-03 1.36408037e-03 3.33692146e-03]] Final stress: [ 0.00192115 0.00369404 0.00033812 -0.00156533 0.00049676 -0.00088988] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 5.92489736e-05 1.83512967e-04 6.37114092e-05] [ 1.63634232e-03 -8.48835479e-04 2.50001871e-04] [-2.61774730e-06 2.42230225e-03 2.68584084e-04] [-4.07030866e-06 -1.79551288e-03 2.53593486e-04] [-2.86587220e-03 1.69553849e-03 3.77922225e-04] [-1.56716941e-03 -8.19810758e-04 -2.08119079e-04] [-6.15075083e-04 -1.07683972e-03 6.96493351e-04] [-6.02371818e-04 2.78759067e-04 -9.78132614e-05] [-1.86760963e-04 -2.03758404e-04 -6.74417238e-05] [-4.81554493e-04 -1.45909190e-03 -8.70758986e-04] [-2.07274768e-03 2.28366206e-04 -1.16971620e-04] [ 1.64920845e-03 -1.99363579e-03 -3.36228509e-04] [ 5.15845826e-04 -1.04063982e-03 1.50589389e-03] [ 2.53353161e-04 8.69244427e-04 1.48162752e-03] [-2.07474463e-04 2.54542108e-04 -2.47464843e-04] [-6.67196260e-04 6.12316431e-04 -1.84065141e-03] [ 3.94857072e-04 -1.13765686e-03 -1.84331883e-03] [ 3.62464982e-04 1.52732581e-04 3.55542597e-04] [ 8.15426740e-04 2.36580838e-04 1.37412352e-03] [-6.25802451e-04 1.07085418e-03 1.44399637e-03] [ 4.36796583e-05 1.82985397e-04 6.30866845e-04] [ 3.56403252e-04 1.25733749e-04 -1.29640469e-03] [ 3.95261521e-04 1.01639595e-03 -1.23050739e-03] [ 2.45017859e-03 7.39192809e-04 -4.70128092e-04] [-1.49827302e-04 -1.13203444e-04 2.61511092e-04] [-1.67662781e-03 4.22243738e-04 4.10939421e-04] [ 2.59089909e-03 -3.70202867e-04 -5.06794571e-04] [-1.07218596e-03 6.11809494e-04 1.27083187e-03] [-1.69916046e-04 -1.09866739e-03 -7.49541073e-04] [ 5.90886841e-05 7.97866352e-04 6.23390373e-04] [ 8.84004271e-04 -1.38390072e-04 -4.53584140e-04] [ 1.66570288e-03 8.32746436e-05 -3.98213759e-04] [-2.45447014e-03 4.02592556e-04 6.89911704e-04] [ 8.38709874e-04 -2.22630945e-04 -1.26072926e-03] [ 4.15562178e-04 1.25658164e-03 7.80850544e-04] [ 3.55026222e-05 -1.32454955e-03 -7.45120940e-04]] Final stress: [-0.00262602 -0.00445144 -0.00049046 0.00151156 -0.00048209 0.00101186] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-2.73195216e-03 -1.37251394e-03 3.53440653e-04] [ 2.90234134e-03 -2.03842161e-03 6.31358190e-04] [-2.62301153e-04 1.58609236e-03 2.95160762e-04] [-1.45080696e-04 -2.62007249e-03 3.73059881e-04] [-1.81626084e-03 1.36842002e-03 4.30063152e-04] [ 2.05801004e-03 1.68576157e-03 3.81202080e-04] [-4.15706829e-04 -2.76346388e-03 -3.35353933e-04] [-7.17423755e-03 2.03050611e-03 -3.85325182e-04] [ 1.70429580e-03 -2.57002808e-03 -2.17268830e-03] [-1.41319743e-03 9.53671526e-05 -2.94063271e-04] [ 4.71805854e-03 -7.99940440e-04 4.30406345e-04] [-1.19618740e-04 -8.51909052e-04 1.05743800e-03] [-1.08857355e-03 6.05908356e-04 1.89569730e-03] [ 1.02649063e-03 2.89536473e-04 2.58320683e-04] [ 7.65034120e-04 1.24321974e-03 -1.94031615e-03] [ 6.58743936e-04 -1.50248226e-03 -2.34378041e-03] [-6.56948127e-06 3.63213073e-05 -5.73060185e-04] [-1.42523086e-03 -4.46219332e-04 1.57137341e-03] [ 1.01225670e-03 2.42257169e-03 -1.41670585e-03] [ 2.03268061e-03 2.29453885e-03 -1.22332056e-03] [ 2.98984256e-03 -2.97920820e-03 1.29106448e-03] [-1.11126707e-03 -2.89199166e-04 1.63936070e-03] [-1.57946209e-03 1.01514555e-03 1.40206996e-03] [-1.47008686e-03 2.89598286e-03 -6.74190441e-04] [ 1.49364505e-03 -8.14187733e-04 -2.59521879e-03] [ 8.22409240e-04 1.56544402e-03 7.00406797e-04] [-9.96547872e-04 -1.32664086e-05 1.37323308e-03] [ 3.69427988e-04 6.81119328e-04 3.43901786e-04] [-1.49815670e-03 2.98800043e-03 1.04171147e-03] [-9.55249546e-04 3.32575793e-04 -1.11901185e-03] [-6.87554204e-04 2.52828109e-04 1.87146855e-03] [-8.43570766e-04 -7.97111797e-04 -5.01378386e-04] [ 4.88203866e-04 -5.20035822e-04 -1.20047435e-03] [-7.73350922e-04 2.11506236e-04 -1.39308689e-04] [ 2.41926786e-03 -2.36387720e-03 -1.35213237e-03] [ 1.05326703e-03 -8.58908554e-04 9.25591424e-04]] Final stress: [-0.00260541 -0.00447531 -0.00046959 -0.00150673 -0.0005299 -0.00096949] Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 47 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 1.07176004e-02 5.15503208e-03 -2.24073972e-03] [ 5.09392497e-03 -2.67881897e-03 7.33750360e-04] [ 1.24016306e-03 3.82338325e-04 2.67018936e-04] [ 2.98494876e-04 -1.08412273e-02 2.04012255e-03] [ 4.21730162e-03 -3.93401044e-03 -7.00750900e-04] [ 3.24466022e-04 -1.63344419e-03 -3.00659653e-04] [ 9.84590459e-03 -9.72438893e-03 7.09761370e-04] [ 2.47793746e-03 1.87413386e-03 -2.16291216e-04] [-2.31039159e-02 3.05751867e-04 3.03671961e-03] [ 1.05914836e-02 7.45446904e-03 -8.05860815e-04] [-4.89176097e-03 1.36679798e-02 -1.99334637e-03] [-4.40211649e-04 4.68583789e-04 -7.50723402e-04] [ 2.32701576e-03 -5.35061814e-03 -5.01910890e-03] [-8.22052272e-03 8.97333608e-03 -1.25265721e-03] [ 2.04995855e-03 -3.82635559e-04 -3.74946110e-03] [-2.69232083e-03 5.42998601e-03 5.34163062e-03] [ 4.38240519e-03 -8.47203048e-03 1.57007096e-03] [-3.43380361e-03 3.58523482e-03 3.03877747e-03] [-1.03820079e-02 1.98051737e-03 8.92089961e-05] [ 1.26269444e-02 1.02843078e-02 -5.58404013e-03] [ 6.24964770e-03 3.10954109e-03 -2.17471557e-03] [-7.60545575e-03 5.56014808e-03 1.14807872e-03] [-1.06938003e-02 -3.10440157e-02 5.76425536e-03] [ 8.64992306e-03 1.32443787e-03 8.38703260e-04] [ 4.22596688e-04 -3.10791508e-03 4.54490374e-03] [-2.07451072e-04 2.40484414e-03 -2.20326581e-03] [ 4.77067854e-03 -5.68845556e-03 -3.63264628e-03] [-4.52763492e-03 -4.56778834e-04 -2.65286902e-03] [-6.03880393e-03 -9.71965860e-04 -2.43261325e-03] [ 4.92336903e-03 -8.89121244e-04 9.71243953e-04] [-3.20228313e-03 4.49981505e-03 -8.40811194e-04] [-2.63061284e-04 7.18847891e-04 5.96630670e-05] [-5.79517507e-03 5.76231022e-03 3.85699253e-03] [ 2.52893511e-03 9.03239688e-04 -1.68100475e-04] [ 3.73247739e-03 -1.98512238e-04 3.23998295e-03] [-5.97301907e-03 1.52908360e-03 -5.32223447e-04]] Final stress: [0.00183974 0.00393146 0.00032463 0.00092308 0.00049182 0.00186501] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-6.13076303e-02 7.39033609e-02 -3.95289816e-02] [ 5.21090173e-03 -4.29497415e-02 -8.64397606e-04] [-3.23000832e-02 -1.61955541e-02 -9.99485318e-02] [ 7.33443127e-02 2.28782437e-02 -1.52779387e-03] [ 1.99541789e-02 2.72697757e-02 -1.38071264e-03] [ 4.37042221e-02 -4.56899496e-02 -1.03480294e-01] [ 6.59226014e-01 6.13308894e-01 4.19812728e-02] [ 1.03016923e+00 -2.83402235e-01 9.17887815e-02] [ 2.24548985e-01 -3.58600613e-01 -3.11794308e-02] [-2.10444343e-03 -2.92395490e-01 -1.42322242e-01] [ 1.18151932e+00 3.32288208e-01 -2.58493906e-02] [-5.55467669e-01 5.79666514e-01 -4.01224911e-02] [ 3.03018199e-02 -5.91651517e-02 7.88219003e-02] [-3.88703904e-02 3.50782185e-02 -5.06070164e-03] [-5.96615479e-02 6.01910564e-02 -8.05760972e-02] [ 1.13597893e-01 1.07758782e-01 -1.64485806e-01] [-4.24199269e-02 7.43680629e-02 1.04713140e-01] [ 8.39407849e-02 4.97602233e-03 -8.73982499e-02] [-6.84759254e-01 5.17756066e-01 -1.73227527e-01] [-7.99679233e-01 -6.42999166e-01 2.41495043e-04] [-4.53581762e-01 1.31864424e-01 9.40657612e-02] [-6.82757718e-01 -1.72466813e-01 3.90202238e-02] [ 1.63093759e-01 -1.12351504e+00 7.55467987e-02] [ 6.58395384e-02 6.09824097e-01 4.15273354e-02] [ 7.20280893e-02 -1.48607990e-01 5.62748307e-02] [-6.67851332e-03 -1.15677021e-01 9.69231954e-02] [-1.92601238e-01 1.61115513e-01 6.72165481e-02] [-6.84027043e-02 2.00710893e-02 -1.48245928e-02] [ 1.19369281e-01 -9.54962838e-02 -1.59728622e-01] [-1.30876469e-01 3.17055448e-02 4.83200930e-02] [-3.50117631e-03 -1.07971562e-02 -4.52827565e-03] [-2.95880278e-02 -4.05987910e-02 8.75714483e-02] [-6.40793455e-02 3.93010855e-02 1.88259611e-03] [-4.74499449e-02 2.89038541e-02 2.20935493e-01] [ 5.10829335e-02 -1.49196696e-01 3.25083069e-02] [ 1.91558150e-02 1.25524881e-01 -3.30508276e-03]] Final stress: [ 0.01776956 0.01685585 0.00432859 -0.00104502 -0.00171958 -0.00318562] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 7.45412395e-03 6.18868415e-03 -1.02137579e-03] [ 1.39920146e-04 1.71039347e-03 -3.01849187e-04] [-4.42598981e-04 1.00712765e-03 -1.05811289e-06] [-6.35998787e-04 2.72309309e-03 -4.85433689e-04] [-1.61174197e-03 2.31285005e-03 8.63110421e-05] [-8.81774426e-03 -3.63351971e-03 -1.04050484e-03] [ 9.68609020e-03 1.23014219e-02 2.29655511e-03] [-1.33555035e-02 -3.04636070e-03 -2.44896058e-04] [ 4.88386337e-03 -2.13027884e-03 -1.98484222e-04] [ 8.30688498e-03 -4.24748752e-03 -1.89223486e-04] [-1.44342633e-02 7.82425267e-04 1.39239414e-03] [ 8.76367976e-03 -6.34445717e-03 -3.42409882e-04] [ 3.52627602e-03 -3.77583212e-03 -1.54706172e-03] [-6.97623565e-03 -2.01262149e-03 -2.73935545e-03] [ 3.15713209e-03 4.22794417e-03 6.97066590e-03] [ 4.24987584e-04 2.26620052e-03 -4.61894290e-04] [ 3.74306598e-03 8.79342279e-04 1.50560533e-03] [-2.78056634e-03 -4.07566568e-03 -2.43145185e-03] [ 2.64635691e-04 1.83119288e-03 4.96528829e-03] [-6.78109109e-03 -5.90309174e-03 2.72612727e-03] [ 4.72307197e-03 -7.85599084e-03 -1.31879587e-03] [ 3.45542573e-03 -1.77677185e-03 -8.58830252e-03] [-6.34680794e-03 2.67819948e-03 -4.48829177e-03] [ 7.14928248e-03 -3.38759523e-04 5.51637229e-03] [-6.50497813e-03 -4.14121719e-03 4.63698437e-03] [-3.19258373e-03 -2.53813445e-03 2.41483993e-03] [-3.10907304e-03 4.34265923e-03 1.03273420e-03] [ 7.37947528e-03 7.97376473e-03 -4.15131095e-03] [ 8.33675960e-03 -4.62164846e-03 -7.12912986e-03] [-3.54686118e-03 4.27679946e-04 -2.11352618e-03] [ 7.50195025e-03 5.38713344e-03 -7.57233025e-03] [ 2.30235729e-03 1.30121454e-03 -7.13622239e-04] [ 2.83443979e-03 -8.20496116e-04 2.19723119e-04] [-6.72216725e-03 -6.97200360e-03 4.43914535e-03] [-1.13107162e-02 5.72048603e-03 9.78148307e-03] [ 2.53550911e-03 1.72524175e-04 -9.03921199e-04]] Final stress: [-0.00262824 -0.00456242 -0.00055375 0.00102339 -0.00040363 0.00182014] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 3.44997728e-02 1.91835021e-02 -3.13390304e-03] [ 1.38396735e-01 -4.01213111e-02 1.81074389e-02] [ 2.64587796e-02 3.17610993e-03 1.94937893e-03] [ 6.79687189e-03 -8.87074180e-03 2.40341486e-03] [-7.70681801e-02 1.24653493e-02 8.00624384e-03] [-3.21808607e-03 -2.33436010e-03 7.44499981e-04] [ 1.13290146e-01 -1.62053543e-01 1.68205773e-02] [ 3.31737974e-01 1.85582875e-01 -4.79659497e-02] [-3.96948476e-01 3.76361744e-01 3.02859759e-02] [-6.33427449e-02 6.31238636e-02 -2.84256146e-02] [-2.95733268e-01 -1.68000409e-01 5.52158431e-03] [ 1.90721684e-01 -2.55489490e-01 -3.45317546e-03] [-4.51731430e-02 -3.16372283e-03 -1.02062821e-01] [ 2.42248085e-02 6.30261771e-02 -1.17164207e-03] [ 4.89283255e-02 -5.03200195e-02 -1.95498200e-02] [-5.34006664e-02 2.10564329e-02 6.26121428e-02] [-7.66006074e-03 -9.78219076e-02 1.02947818e-03] [ 6.98058335e-03 5.86014484e-02 3.50531877e-02] [-1.63951600e-01 -2.83275722e-01 1.12105957e-02] [ 1.53488850e-01 -2.30836304e-01 -8.07133892e-02] [ 3.99830090e-02 1.19265316e-01 -9.24755605e-02] [ 1.17503029e-01 5.34523308e-02 -5.77883487e-02] [-1.60913222e-01 2.44178444e-01 9.54212272e-02] [ 1.06157863e-01 -1.14535101e-01 1.29460195e-01] [-4.41563381e-02 7.31504129e-02 4.69996750e-03] [ 3.80302817e-02 2.65704932e-03 -5.80357621e-02] [-9.48922140e-02 9.90542034e-02 -1.59064359e-03] [ 3.00297205e-02 4.31130275e-02 -3.74035999e-03] [ 1.11695962e-02 2.76191447e-02 6.42663210e-02] [ 3.80435240e-03 -6.26050994e-02 4.49098966e-02] [ 8.18933711e-02 -3.77422626e-03 1.38616803e-02] [-3.28281710e-02 2.52840951e-02 5.25078186e-02] [ 7.56028601e-02 -6.60532175e-02 -3.89035633e-03] [-7.29049619e-02 -1.42763728e-02 -3.51841775e-02] [-3.80687583e-02 1.38446529e-04 -2.48614359e-02] [-2.94387218e-02 7.30415750e-02 -3.48286652e-02]] Final stress: [-0.00471349 -0.00727442 -0.00078816 -0.00145844 0.00010974 -0.00134526] Minimization converged after 15 steps. Minimization converged after 12 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 62 steps. Final forces: [[ 9.69870059e-03 3.12642111e-03 -1.98544608e-03] [ 1.25886237e-02 -2.98192724e-04 1.70400057e-03] [-2.11602304e-04 -6.91249221e-03 -6.71109992e-04] [ 9.82898732e-03 2.26515445e-03 -4.74497920e-05] [-5.32435496e-04 -1.76184610e-03 -2.79042763e-04] [-4.54239676e-04 -4.87345934e-03 -7.77282663e-04] [ 2.57071399e-03 3.79771565e-03 7.70105279e-03] [-3.08955427e-03 3.07908171e-03 5.01143154e-04] [ 6.44135081e-04 3.03737702e-03 -7.68010598e-03] [-2.54345481e-03 2.30580617e-03 1.59229787e-03] [ 3.36322295e-03 1.82806936e-04 1.76315282e-03] [-1.09424123e-03 -6.76121741e-05 -3.52445276e-03] [-7.06302821e-03 -1.16069710e-03 -3.50729946e-04] [-1.09026558e-04 4.80937780e-03 2.46952861e-04] [ 7.09351969e-03 -2.33161518e-03 1.37500710e-03] [-2.00212235e-03 2.59049425e-03 2.79469546e-03] [ 3.29239177e-04 -6.03522269e-03 3.96595445e-03] [ 1.70124725e-03 1.96575791e-04 -7.95807973e-03] [ 9.13107333e-03 -6.13582796e-03 8.08555986e-05] [-5.97984592e-04 1.92030637e-03 1.93864854e-03] [ 3.25653251e-03 -3.18163341e-03 1.81045673e-03] [-1.00152020e-02 9.19211557e-03 2.05059926e-03] [-1.38435598e-03 -1.23357484e-03 -3.65637299e-03] [-5.07883396e-03 5.37769660e-03 -2.51355716e-03] [-7.59762966e-04 3.20488123e-03 2.56840135e-03] [-2.97316810e-03 -4.90936127e-03 4.88957646e-03] [ 4.28781381e-03 -5.12274432e-03 -2.94816515e-03] [-1.96493440e-03 3.02686434e-03 -2.08634969e-04] [ 1.56332887e-03 -3.45883396e-04 -2.94633914e-03] [-4.01003881e-03 1.43164452e-05 -4.68918081e-04] [-1.21869426e-03 -1.13442400e-03 -4.71671643e-03] [-1.00896092e-02 1.29683368e-03 5.51481834e-03] [-8.45381469e-03 7.89740276e-03 -2.65939194e-03] [-2.50342237e-03 -1.05818331e-02 6.49266278e-03] [-4.00144366e-03 1.00826334e-03 7.80089148e-04] [ 4.09383162e-03 -2.24307146e-03 -4.37856971e-03]] Final stress: [ 3.77420689e-04 3.45192492e-04 7.03644743e-03 1.58502260e-03 -4.29832065e-05 8.09213874e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 2.47743779e-03 -6.85112092e-05 -2.26652336e-04] [ 1.11758277e-02 -9.63847878e-03 2.78839200e-03] [ 6.50657925e-03 -3.97585643e-03 -4.78363456e-04] [ 1.83108214e-03 -1.28270990e-02 1.48067745e-03] [-1.81754742e-03 4.35909896e-03 1.04310368e-03] [-2.91971664e-03 -7.84048359e-03 -1.06419481e-03] [ 4.10457927e-03 4.15313129e-03 2.74338748e-03] [-1.49839609e-02 5.67230231e-05 2.29740631e-03] [-1.93639653e-02 2.41113509e-02 -7.06922311e-03] [-7.95933095e-03 -1.08438475e-02 -1.93413384e-03] [ 2.00545961e-02 4.03246306e-03 -7.84465958e-04] [ 1.50083366e-02 -2.16174586e-02 1.24196399e-03] [-1.16607160e-02 -3.58365679e-04 -4.61464575e-03] [-2.89579310e-03 1.47979743e-03 -7.42821987e-04] [ 8.43957454e-03 5.57839228e-04 1.55241331e-03] [-9.66248648e-04 1.18852945e-03 4.96219631e-03] [ 9.00542878e-03 1.43249476e-02 -5.82450886e-03] [-6.91880175e-03 -9.57030690e-03 2.79213230e-03] [ 1.05972310e-02 -1.16717996e-02 4.34197795e-04] [ 1.03739522e-02 -1.07343047e-02 6.37668965e-04] [-2.49269173e-03 -4.96749603e-03 2.36020769e-04] [-1.36873185e-02 1.29208433e-02 1.60084771e-04] [-8.45859552e-03 1.41516947e-02 3.56212958e-06] [ 2.75404940e-03 1.07954494e-02 -9.20243300e-04] [ 7.32631833e-03 4.06576012e-03 -4.27984021e-03] [-1.26838340e-02 -2.66573777e-03 -5.42777502e-03] [-1.66985121e-03 -1.24789514e-03 -5.06752999e-03] [ 4.16663868e-03 1.52303715e-02 -2.57888419e-03] [-3.13990586e-03 -4.43749654e-03 2.12943037e-03] [-1.49975056e-02 8.46406162e-03 8.06145824e-03] [-5.83021414e-03 -7.12113672e-03 7.27942229e-03] [ 1.09640402e-02 1.03317573e-03 4.17414743e-03] [-2.73576199e-03 7.82439980e-03 5.78525624e-03] [-2.19497077e-03 -1.19233834e-02 -2.82049220e-04] [ 6.30759831e-03 9.00525253e-03 -6.10377729e-04] [ 6.28345965e-03 -6.24523188e-03 -7.89721206e-03]] Final stress: [ 4.16146944e-04 3.46520464e-04 7.15082384e-03 -1.51632465e-03 -3.89737761e-05 -8.38239700e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-2.79018233e-03 -1.04175865e-03 5.42435951e-04] [-1.74311226e-03 2.27065442e-03 -4.63353032e-04] [-1.60141144e-03 -2.88504711e-04 2.48884075e-04] [-8.61541352e-04 3.67653281e-03 -5.51090912e-04] [-1.48180699e-03 -1.44048092e-03 7.28623568e-05] [ 1.25678930e-03 2.29518134e-03 1.23517067e-04] [ 1.51079190e-03 -4.16293944e-03 -8.41185177e-04] [ 1.59696491e-03 3.13557639e-04 6.06079530e-04] [ 1.23351776e-03 2.42737083e-03 3.59572541e-04] [ 3.22513220e-04 -2.44969895e-03 4.96801242e-04] [ 2.34866703e-03 8.34861822e-04 1.99473240e-04] [ 3.02035046e-03 3.04392259e-03 -8.64869389e-04] [-5.60686711e-03 1.19907849e-03 7.54122003e-04] [ 1.18365398e-03 2.69278405e-03 -1.33589226e-03] [ 2.22907635e-03 -2.19545921e-03 6.20558142e-04] [ 9.71577549e-05 1.43797074e-03 -1.59215458e-04] [ 1.50818923e-03 -7.94581687e-04 -7.94380879e-04] [-1.89104567e-03 -1.42707363e-03 1.05129452e-03] [ 9.02387378e-04 -3.19451554e-03 1.62357133e-03] [ 1.57136030e-03 -1.01180654e-03 -1.13228513e-03] [ 1.31627744e-03 -3.73498445e-04 -2.14369325e-04] [-2.64728790e-04 -1.37116859e-03 -8.55324513e-04] [ 1.68845040e-03 2.28773499e-04 -1.78471988e-03] [-1.22807069e-03 -7.96471702e-04 2.09642178e-03] [ 5.18673066e-04 -1.66641322e-03 -9.51773936e-04] [ 8.85827357e-04 -5.45114468e-04 9.92178202e-04] [-1.12549559e-03 1.24830679e-04 9.34466532e-04] [ 1.09174303e-03 3.30088284e-04 1.58360566e-03] [-1.10493536e-03 -4.01050680e-04 -1.19828050e-03] [-2.93681625e-03 -7.24287880e-05 -1.44773148e-03] [-1.27752962e-03 2.83118927e-04 -1.00411795e-03] [-8.84568270e-04 1.50230867e-03 -7.14832096e-04] [ 3.65687651e-04 2.39168585e-03 1.42836864e-03] [-1.10466593e-04 -1.54687677e-04 1.10205981e-03] [ 6.32947988e-04 -6.84870744e-04 5.70396320e-05] [-3.72448169e-04 -9.80197046e-04 -5.79890315e-04]] Final stress: [-4.84243391e-04 -4.63377859e-04 -7.11834460e-03 1.51329772e-03 2.40809538e-05 9.89757376e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-1.19695337e-03 -6.73362642e-04 1.21581844e-04] [ 1.02209713e-03 8.06551558e-04 9.54130488e-05] [-2.24340496e-05 -4.36815863e-03 -8.03837643e-04] [ 1.09735116e-03 1.83839000e-04 -4.27876442e-05] [-3.64215298e-03 2.66787395e-03 8.95624471e-04] [-9.88628982e-04 -5.23995910e-04 -1.12941578e-04] [-3.54866768e-03 -1.59729922e-02 -1.29236079e-03] [-2.04309642e-02 4.74004331e-03 9.57894360e-04] [ 4.79876297e-03 -4.08847804e-03 1.14123000e-03] [-8.28328456e-03 -7.02457503e-03 1.48460329e-03] [-1.03714218e-02 1.00821713e-03 -9.17046137e-04] [ 7.62723439e-03 -1.17711869e-03 -1.40977572e-03] [ 3.65451933e-03 1.79666625e-04 5.71311842e-04] [-1.66983435e-03 -2.61622500e-03 2.02142108e-03] [ 3.55357150e-03 7.06979628e-03 -1.39125503e-03] [ 1.22896471e-03 1.35020843e-03 3.00224406e-05] [-3.12479736e-04 -4.02936278e-03 -3.03976337e-03] [-4.56790503e-03 -7.92544344e-04 1.86402788e-03] [ 1.27462201e-02 -1.40527525e-03 -1.46304810e-03] [ 2.56713861e-06 1.02365447e-02 -8.58577273e-05] [ 1.06504149e-02 5.04709824e-03 3.01725199e-03] [ 3.56539566e-03 -7.51748642e-04 1.90834784e-03] [ 2.46753908e-04 8.33228018e-03 -6.21391397e-04] [ 7.95177690e-03 3.55091402e-03 -2.51598939e-03] [ 4.06007851e-04 -5.94541265e-03 -5.53636760e-04] [-2.63798323e-03 8.62805402e-04 -8.66183115e-04] [ 3.20913572e-03 -8.46536661e-04 4.48429992e-04] [ 1.11404515e-03 1.15087911e-03 1.08559971e-03] [-1.39548431e-03 1.69559479e-04 -1.19198095e-04] [ 4.93002192e-04 -1.46910283e-04 -1.47698086e-03] [ 5.97692134e-04 4.43677957e-03 4.09515955e-05] [ 8.22035855e-04 -1.32000307e-03 6.09519031e-04] [-3.65935368e-03 9.33304183e-04 -2.14635426e-04] [-2.12599332e-03 -2.42889814e-03 -8.83567544e-04] [ 1.13229832e-03 -5.27104057e-05 -8.45606865e-05] [-1.06630572e-03 1.43794722e-03 1.60158659e-03]] Final stress: [-4.51575902e-04 -4.95591351e-04 -7.12065742e-03 -1.50946559e-03 -1.59955523e-05 -1.04829674e-03] Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 0.00576723 0.01830982 -0.00209831] [-0.01690241 -0.00437172 -0.00171147] [ 0.00022554 -0.00639487 -0.00217938] [-0.01288186 0.00581442 -0.00100538] [ 0.01518928 0.00521435 -0.00151321] [-0.01152863 -0.0089998 -0.00146216] [-0.0001746 0.01552525 0.00284625] [ 0.00244461 0.00062681 -0.00179868] [-0.01756612 0.00733 0.00049886] [-0.00726257 -0.00865061 0.00132946] [ 0.00901041 0.00072893 0.00602848] [ 0.0069356 -0.01029991 -0.0004188 ] [-0.01013487 0.02136501 -0.00034261] [-0.01862654 -0.0804466 0.00278997] [ 0.02858598 0.04859975 0.00241579] [ 0.01908111 -0.02313672 0.00333421] [-0.00078153 0.02451029 -0.00560963] [ 0.01879013 -0.00759628 0.00351233] [ 0.0040813 -0.00507036 0.00779099] [ 0.00718892 -0.00948159 -0.01567091] [ 0.0061903 -0.00386111 0.00549997] [-0.00227205 0.00202404 -0.00791356] [ 0.00435241 0.01119008 0.00297731] [-0.00388583 0.00029396 0.00319918] [ 0.00593192 0.01214046 -0.00878622] [-0.01188004 -0.00656652 -0.01779414] [ 0.00506716 -0.01119999 -0.00650279] [-0.01068634 -0.01915553 0.01302683] [-0.00669809 0.01153612 0.01588993] [ 0.00399499 0.00296107 0.00868432] [ 0.00381816 0.00384142 0.00346444] [-0.00912214 -0.0004067 0.00658777] [-0.00360823 0.00906902 0.01024757] [ 0.00421812 -0.00253402 -0.00648138] [-0.0055694 0.00508389 -0.00720132] [-0.00129193 0.00200765 -0.0116337 ]] Final stress: [ 0.00114929 -0.00085673 0.00711145 -0.00012044 -0.00152562 -0.0001041 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[-4.24149100e-03 -3.66405006e-04 6.63779388e-04] [ 2.19037668e-03 2.47677313e-04 1.35704231e-04] [-6.24757714e-04 3.01189467e-03 4.50426511e-04] [ 2.07561460e-04 -1.19760614e-03 1.68741203e-04] [-1.90325197e-03 9.84368186e-04 2.94119618e-04] [ 3.55942739e-03 2.58139020e-03 5.98955343e-04] [ 1.31267279e-02 -3.47344222e-03 -1.38699587e-03] [-5.15601214e-03 4.55839911e-03 -4.18941392e-03] [-2.12669338e-02 2.67461897e-02 4.70276208e-03] [ 1.74701961e-02 1.48258182e-02 2.85257051e-05] [-3.40205167e-02 -4.67595749e-03 -5.21106333e-04] [-1.08108464e-02 1.40068488e-02 5.95936524e-04] [ 6.35419695e-03 -6.48429679e-03 -1.51262571e-03] [-6.48589464e-03 -7.72229929e-03 3.38216764e-04] [ 2.13971379e-03 8.14428851e-03 7.80019808e-04] [ 4.72125809e-03 3.69493065e-03 8.48803084e-04] [-3.20119009e-04 -6.75127725e-03 -3.84014207e-03] [-5.54728163e-03 5.69026981e-03 2.55027737e-03] [ 1.34084476e-02 -1.72400177e-02 -1.26231929e-03] [ 9.38313528e-03 -4.89364493e-03 -1.87615290e-03] [ 7.39570315e-04 -5.66919548e-03 4.19004707e-03] [ 2.19875055e-02 -1.09851634e-02 1.16686658e-03] [-3.71092057e-03 -7.14130801e-03 5.93039031e-04] [ 7.91799787e-03 -1.09859161e-02 -1.57932843e-03] [ 1.96832820e-03 2.23005958e-03 1.09642429e-03] [-1.47613544e-03 -3.10880625e-03 -3.68694496e-03] [ 1.93187767e-03 4.26714868e-03 -1.04071498e-03] [-5.30749316e-03 4.10650252e-03 -1.44992148e-03] [-3.21811756e-03 -1.44009935e-03 4.54603541e-03] [ 5.70100734e-04 -4.92561436e-03 -4.26151533e-04] [-3.77304763e-04 6.65062649e-04 2.20591266e-03] [-5.01207454e-04 4.69034409e-03 -1.63965705e-03] [-3.62445970e-03 -5.30706288e-03 2.22399788e-03] [ 1.93615672e-03 -6.24525274e-03 -3.09015622e-03] [ 1.58318336e-03 3.27414588e-03 -1.77800461e-03] [-2.60301795e-03 4.88802685e-03 1.10104480e-03]] Final stress: [-1.56631174e-03 4.88192712e-04 -7.17738255e-03 -2.37414648e-05 1.48255749e-03 4.97817846e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-0.1144791 0.11043756 0.00137952] [-0.180631 0.0600013 -0.06445271] [ 0.05665266 0.05262115 -0.00684044] [-0.02510573 0.03312664 0.00939583] [ 0.13570474 0.08133837 -0.00502698] [ 0.21900079 0.02732622 0.06575833] [-0.32745814 -0.62169769 -0.08312707] [-0.56061401 -0.04245651 0.09684691] [ 0.00121026 -0.00166967 0.05047493] [ 0.17280476 0.05497987 -0.01909967] [ 0.67879872 0.22423664 -0.17334604] [ 0.0414411 -0.37792488 0.10775516] [ 0.20273825 0.05473178 -0.1027438 ] [-0.05343464 0.01732162 -0.06185406] [-0.22267976 0.04370645 0.10044655] [ 0.1051686 -0.09763366 0.10925006] [ 0.03800478 0.0198355 0.04959216] [-0.0954457 -0.07264434 -0.09269298] [ 0.41512472 -0.11958404 0.10417805] [-0.01303979 0.40115791 0.00321522] [ 0.3680231 0.43541377 -0.06999153] [-0.39548205 0.14869752 -0.04971359] [-0.08104731 -0.16221273 -0.00323864] [-0.21047848 -0.00521932 0.02656765] [ 0.02518547 -0.06442822 -0.21237473] [ 0.00631074 0.04550245 0.03893605] [ 0.02728134 -0.06704377 -0.05896131] [ 0.00239902 -0.08138204 0.06674062] [ 0.0021139 -0.04985016 0.04887353] [-0.0150771 0.07048595 -0.05027376] [-0.09265583 0.06027014 0.14927973] [-0.08018531 -0.11634434 -0.12422166] [-0.03378308 0.06860297 -0.0739988 ] [-0.06194745 0.03636202 0.00725515] [ 0.02391914 -0.00781845 0.11174514] [ 0.04166242 -0.15824599 0.10426718]] Final stress: [ 0.00160032 0.00237442 -0.00600539 0.00041241 -0.00094812 -0.00119025] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 0.00637023 0.00353367 -0.00100011] [ 0.00837114 -0.00332108 0.00171994] [ 0.00062543 -0.00824376 -0.0008725 ] [ 0.00016436 0.00597258 -0.00141327] [-0.00813088 0.00583263 0.00098882] [-0.02206604 -0.01157722 -0.00470167] [-0.01806947 -0.01807306 -0.00028377] [-0.0312946 0.00477661 -0.00179662] [ 0.01143569 0.00285341 0.00261279] [ 0.01583668 -0.00621531 0.00239698] [ 0.01599654 0.01116458 0.00275643] [-0.021865 -0.00507818 -0.00275194] [ 0.00815269 0.00689581 -0.00146422] [-0.00083766 0.0068965 0.00110904] [-0.02591202 -0.00604379 0.00332017] [-0.00562301 0.00295386 0.00179733] [ 0.00488641 -0.01688952 0.000121 ] [ 0.02156146 0.00391249 -0.00283732] [ 0.0377041 -0.01099083 0.00326797] [-0.00757835 0.03177193 -0.0003836 ] [ 0.00536074 0.0175584 0.00016704] [-0.0097464 -0.00463828 -0.0056853 ] [ 0.00111663 -0.02645212 0.00140706] [ 0.0036845 0.00300266 -0.00078775] [ 0.0210252 0.00522066 0.00256831] [ 0.00395822 -0.01074996 -0.00148502] [ 0.00498761 -0.00390541 -0.00090107] [-0.01258998 -0.00604987 0.00242295] [-0.01313551 -0.00851699 0.00639875] [-0.00559961 0.00015085 -0.00623514] [-0.02012051 -0.00473361 -0.00232708] [-0.00288087 0.01399781 0.00153823] [-0.0031165 0.00472763 0.00149144] [ 0.01664056 0.00596216 -0.0013148 ] [ 0.01271428 0.00821734 -0.00694901] [ 0.00797393 0.00607739 0.00710594]] Final stress: [5.14636173e-04 5.11568686e-04 7.02751150e-03 8.50039077e-04 9.34706024e-06 1.78165194e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-1.08344878e-03 -2.10293498e-03 2.33267435e-04] [-4.67119551e-03 1.81677011e-03 -8.44549845e-04] [ 2.12518843e-04 -1.26681337e-03 -2.59324491e-04] [ 6.42914431e-04 1.65550304e-03 -2.34510397e-04] [ 7.44842561e-04 -1.55865126e-03 -2.01086944e-04] [ 2.10867249e-03 -3.49910984e-04 2.79992249e-04] [-3.34270818e-03 -1.40720154e-03 -1.52972137e-03] [ 4.96452405e-03 1.05950927e-04 -8.89378337e-05] [-1.82487449e-03 2.71353842e-03 8.09717219e-05] [ 4.51606577e-03 1.81173465e-03 1.17143353e-03] [-5.19292557e-03 1.36390945e-03 -1.18109733e-04] [ 9.68436152e-04 -1.50904572e-03 1.02355621e-03] [ 1.40730398e-03 -6.12516504e-04 8.37157532e-04] [-1.38918134e-03 4.65872563e-04 1.04931175e-03] [ 1.90026299e-03 3.34061117e-03 -6.82267134e-04] [-3.53573818e-03 1.09469010e-03 6.94361884e-04] [ 8.02373686e-04 4.40057796e-04 -4.78203482e-04] [ 8.75056500e-04 -3.18320042e-03 -1.10512648e-03] [-7.19862970e-04 9.18051870e-04 8.84285663e-04] [ 2.59234689e-03 2.48961984e-03 4.83079918e-04] [-1.52106794e-03 2.59411067e-03 -2.59421289e-03] [ 3.99839875e-04 3.98301021e-04 8.89888372e-04] [-2.43183680e-03 -1.15310258e-03 2.56676784e-04] [ 1.06418977e-03 -1.43673854e-03 -2.60066441e-04] [ 1.89011892e-03 -1.17115031e-03 5.50589087e-04] [ 1.43169881e-03 -1.12570428e-03 1.24604508e-03] [ 2.55835812e-03 -1.19181987e-03 -1.46564616e-04] [-7.49813194e-04 -9.18678697e-04 1.10783397e-03] [-3.38524595e-03 -2.36067091e-04 -3.23536393e-04] [-7.50201465e-04 -2.10771072e-03 1.17103858e-03] [-3.14966427e-03 6.81139353e-04 7.15557090e-04] [-6.52209068e-04 -1.01995657e-03 -2.08916443e-03] [-7.49678612e-04 4.79583879e-04 -7.30039963e-04] [ 4.63866089e-05 2.29516323e-04 -9.02667347e-04] [ 4.88016558e-03 -8.58017464e-04 -5.32656323e-04] [ 1.14357630e-03 6.10259747e-04 4.45699252e-04]] Final stress: [ 2.69815061e-04 2.09625759e-04 7.03728715e-03 -9.41120607e-04 -2.23387933e-07 -1.84456872e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.19188925e-03 -8.58714765e-03 1.23495987e-02] [ 7.94081608e-04 -5.44884699e-03 -6.20148696e-03] [ 5.49740089e-04 -1.19683775e-02 3.96700086e-04] [-6.45297296e-03 -4.53598520e-03 7.31098925e-03] [ 8.26220341e-04 2.24187517e-04 -1.13614977e-02] [ 3.52811606e-03 9.61070419e-03 4.99669168e-04] [-1.47730024e-03 -9.70636754e-03 4.22226527e-03] [-1.95809159e-02 -1.07417527e-02 1.04026600e-02] [-1.73656117e-02 7.96132018e-03 -1.18474139e-02] [-2.38089909e-02 -1.99610070e-02 -3.67775562e-04] [-3.20184254e-02 2.60555901e-02 -5.77309932e-03] [-3.50947985e-03 -1.82131275e-03 3.80521719e-03] [ 2.09483819e-03 6.51602159e-03 1.18252401e-03] [-3.35421255e-03 -1.05397202e-03 -2.90836962e-03] [ 5.13171860e-03 1.39782160e-04 -3.46246127e-03] [-2.51618854e-03 -9.72605618e-05 -1.36057443e-03] [ 3.50436613e-03 3.93128771e-03 1.90984865e-03] [ 8.82222563e-04 2.80984258e-03 -2.75599155e-03] [ 1.31070158e-02 2.33694411e-04 -7.72979690e-04] [ 1.31364273e-02 8.94558271e-03 5.67967259e-03] [ 6.89032176e-03 -4.70225032e-03 6.35911832e-03] [ 2.00076255e-02 2.26741885e-02 -2.87982420e-04] [ 7.48885290e-03 -1.72846127e-02 1.72098806e-04] [ 2.18659373e-02 1.65299921e-03 -6.90797122e-03] [ 1.94897432e-03 2.84538616e-03 -3.51621997e-04] [-1.57994991e-03 -2.50871315e-03 1.40256910e-03] [ 3.04263286e-03 -9.42599495e-04 2.07691146e-03] [ 4.16309391e-03 1.48750964e-04 -6.22736269e-04] [-1.77033518e-03 -5.46228111e-03 -5.84661728e-03] [ 1.08758534e-04 -1.47739907e-03 -1.37987916e-03] [-1.43983523e-03 4.80589339e-03 3.95976475e-03] [ 8.85752316e-04 4.39437058e-03 4.96871727e-03] [ 3.53160126e-03 3.65851562e-03 -5.00397266e-04] [-4.67608783e-03 5.85649916e-04 -1.99043632e-03] [ 3.09558586e-03 -3.69545719e-05 -2.54141334e-03] [ 4.15831222e-03 -8.56927186e-04 5.42380704e-04]] Final stress: [ 0.02817066 0.02832339 0.01045988 0.0004737 -0.00013936 0.00121531] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 0.01496712 0.0053935 -0.00142715] [ 0.0049077 -0.01016093 0.0019704 ] [-0.00552761 0.02736062 0.00581315] [-0.00065465 -0.00818558 0.00100414] [ 0.02996309 -0.02218023 -0.00768306] [ 0.0121569 0.00553563 0.00111786] [-0.00097731 0.01117628 0.00208844] [ 0.02696523 -0.02206496 0.00165097] [ 0.00360161 -0.01604174 0.00610631] [ 0.01148585 -0.01273361 -0.00423549] [-0.02657825 0.03894737 0.00197555] [-0.00778185 -0.00830009 -0.00772443] [-0.002296 -0.00951387 0.02292148] [-0.00653689 -0.01364218 0.00922759] [ 0.0078225 0.01368396 -0.01583934] [-0.00394382 -0.00079903 -0.01629497] [-0.01152013 0.00507456 -0.00882168] [ 0.00682406 0.00278421 0.00849466] [ 0.00318285 -0.00268269 0.01908677] [-0.01767784 -0.01356696 0.00170749] [-0.01460276 -0.00306057 0.01126341] [-0.0029669 0.01965798 -0.00195513] [ 0.00656701 0.02247776 -0.00791319] [ 0.00295128 0.01428094 -0.02252457] [-0.00571463 0.0174917 -0.01694502] [-0.01203495 0.00055505 -0.00107581] [ 0.01653833 -0.03065908 -0.01694552] [ 0.00090661 -0.01018305 0.01425229] [ 0.00654746 0.00563762 -0.003648 ] [-0.01126353 0.00038281 -0.00523265] [-0.01320349 -0.01730105 0.02209376] [ 0.00796836 0.00240543 -0.0148357 ] [-0.02075039 0.0250621 0.01131892] [-0.00250986 0.00058491 -0.00471942] [-0.00042371 -0.00813075 0.00045526] [ 0.00360858 -0.00928605 0.01527266]] Final stress: [-0.00043621 -0.00036025 -0.00716902 -0.00096975 0.00010581 -0.00208229] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[-5.74240150e-03 -3.29371638e-03 9.95983387e-04] [ 2.39892741e-03 -5.12103031e-03 5.03030776e-04] [ 5.64971060e-03 1.29533769e-02 1.20135997e-03] [-5.72714155e-03 -1.13840201e-02 2.35935895e-03] [-2.98848841e-03 2.07774289e-03 7.65780859e-04] [ 1.22772710e-02 3.97537536e-03 2.43385201e-03] [ 3.21197481e-03 2.24237156e-03 -1.44906996e-03] [-2.95177662e-03 4.10243408e-04 -1.22807355e-03] [ 3.43113060e-03 -8.62189691e-03 3.37242717e-04] [-3.35428079e-03 6.24821651e-04 -5.47252953e-03] [-1.12297688e-02 -4.46623507e-03 2.35890518e-04] [ 2.29206811e-04 -7.90702946e-03 2.89547418e-03] [ 1.70400986e-03 5.34048710e-03 -2.71882735e-03] [ 6.63915846e-03 -8.35703064e-03 -3.00044637e-03] [ 1.24552977e-03 5.16708952e-03 3.26556443e-03] [-8.34557817e-03 -4.66943711e-03 -3.36056421e-03] [-3.72610772e-03 1.02180152e-02 2.70626913e-03] [ 3.07897972e-03 2.13264208e-03 -1.01354049e-03] [ 7.68075513e-03 1.41186254e-04 -5.37167283e-04] [-3.24181437e-03 1.44482415e-03 -6.04087397e-04] [ 6.00431625e-03 1.69953535e-03 2.41624869e-03] [ 1.58058708e-03 -1.39881997e-03 3.43949704e-03] [-8.38359603e-03 3.87622187e-03 9.68558698e-04] [ 2.02802562e-03 -1.24544510e-03 -2.53537834e-03] [-1.88737465e-04 1.77547697e-03 -3.30967833e-03] [-4.91439824e-03 5.09948893e-03 -1.57621337e-03] [-3.60014231e-03 -1.48957792e-03 4.91838955e-03] [ 3.89686330e-03 8.75455060e-04 -1.68271524e-03] [ 3.40665265e-03 7.46538961e-03 4.53704499e-04] [ 3.24899783e-03 3.84136050e-03 5.81221018e-04] [ 5.43228694e-04 -6.51573556e-04 3.88792242e-03] [-1.71087561e-03 4.41374675e-03 -1.55488552e-03] [ 1.30980184e-05 -3.52882350e-03 -3.52814280e-03] [-3.79975724e-03 -5.64875841e-03 -9.25857540e-04] [-2.16273286e-04 -4.80552285e-03 -1.08040364e-03] [ 1.85271450e-03 -3.18593384e-03 1.21223208e-03]] Final stress: [-1.95915491e-05 -7.68652714e-05 6.61474446e-05 3.06739549e-03 -8.46974068e-05 1.89764112e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-8.54181484e-04 1.16059667e-02 -2.41447464e-03] [ 4.97516262e-02 -3.15165963e-02 1.13741875e-02] [-1.15415700e-02 -1.69171327e-02 -2.99312254e-03] [ 8.17994809e-03 -2.33151236e-02 1.53253644e-03] [-1.54209157e-02 2.72858393e-02 7.81601692e-03] [-3.05740454e-02 -1.23413739e-02 -4.51842550e-03] [-8.41006793e-03 -1.82239483e-02 1.11142828e-02] [ 1.00564305e-01 -1.18617804e-02 3.52693602e-03] [ 4.89335135e-03 -6.40058931e-02 -1.80565554e-02] [-1.08319126e-02 -2.04718539e-02 -6.47307744e-05] [ 1.12833710e-01 7.89030946e-03 -6.69537729e-03] [ 5.44906901e-02 -3.78204101e-02 7.64773063e-04] [ 1.99158539e-02 -1.34832331e-02 -3.08200362e-03] [-3.88396451e-03 -2.61488792e-02 1.72958465e-02] [-7.96903989e-02 -3.48098014e-02 -8.09991524e-03] [ 3.68226070e-02 5.53996236e-03 -4.42869734e-03] [ 2.96592688e-02 4.07335747e-02 -1.48816260e-02] [ 1.60880497e-02 8.85352423e-03 1.62622376e-02] [-8.24262615e-02 2.44750027e-02 -7.62117998e-03] [-5.05428882e-03 3.91516019e-02 9.01130839e-03] [-8.41834354e-02 -3.12641906e-02 2.86411297e-03] [-5.75861858e-02 4.00204990e-02 2.68178993e-02] [ 1.67721956e-02 1.67346291e-02 -3.12404255e-03] [-3.05039674e-02 2.00436024e-02 -3.10509238e-02] [-4.27524855e-03 2.03461755e-02 -2.23266217e-03] [ 6.18472758e-03 3.37268191e-02 6.29348576e-03] [-2.86689989e-02 -5.15162919e-05 -2.28992505e-03] [-1.04565522e-03 -9.74677035e-03 -2.40737443e-02] [ 2.67089463e-03 -8.62683770e-03 2.11264373e-02] [-8.96207808e-03 3.14118314e-02 -5.00434142e-03] [-9.56025875e-03 -7.56122153e-03 3.74635962e-03] [ 7.38422219e-03 3.84601706e-03 -1.73252362e-02] [-2.80616591e-02 -1.43181067e-02 1.33516290e-02] [ 2.90336982e-02 4.56945798e-03 7.37890813e-03] [ 1.99456844e-02 1.99537353e-02 -1.65649932e-02] [-1.36557398e-02 2.62961212e-02 1.42450196e-02]] Final stress: [-0.00014402 0.00046059 0.00010158 -0.00304787 -0.00029984 -0.00164114] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 1.03499416e-02 3.22532375e-03 -2.75796040e-03] [-2.35892479e-03 -2.81096079e-03 -2.17317791e-04] [-2.95886908e-03 9.81380185e-04 1.89562216e-04] [-4.24064114e-03 -9.37513493e-03 2.22217239e-03] [ 4.93807693e-03 -1.87953744e-03 -3.52175665e-04] [-5.52777036e-03 3.36389114e-03 -4.89011041e-04] [-7.27874127e-03 -1.08125262e-02 -6.00773258e-03] [ 9.10193170e-03 -1.16503395e-03 8.60606068e-03] [-2.44809792e-03 1.47667766e-02 -2.49364000e-03] [ 2.55644643e-04 -8.02564018e-03 -3.59372712e-03] [ 5.99221620e-03 8.77340494e-04 6.35620382e-03] [-3.05132573e-03 -2.43813680e-03 -2.33790918e-03] [-3.90127332e-03 -3.57074510e-03 -1.87885476e-03] [-2.67643663e-03 6.79710595e-03 6.72797239e-03] [ 9.77794713e-03 2.53165056e-03 -2.79891528e-03] [ 2.12804239e-03 -2.17127033e-02 7.50332522e-04] [-1.26956774e-02 2.07911521e-02 -2.48557752e-03] [ 9.28501052e-03 -2.46998237e-03 -3.80640954e-05] [-2.50120435e-03 -7.84848333e-03 4.45562133e-03] [ 2.12755275e-03 1.48321959e-02 -3.20245705e-03] [-1.44378703e-02 -8.40894163e-04 1.54999291e-05] [ 3.57796354e-03 -7.68914128e-03 -5.67287176e-03] [-2.87619759e-03 4.98902524e-03 3.86332070e-03] [-1.26463650e-02 -1.05586881e-03 3.73356525e-04] [ 2.31434155e-03 -4.18722395e-03 -1.82083726e-03] [ 1.48151093e-03 -2.03560158e-03 -2.69382207e-03] [ 1.09004157e-03 1.59670192e-03 5.02580008e-03] [-3.67735846e-03 7.39991198e-03 5.71631359e-03] [-4.27587375e-03 -2.54157064e-03 -8.07532793e-03] [ 2.45868905e-03 3.64766776e-03 2.16276287e-03] [-1.45548672e-04 2.81313652e-04 -5.26228144e-03] [ 4.16291797e-03 3.81971613e-03 3.40688824e-03] [ 6.21286981e-03 -3.18949356e-03 3.39970716e-03] [ 8.10332279e-03 -3.00603795e-03 3.88942236e-04] [ 5.10867925e-03 6.34856838e-03 -2.82536816e-03] [-7.68524617e-04 4.04994511e-04 1.34333445e-03]] Final stress: [-1.04485360e-03 9.56924425e-04 2.55021980e-05 1.47535694e-03 1.59053911e-03 1.13022151e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 3.19678040e-03 4.30889398e-03 -9.53739135e-04] [-1.39141048e-03 1.23984596e-03 -3.52941963e-04] [-1.69359365e-03 -6.80945520e-04 -1.38667919e-04] [ 8.29636633e-04 3.13295972e-04 3.52407407e-05] [ 3.84998238e-03 -4.75982776e-04 -4.01349445e-04] [-2.81009261e-03 -3.84024292e-04 -5.74500172e-04] [ 8.18306490e-05 1.71136967e-03 2.42842698e-03] [-2.97121055e-03 1.22891383e-03 -1.91534173e-04] [-2.87882683e-04 1.67196042e-03 -1.76723844e-03] [ 2.48985065e-04 -5.30914974e-04 2.92645756e-03] [ 1.71927312e-03 3.71199077e-04 5.52567302e-04] [ 3.38655204e-04 -1.85190989e-04 -1.60990139e-03] [ 1.10564963e-03 4.10237759e-04 -3.49204783e-04] [-1.65754238e-03 -1.08271821e-03 -1.47280665e-03] [ 9.36223519e-04 -1.08993246e-03 -1.45811617e-03] [-1.64264356e-03 -3.06489160e-04 2.50384043e-03] [ 3.38283359e-03 6.07864545e-03 1.89901494e-03] [-3.28977172e-03 -5.10571796e-03 6.96450776e-04] [ 1.52009407e-04 -9.12674533e-04 -2.51806117e-03] [ 1.23959668e-03 7.64199319e-04 -2.68654904e-03] [-1.00955218e-04 2.27472501e-03 -2.27187584e-03] [-3.49834325e-04 1.77688689e-03 2.38586934e-03] [-1.04134079e-03 2.09969573e-04 2.53371022e-03] [ 7.13002918e-04 -9.11077596e-04 1.89232567e-03] [-2.24013056e-03 -3.08833243e-04 5.28860313e-04] [ 2.96843458e-04 -1.44142949e-03 1.98248749e-03] [-9.00101377e-04 -1.20626140e-03 -8.39286807e-04] [-7.54434117e-04 -9.80223934e-04 1.76440313e-03] [ 8.32836805e-04 9.38549768e-05 1.39827619e-03] [ 9.65203534e-04 3.88446335e-04 -1.37432675e-03] [ 5.35059807e-04 -1.47404423e-03 -1.04227245e-03] [-1.91406064e-03 -3.37834398e-04 1.02652793e-03] [ 1.02020358e-03 1.45830275e-04 -2.30505261e-03] [ 1.67862436e-03 -2.00712184e-04 5.17710476e-04] [-1.15568644e-03 -3.49833738e-03 -5.40496633e-05] [ 1.07746037e-03 -1.87492979e-03 -2.71069492e-03]] Final stress: [ 9.17472339e-04 -9.81376303e-04 1.79259341e-05 1.53491695e-03 -1.53818881e-03 9.79397555e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[-1.34554783e-04 7.92878232e-04 -1.99222890e-05] [-2.59775096e-03 2.09645560e-03 -4.90417571e-04] [ 1.11946488e-03 -1.64153225e-03 -3.53299871e-04] [ 1.75082395e-03 4.23560334e-03 -6.82775642e-04] [ 2.02156665e-03 -9.54890365e-04 -4.43715285e-04] [ 3.71428316e-04 -1.60235170e-03 -9.33958273e-05] [ 6.79319049e-05 -7.81344108e-03 1.12785778e-03] [ 1.09132092e-02 2.06466536e-03 -1.42917175e-03] [-1.15464274e-03 1.09827548e-03 -1.19620468e-03] [-6.11908921e-03 -4.94666383e-03 2.17440883e-03] [-3.24089355e-03 2.77643324e-04 -1.69142663e-03] [ 2.17342623e-03 -1.84778149e-03 7.09106168e-04] [ 8.76142556e-03 1.18150855e-03 7.09942316e-04] [-5.11615925e-03 -6.07212068e-03 -1.60877301e-03] [-7.87933925e-03 5.43603666e-03 -7.94747469e-05] [ 2.82992938e-03 -1.01837496e-03 3.77014822e-05] [ 2.67953035e-03 4.57122595e-03 4.44283232e-04] [-1.76272606e-03 -5.09964146e-03 -9.17055968e-05] [-3.62984857e-03 -2.02641214e-03 -8.06560163e-04] [ 3.83660410e-03 3.84009683e-03 8.49535939e-04] [-1.60868255e-03 2.71291283e-03 -2.16162034e-03] [-3.95546164e-03 1.49811399e-03 5.57037095e-04] [ 4.21299289e-04 5.92697823e-03 -8.19878885e-04] [ 6.48488700e-03 3.01870196e-03 9.45321650e-04] [-1.56123186e-03 -6.39596598e-04 7.36283453e-04] [-1.07350528e-03 -3.24545111e-03 2.76016403e-03] [-2.62915337e-03 -1.86015378e-03 -1.58572269e-03] [-4.06164191e-04 -4.09875411e-04 1.91923362e-03] [ 2.35207948e-03 -1.41262021e-03 8.92797607e-04] [ 4.62857711e-04 2.74585966e-03 -6.53551463e-05] [ 2.52248828e-04 1.12008193e-03 2.38944067e-03] [-9.25494044e-04 8.05391883e-04 -1.18615137e-03] [ 5.95658601e-04 2.17153744e-03 -7.12538180e-04] [ 2.56861511e-04 -1.09386381e-03 -1.93338157e-03] [-2.22075508e-03 -6.53898995e-04 2.22712650e-03] [-1.33578057e-03 -3.25529741e-03 -1.02874912e-03]] Final stress: [-9.78001897e-04 8.84130817e-04 2.56136540e-05 -1.49589648e-03 1.55584865e-03 -1.03369752e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[-1.04653514e-03 -1.76952102e-03 2.98441360e-04] [-3.61632918e-04 -9.87955838e-04 6.75432971e-05] [ 1.00148394e-03 2.75225367e-03 3.84645247e-04] [ 2.84144091e-05 -2.37487234e-03 2.86778758e-04] [-4.55218876e-03 1.87188060e-03 8.98406462e-04] [ 2.27797262e-03 2.38760051e-04 4.81707042e-04] [-1.62515316e-03 -8.80341653e-03 -1.79987173e-03] [ 1.68360655e-03 3.36152252e-03 8.53756303e-04] [-2.37464100e-03 7.52448291e-03 1.47397914e-03] [-9.05433860e-03 -9.13957540e-03 -4.58805878e-04] [ 7.00236868e-03 -3.53899139e-03 2.60710626e-04] [ 3.15100506e-03 -1.27552176e-03 -1.99927173e-03] [-1.69360655e-03 -1.08243885e-03 9.56020074e-04] [-2.71079243e-04 -4.16754856e-03 2.12851607e-03] [ 8.52533031e-04 2.67672575e-03 -4.48634432e-04] [-8.76208832e-05 9.40511817e-04 -1.47057963e-03] [ 7.02762622e-04 6.95898468e-04 3.36125711e-04] [ 1.86934316e-03 7.00201930e-04 -2.62655893e-03] [-4.04382502e-03 8.26292453e-04 3.17991317e-03] [ 2.35031351e-04 -3.78244292e-03 5.19839346e-03] [ 3.25885967e-03 6.22402955e-03 -6.69737794e-04] [-4.82863980e-03 1.63109958e-04 -1.64086985e-03] [ 4.76681093e-03 1.06093993e-02 -2.28237014e-03] [-5.93843279e-03 1.74344843e-03 -3.36336714e-03] [-6.87463036e-05 2.27478729e-03 -2.54620953e-03] [ 2.05401212e-03 1.24112768e-03 -2.80386489e-03] [ 1.42657153e-03 -5.85392409e-03 -1.45292260e-03] [ 2.66549641e-03 9.91447490e-04 -4.54348822e-04] [ 2.38529737e-03 -1.65505020e-03 -7.43498477e-04] [-1.02479299e-03 1.40233761e-03 1.71045912e-03] [ 1.71514541e-03 -2.79149060e-03 3.06401327e-03] [ 5.92799742e-04 -3.12391698e-04 3.03944279e-03] [-1.52755362e-03 2.66225698e-03 1.32204098e-03] [-2.01461816e-03 -1.77359748e-03 -6.07367862e-04] [ 3.95095077e-04 4.57771109e-04 -1.94562127e-03] [ 2.44879525e-03 -4.95068802e-05 1.37300781e-03]] Final stress: [ 8.60655483e-04 -1.02794457e-03 3.82664459e-05 -1.52658304e-03 -1.53614183e-03 -1.00385200e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 2.38829201e-02 3.32537144e-02 -8.46184519e-03] [ 3.49643530e-03 -3.43488675e-03 -8.24929747e-05] [ 1.29037557e-02 -3.88788812e-03 -1.72669572e-04] [-1.03240920e-02 -1.04999278e-02 2.46672124e-03] [ 1.35191299e-02 4.38284231e-03 -2.69068906e-04] [-5.39044866e-03 -1.96538884e-03 -5.57541413e-04] [ 1.37389419e-02 5.21871676e-02 -2.50942936e-02] [-1.86632768e-02 -2.36954710e-03 -4.19077739e-03] [ 5.97336802e-02 -1.33723950e-02 3.03491472e-02] [-1.04674585e-02 -6.06603335e-02 -5.35235385e-03] [ 1.48934002e-02 -1.38425519e-02 1.83401812e-02] [-4.47411284e-02 1.45740226e-02 -1.50026162e-02] [-2.43052542e-02 3.26924321e-02 -1.58976928e-02] [ 1.64484009e-02 -2.95410146e-02 5.61571934e-03] [ 1.65303430e-02 -4.23724215e-03 -2.06648384e-03] [ 9.50388613e-03 -2.43566398e-03 -8.91103337e-04] [-1.34135134e-02 9.24227743e-03 3.80635125e-03] [-1.81860259e-02 8.03995799e-03 6.86819796e-03] [-5.62690424e-02 6.06753361e-02 1.44564075e-03] [ 1.65353306e-02 -4.99134063e-02 -6.31357378e-03] [-1.21121574e-02 -6.10549482e-02 4.64962356e-03] [ 5.76958466e-02 -6.98797328e-02 -7.50976610e-03] [-3.07153559e-02 4.97167594e-02 8.77738383e-03] [-2.94745940e-02 4.67662330e-02 -8.25036622e-03] [-5.20256135e-03 6.65219350e-03 6.36029908e-03] [ 8.41225266e-03 1.07960538e-02 -1.62737709e-02] [ 1.82490343e-03 7.96208911e-03 1.72180012e-02] [-5.73875765e-03 1.48467470e-02 -2.49334100e-02] [-1.12677883e-02 -5.61911950e-03 4.80286462e-03] [-8.44710484e-03 5.40729172e-03 1.51057580e-02] [ 1.69188518e-03 -7.57044022e-03 -1.88357767e-02] [ 3.90823456e-03 -4.76814339e-03 5.91726311e-03] [ 1.35242344e-02 -6.48685388e-03 5.85389624e-03] [ 5.37170676e-04 -3.68187449e-03 1.49741831e-02] [ 1.36102490e-02 -4.00934836e-03 -4.91130769e-03] [ 2.32755915e-03 2.03558885e-03 1.25156788e-02]] Final stress: [-8.84077770e-04 -6.77356543e-04 -5.00131756e-05 2.33786922e-03 -1.18106154e-04 3.66381619e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-2.44227282e-03 -3.41353043e-04 3.90318929e-04] [ 8.03166635e-04 1.59374111e-04 6.72535568e-05] [-2.85089181e-04 3.15150735e-03 3.99204123e-04] [-3.78214035e-04 -3.09720960e-03 5.10808383e-04] [-2.27941923e-03 1.89126777e-03 4.47763382e-04] [ 1.21861789e-03 1.51909205e-03 3.17517360e-04] [ 2.34587908e-03 6.02923454e-03 -8.26913506e-04] [-6.21741281e-03 -4.17415430e-03 -1.05528879e-03] [-1.01107059e-03 1.00219855e-03 2.90752557e-04] [ 3.98161718e-03 -3.13998327e-03 8.28250032e-04] [ 4.26857225e-03 3.29355249e-03 7.08606805e-04] [-2.05718876e-03 -4.83639499e-04 -1.52742139e-03] [ 2.08098673e-03 -2.85836246e-04 -4.04767435e-05] [ 2.53871539e-03 3.88049829e-03 -1.41588896e-04] [-1.22684001e-03 -1.11558587e-03 -1.03806691e-03] [-3.17284698e-03 -1.12274239e-03 -1.01372776e-03] [ 2.68977128e-04 -9.21181563e-04 -6.81049815e-04] [-1.90825140e-04 -1.57093698e-03 2.36461489e-03] [ 2.66989666e-03 9.72860355e-04 -1.13802189e-03] [ 9.96674292e-04 -4.34843063e-03 -3.93640250e-04] [ 2.72339379e-03 -3.68077225e-03 8.92069643e-04] [-9.84206540e-04 -1.45768361e-03 4.48480782e-04] [-1.50341178e-03 -7.43520637e-04 -3.75874410e-04] [-1.99848601e-03 1.52591135e-03 1.21977690e-03] [ 1.25101347e-03 5.24591760e-04 -3.15626482e-04] [ 3.21028878e-03 -4.32981865e-04 2.79978968e-03] [ 7.79580024e-04 5.05275641e-04 3.43820941e-04] [ 1.00694957e-03 1.67716197e-03 -1.39651792e-03] [ 1.41472552e-04 -8.32141530e-04 2.74692535e-04] [ 1.25335659e-04 -1.78941173e-03 -1.13199108e-03] [-1.29741645e-04 -9.66848934e-04 -1.87200462e-04] [-3.71020974e-03 3.16343421e-03 -1.55875854e-03] [-2.63714177e-03 -6.36665182e-04 5.26003582e-04] [ 6.12983132e-04 -1.62777846e-03 1.48794931e-03] [-4.55731895e-04 1.38077941e-03 -7.42729243e-04] [-3.44011275e-04 2.09211771e-03 -7.52779303e-04]] Final stress: [-6.81473740e-05 -9.43464465e-05 -2.54253665e-05 5.71505800e-04 -2.51870889e-05 -8.68909264e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 0.07616625 0.03450506 -0.01139293] [-0.01252032 0.00480291 -0.0034454 ] [ 0.00676389 -0.07218979 -0.01021175] [-0.02040614 0.08920921 -0.01214685] [ 0.01110053 -0.00606162 -0.00341344] [-0.0377903 -0.02552405 -0.00666819] [ 0.04445277 0.12129581 -0.01560408] [ 0.06904494 -0.05941275 0.04049716] [ 0.033178 0.0076229 0.01465633] [ 0.03698585 -0.0392455 0.0197345 ] [-0.06620891 0.03433003 -0.03224171] [-0.0606923 -0.02016661 0.01145672] [-0.07841827 0.10056662 0.01667955] [-0.04825918 -0.13440515 -0.01249869] [ 0.10121298 0.10338828 -0.01266688] [ 0.09998041 -0.05717443 -0.02565316] [-0.00292253 0.07434897 0.03539596] [-0.07358636 -0.04837397 0.01460714] [-0.19054599 -0.01570717 0.03656657] [-0.00853365 0.01057984 -0.0158303 ] [-0.00672353 -0.13752752 -0.00791923] [ 0.13220158 0.03432414 -0.06317095] [ 0.01481554 0.00349256 0.03263235] [-0.03822444 0.0317767 0.00929819] [-0.03913226 0.0106435 0.05214672] [ 0.03414102 -0.06091395 0.0104623 ] [ 0.02346688 0.04520085 -0.02846753] [ 0.00427913 0.03606334 -0.04166899] [ 0.06227587 -0.02908055 -0.02271105] [-0.00083192 -0.05249569 -0.02563214] [ 0.04302424 -0.00477966 -0.05368452] [-0.02312286 0.00541001 0.00025703] [ 0.01211789 -0.03305445 0.01153338] [-0.03984606 -0.01996529 0.03147876] [-0.09317022 0.01248231 0.03234856] [ 0.03572747 0.05603512 0.03527656]] Final stress: [-0.00196688 -0.00114381 -0.00082031 -0.00114717 0.00070635 0.00059905] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.58845028e-03 -7.50680016e-04 1.58558500e-04] [-1.06323225e-03 4.86939341e-04 -3.23284077e-04] [ 4.18659014e-04 -1.23292888e-03 -3.78153220e-04] [ 1.30900354e-04 -4.16683588e-04 1.20002334e-04] [-4.75237224e-03 3.45558529e-03 1.23753216e-03] [ 3.90318275e-04 -2.32136588e-04 1.41824280e-04] [-2.10134582e-04 3.15753429e-03 -1.49277267e-03] [ 9.03287575e-04 1.36316231e-04 -1.86784287e-04] [ 1.91838767e-03 8.18621809e-03 1.69228021e-03] [ 7.80798222e-04 -1.40438332e-04 1.83180556e-03] [-3.89804339e-03 1.46259751e-05 -8.21728324e-05] [ 3.16197749e-03 2.46936931e-04 -2.21335776e-03] [-4.13415891e-03 -5.34962829e-04 -9.31275373e-04] [-1.36938723e-03 -2.45903728e-03 7.89180683e-05] [ 4.15243960e-03 1.83984879e-03 1.26851663e-03] [-1.08536141e-04 1.00556210e-03 1.25021763e-03] [ 3.01191032e-03 2.75268332e-03 -3.73490123e-04] [-2.91172009e-04 -2.22313995e-03 -1.71587697e-03] [-4.74339679e-03 4.18770248e-04 2.70779006e-03] [ 6.24024145e-03 3.34977245e-03 9.76758668e-04] [-3.98033616e-03 -9.27844731e-03 -3.22185870e-03] [ 9.11627002e-04 3.06432905e-03 -2.41904872e-03] [ 4.52221494e-03 -7.63950208e-04 -7.20933605e-04] [-4.20680952e-03 -7.48665094e-03 2.99124108e-03] [-4.48457837e-04 -1.53681137e-04 7.71308243e-04] [-2.99645053e-04 -1.29440696e-03 -7.29781310e-04] [-9.17077799e-04 8.95371326e-04 1.98492053e-04] [ 2.39513052e-03 2.45340314e-03 -8.09202093e-04] [ 1.77303716e-03 2.00622423e-03 -2.06961528e-03] [-7.66013611e-04 2.45065318e-04 1.07253472e-03] [ 1.51216288e-03 -1.66549700e-03 -9.86343006e-04] [-2.12724466e-04 1.72087010e-03 1.47108832e-03] [ 1.33574153e-03 -1.59836944e-03 -1.20400049e-03] [-1.93385094e-03 -2.94212726e-03 1.33730943e-03] [-6.57101269e-04 -2.47731259e-03 1.58814056e-03] [ 2.02206648e-03 2.14394073e-04 -1.03636798e-03]] Final stress: [-2.89370135e-04 -2.32174615e-04 -6.73812283e-05 -2.48776031e-03 3.18446022e-05 -2.85966513e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 2.35434577e-03 1.63877105e-03 -5.97646633e-04] [-2.97232278e-03 3.99108684e-04 -4.62001079e-04] [ 2.54284251e-03 -5.15776921e-03 -1.10390690e-03] [ 4.23995147e-04 -2.72496555e-03 7.98328850e-04] [ 1.87551514e-03 -2.38414710e-04 -1.76107127e-04] [ 2.07478602e-03 -3.22693074e-03 1.23538195e-04] [ 9.11226506e-04 4.27916271e-03 -1.08822237e-03] [ 2.65247317e-03 1.21333824e-03 1.05467391e-03] [-2.32592718e-03 -7.73904319e-04 -1.44162198e-03] [ 3.60695724e-03 4.94538100e-03 2.69262604e-03] [ 1.54299471e-03 1.35921740e-03 -2.77125232e-03] [-8.09711162e-04 2.36180400e-04 3.93389518e-03] [-1.65242983e-02 -9.51922386e-04 4.87393883e-03] [-1.28184038e-03 -1.70594374e-03 -1.03245673e-03] [ 1.70727456e-02 1.97224302e-03 -4.33623613e-04] [ 6.58365671e-03 3.70196581e-03 -4.94097383e-04] [ 5.55322920e-04 -1.05773118e-03 1.75139171e-03] [-7.80228247e-03 3.52960107e-04 -2.22616445e-03] [-1.34315305e-03 -1.46072116e-04 1.51070139e-04] [-1.90296512e-03 2.29964010e-03 2.12704202e-03] [-2.03205573e-03 -2.73522305e-04 -3.35504078e-03] [ 1.77745753e-03 1.76337953e-03 3.71762435e-03] [ 2.15054408e-04 1.94570377e-03 -8.95464185e-04] [-1.25096560e-03 7.08733986e-04 -2.46782383e-03] [-6.66164214e-04 -1.08120052e-03 2.31600441e-03] [-8.55383549e-03 -3.14405808e-04 3.45414207e-03] [-2.17006129e-03 -3.75549947e-04 1.08452418e-03] [ 1.80296781e-03 -1.56548449e-03 -5.27610128e-05] [ 1.02902045e-03 -9.39255938e-04 -2.41554048e-03] [ 6.23034791e-03 1.42558881e-03 -2.26696512e-04] [-1.84850648e-03 2.44481684e-03 2.66301445e-03] [ 4.02912458e-03 -1.08942876e-04 -6.22661411e-03] [ 2.84616503e-03 -4.93306569e-03 -4.69896350e-03] [-4.90327351e-03 -5.11122836e-03 -1.34898272e-03] [-3.89731236e-04 3.06895417e-04 1.04745555e-03] [-3.34990512e-03 -3.06777017e-04 1.72571785e-03]] Final stress: [-2.00097068e-03 1.90175103e-03 7.07307561e-05 3.12512144e-05 3.07997267e-03 -1.67112662e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 3.58937966e-03 -1.48911469e-03 -3.38373365e-04] [ 7.34897018e-03 3.38773555e-03 1.00131107e-03] [ 6.70023914e-04 -2.24470723e-03 -7.73623047e-05] [ 5.42552108e-03 -3.21908499e-04 -6.94477186e-05] [-2.43753524e-03 5.27353041e-03 6.51054186e-04] [-2.06335906e-03 3.35322703e-03 -1.89608393e-04] [-7.83780736e-03 2.07879046e-03 8.83713280e-04] [ 1.79115187e-03 -1.58050245e-03 -5.54832246e-04] [ 9.67858458e-04 -5.03612837e-04 -1.40165153e-03] [ 2.61166014e-03 -8.83410456e-04 -9.62909060e-04] [ 2.02297762e-04 1.02161242e-03 3.68623994e-03] [-6.43804687e-03 -2.79724129e-05 -1.55510298e-03] [-1.59039146e-03 2.69658011e-03 -1.04456324e-03] [ 5.62446744e-04 -3.10684330e-03 3.20030208e-03] [-9.82960975e-04 1.76030793e-03 -1.12749547e-03] [ 1.91596511e-03 8.54605971e-04 -2.29989314e-03] [-1.56719036e-03 -5.11440008e-03 2.53780663e-03] [ 1.19365354e-03 4.38622704e-03 -1.21472036e-03] [ 6.26324296e-03 -3.53114359e-03 -2.55418430e-03] [-1.11900241e-03 4.21559214e-03 2.81556603e-03] [-7.37151880e-03 -2.47654894e-03 7.32436058e-04] [-1.04776169e-02 3.91859126e-03 -1.63845546e-03] [-7.61998602e-04 -3.99395091e-03 3.43225908e-03] [ 3.26717248e-03 1.88493623e-03 -8.46399706e-04] [-5.52257724e-04 -2.54236844e-03 -3.65219535e-04] [-1.92913725e-03 -9.22106535e-04 3.34650440e-03] [-1.72688669e-03 4.44450517e-03 -1.53462830e-03] [-7.97104067e-04 1.26791737e-03 -5.08964181e-04] [ 1.95365635e-03 -2.62026427e-03 1.66496178e-03] [ 3.61154697e-04 7.11983081e-04 -1.97166227e-03] [-9.77272309e-04 -4.86622267e-03 -2.94104523e-03] [ 4.49418056e-03 -2.31386218e-03 3.03931696e-03] [ 2.98946421e-03 -3.06889221e-04 -2.32104082e-03] [-4.93193038e-04 1.19629490e-03 -1.11727038e-03] [ 3.62594073e-03 -2.57349154e-03 -1.58753731e-03] [-1.10461311e-04 -1.03311679e-03 1.23089581e-03]] Final stress: [ 2.07135763e-03 -1.93229493e-03 6.77463026e-05 -2.02520435e-05 -3.05824730e-03 -8.45190733e-06] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.09468161e-02 -6.99224635e-03 7.05314355e-03] [ 1.46352239e-03 5.56060230e-03 1.93361248e-04] [-2.40366259e-03 -6.69417323e-03 -2.98897232e-03] [-3.89766373e-03 2.26158079e-03 3.00828484e-03] [ 8.52905905e-03 -8.11422971e-03 -2.05794124e-03] [ 1.31685422e-03 -5.82521152e-03 -4.65332902e-03] [-4.36826951e-02 -3.17324674e-02 -1.33475540e-03] [ 4.02645359e-02 -1.57287000e-02 -8.18768617e-03] [ 1.47199347e-02 -1.43810684e-02 -4.27809913e-03] [-2.70123128e-03 1.87809223e-02 -9.11389062e-03] [-5.19518249e-02 -1.34168054e-02 -2.30116962e-03] [-5.13997055e-02 4.02843700e-02 -1.80611068e-03] [ 1.62351665e-02 -9.88422171e-03 3.28034873e-03] [ 1.32604460e-03 -3.24845505e-03 -3.18456105e-04] [ 7.23689204e-04 -1.59155245e-05 -2.98966172e-04] [-1.22615169e-02 -2.18846541e-02 -1.62029124e-02] [-9.09755233e-03 -1.77587784e-02 -5.60216838e-03] [-1.26267929e-03 3.90971106e-03 2.01551521e-03] [-3.20051794e-03 -8.84718937e-03 8.09496124e-03] [ 3.21389582e-02 5.91333632e-02 -7.95022129e-03] [-3.62094553e-02 3.36986128e-02 1.10895479e-02] [ 7.84382311e-02 -2.31411972e-02 -5.09019693e-03] [ 3.28979986e-02 1.20728799e-02 -1.10103131e-03] [-2.93317098e-03 -8.65725428e-03 1.13173046e-02] [-7.39338123e-03 3.52585586e-03 1.02327443e-02] [-9.38214008e-04 3.76074789e-03 2.05002713e-03] [-8.78793729e-04 4.66254771e-03 4.59855376e-03] [ 6.32950181e-03 3.26584208e-03 -7.49895871e-03] [-3.84096290e-04 1.63490187e-02 1.95905822e-02] [ 5.01470278e-03 -6.16886932e-03 1.27915050e-03] [-4.14785036e-03 7.11660340e-03 5.52512685e-04] [-1.40786661e-03 8.75360108e-03 1.46908951e-05] [ 9.14522361e-04 -1.37003856e-02 -4.51897817e-03] [ 8.29350267e-03 6.72517193e-04 7.87401869e-03] [-2.95717381e-03 -2.69881455e-03 -6.08464832e-03] [ 1.44964372e-03 -4.91813902e-03 -8.56255567e-04]] Final stress: [0.02764719 0.02864093 0.0168712 0.00053972 0.00146517 0.00108547] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 0.03287328 0.0279491 -0.00472004] [-0.05651363 0.03944955 -0.0081665 ] [ 0.00236232 0.0081403 0.00299926] [ 0.00353608 0.02045407 -0.0039905 ] [ 0.09065866 -0.043139 -0.01981463] [-0.01885881 -0.01323139 -0.00448599] [ 0.0236124 0.04931346 -0.00100913] [-0.05103328 0.04133246 -0.02888183] [-0.03478279 0.02249223 0.03371834] [-0.0397302 -0.03718527 0.01280404] [ 0.05735392 -0.01540818 0.02818686] [ 0.03865295 -0.02100158 -0.02444753] [-0.02549097 -0.00127266 0.03111034] [ 0.0188182 0.01458825 0.01559679] [ 0.01617042 -0.01284305 0.05691783] [ 0.0389289 0.00459 -0.02761104] [-0.05172182 -0.0164465 -0.01158508] [-0.01161385 0.00635565 -0.05131199] [-0.02049226 0.00819717 0.02577977] [-0.01043752 -0.06927429 0.0464528 ] [ 0.09307153 -0.05011323 0.02910532] [ 0.00354059 -0.00547385 -0.02910747] [ 0.04646634 0.08581402 -0.04910298] [-0.10246519 0.00553524 -0.03839806] [ 0.00185715 -0.02167376 0.01052609] [-0.06232464 -0.00356249 -0.05604134] [ 0.0405515 -0.08648007 -0.02136379] [ 0.04183083 -0.00766562 -0.00140368] [-0.01027233 -0.02945503 -0.02678509] [-0.0630214 0.04583296 -0.008879 ] [-0.03071183 0.02368232 0.00197076] [ 0.05351208 -0.00507399 0.06016097] [-0.04300695 0.08420873 0.01558681] [-0.03269684 -0.01436075 -0.00267767] [-0.00191274 0.00940534 0.04329211] [ 0.0632899 -0.04368012 0.00557524]] Final stress: [-0.00198849 0.00092728 0.00043526 -0.00098983 0.00161789 -0.00214391] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.56983340e-02 -7.69152255e-02 -2.93894446e-02] [ 1.14078321e-02 -6.07587400e-02 -7.03261954e-02] [-2.84477302e-02 3.48954803e-02 7.18445712e-02] [ 3.66227411e-03 1.20421484e-02 1.04464639e-02] [-3.17005171e-02 5.66419101e-02 5.99716100e-02] [-6.79750286e-02 1.19121281e-01 8.16528812e-02] [-1.42254002e-01 -2.71313900e-01 1.33840566e-01] [ 3.64651925e-01 -1.38200443e-01 2.71168198e-02] [ 1.20445081e-01 -1.74147888e+00 1.86585399e-01] [-1.00799378e-01 -5.07578995e-01 -6.51486329e-03] [-2.80780297e-01 -1.58643363e-01 1.15385394e-01] [-1.02752410e-01 1.16929824e-01 -4.65335191e-03] [-4.45577312e-03 2.96803587e-02 -2.31744269e-02] [ 4.56262756e-02 5.09602327e-02 1.18804524e-02] [-4.44213680e-03 -1.16556631e-01 -1.64540072e-04] [-1.00937534e-02 9.35487081e-02 4.26852474e-03] [-8.53414730e-02 -7.98967223e-02 1.69796501e-02] [ 4.69584739e-02 -4.43107447e-02 -3.28835059e-02] [-1.38496172e-01 1.34288756e+00 -1.55235279e-01] [-4.58420810e-01 5.64329309e-01 3.92300248e-02] [ 3.27861908e-01 3.62147720e-01 -3.24481592e-02] [ 6.53606806e-01 3.15484729e-01 -1.39157562e-01] [ 1.02525797e-02 1.20992353e-01 -7.99056610e-02] [-2.08563348e-01 1.68302374e-01 4.82812275e-03] [-3.25893680e-02 -3.18598643e-02 8.14167756e-02] [-2.93548729e-03 -3.97819139e-02 3.51840839e-03] [ 5.25416453e-02 5.54011234e-02 -3.70914170e-02] [-2.93757626e-02 -8.53758011e-02 -3.65400478e-02] [ 3.16895330e-02 -3.86834919e-03 -6.70199960e-02] [-1.84707979e-04 -2.71629652e-02 -5.69741784e-02] [ 4.98360339e-02 5.38882261e-02 -1.69980718e-02] [-2.09256750e-02 3.74620098e-02 -6.25482628e-02] [ 1.36119481e-01 -4.09731911e-02 2.97961087e-02] [ 1.29282712e-02 -1.02272772e-01 7.54486072e-04] [-6.13495234e-02 -3.29871033e-02 3.74490404e-03] [-7.14031007e-02 2.52202565e-02 -3.22362007e-02]] Final stress: [ 0.02156806 0.02316804 0.01341562 0.00205843 -0.00115158 -0.0022506 ] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 3.17867886e-02 -7.25333049e-03 -6.03424253e-02] [ 7.11523899e-02 1.48482783e-01 -4.37245293e-02] [ 1.08010707e-02 6.42846362e-02 -4.37588781e-02] [-2.34904887e-03 -2.19384275e-02 -3.97596000e-02] [-2.03434424e-02 1.12147592e-01 -7.45590405e-04] [ 6.30456425e-02 -2.10778088e-01 1.51625399e-01] [-2.05881059e-01 1.45776088e-01 -1.46204280e-01] [ 7.51387747e-01 3.85030804e-01 3.06399787e-03] [ 3.66293641e-02 -1.38774735e-01 7.03974239e-02] [ 2.48151209e-01 1.22420103e-01 5.14019658e-02] [-3.00984561e-01 8.89181383e-02 9.40300313e-02] [ 1.30315948e-02 3.36845870e-01 -1.04331902e-01] [-5.41902860e-02 1.91515037e-02 6.38343496e-03] [-6.44368441e-02 2.55058805e-02 3.55789435e-02] [-7.91420581e-02 2.27312946e-02 6.55751847e-02] [ 2.22436860e-02 -1.60215955e-02 -1.08269647e-01] [ 1.87172450e-02 -9.98315949e-02 -5.70213755e-02] [-1.36730824e-02 5.25252778e-02 1.11031973e-02] [ 1.58401371e-01 -1.58099438e-01 1.76788467e-01] [-5.08010194e-02 5.53658500e-01 -5.82772420e-02] [-5.70056892e-01 -6.07056411e-01 -1.02113448e-01] [-1.59411778e-01 -1.93249012e-01 2.60793480e-02] [-2.37554613e-01 -3.16602177e-01 -4.57121764e-02] [ 5.09983704e-01 2.97309792e-02 -8.13790431e-02] [-4.33622435e-02 -6.53291355e-02 6.42879754e-02] [ 1.94787010e-02 5.05248151e-02 -3.98860627e-02] [-3.51795277e-02 3.82476208e-02 2.95182692e-02] [ 2.54487794e-02 -5.46820726e-02 -3.94732383e-03] [-2.09763323e-02 -1.53459301e-02 5.69966890e-03] [-2.91898994e-02 -2.77465640e-02 4.87245485e-02] [ 7.67035287e-02 -6.65651543e-02 3.90175815e-02] [-6.90257481e-02 -2.95819361e-02 1.29182220e-03] [-9.82702227e-03 -2.19576799e-02 3.90789579e-02] [-6.37349668e-02 -1.94664256e-03 -5.28012390e-03] [ 7.30659133e-03 -8.36555755e-02 2.90138491e-02] [-3.41489877e-02 -5.95663870e-02 -7.90641932e-03]] Final stress: [ 3.31759389e-02 3.27629472e-02 1.56367465e-02 -2.62491467e-04 7.72191412e-06 -1.25083735e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 62 steps. Final forces: [[ 8.93080843e-03 1.02954138e-03 -1.62481144e-03] [-6.61695364e-03 -4.68416606e-03 -3.81186554e-04] [-5.51044064e-03 1.34918872e-02 2.11684865e-03] [-2.03081871e-03 1.61862935e-03 -7.41899983e-05] [-2.88154183e-04 -8.82587823e-03 -5.64613515e-04] [ 2.66541623e-02 1.50701692e-02 5.09728100e-03] [-2.69487608e-03 -1.09854012e-02 -6.26062768e-03] [ 4.57531622e-03 4.99383591e-03 6.33697090e-03] [-9.69605359e-03 2.55987130e-02 -4.25573729e-04] [ 1.28704716e-02 1.26928017e-02 2.94804564e-03] [-1.39465672e-02 -1.19620411e-02 -3.23299746e-03] [-5.50573678e-04 -6.80350494e-03 -1.36017701e-03] [-5.11074313e-03 1.15562960e-02 1.04459302e-02] [ 7.78006409e-03 -7.16881675e-03 4.75780257e-03] [-4.81068710e-03 3.65180068e-03 9.32204976e-03] [-1.63713539e-03 8.66630535e-03 -1.22521568e-03] [ 7.11751708e-03 -1.81985654e-02 -9.94312581e-03] [-1.99983151e-03 -4.09436424e-03 -1.78303928e-02] [ 1.39401420e-02 9.48144479e-03 3.22611039e-02] [ 1.14029532e-02 -6.40890522e-03 7.01928547e-03] [-1.43122935e-02 6.76682919e-04 3.89468857e-03] [-4.18523052e-03 5.49393460e-03 -1.28636397e-02] [ 1.32769424e-03 -2.63919793e-03 -1.32183884e-02] [ 7.66619861e-03 -1.08914072e-03 -1.20751475e-02] [ 4.83381200e-03 2.24126079e-03 3.68652427e-04] [-1.37393930e-02 -3.59891729e-03 -9.11322077e-03] [ 4.32089670e-04 -1.70624983e-02 -2.30971698e-03] [ 6.06820356e-03 1.76641964e-03 7.83653655e-03] [ 4.39936384e-03 -1.38588642e-02 -1.54969872e-02] [-9.89428409e-03 3.81008845e-03 2.17223566e-03] [-1.34601232e-02 -1.05141464e-02 7.09270624e-03] [ 7.30876429e-03 8.08358097e-03 -1.29437379e-03] [-1.32639049e-02 6.04195980e-03 -2.40275943e-03] [-5.57265811e-03 -1.57887462e-02 2.27377180e-03] [ 3.30484927e-04 8.06434719e-03 6.47907327e-03] [ 3.68267613e-03 -3.46544676e-04 1.27416276e-03]] Final stress: [-2.71598537e-05 -3.18699253e-04 -7.96522257e-05 1.92813925e-03 1.10004616e-04 3.74863498e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 4.96929813e-04 7.81810538e-04 -1.06160699e-04] [ 6.42569316e-03 -3.92335826e-03 1.48105512e-03] [-1.99287504e-04 -6.45271583e-04 -3.83763022e-05] [-2.96725124e-04 -1.53048507e-03 2.03380063e-04] [ 6.19002275e-04 -5.72390161e-05 -5.53983712e-05] [-1.69974023e-03 -4.34216568e-04 -1.99115134e-04] [-1.05287941e-04 -1.01889660e-03 6.36850042e-04] [-3.30575442e-03 -2.20276735e-05 2.00420017e-04] [ 2.68141433e-03 -2.96685990e-03 -5.31324176e-05] [ 2.55733295e-03 5.01195020e-03 -6.17647588e-04] [-4.97176980e-03 -3.42235522e-04 -8.98355093e-05] [-3.07039615e-03 2.95541939e-03 -4.07760680e-04] [ 3.88530817e-05 1.80472275e-03 -2.91237702e-03] [ 2.56257363e-04 4.22451166e-03 -2.08831776e-03] [-2.14852642e-03 -2.33853941e-03 -3.04844169e-03] [-1.20950144e-03 -1.58910993e-03 2.60358467e-03] [ 4.42224359e-04 -3.44260679e-03 1.95845546e-03] [ 2.09697702e-03 2.17815903e-03 2.97917907e-03] [-2.44171222e-03 5.32733544e-03 -2.59654197e-03] [ 2.26262922e-03 1.68802851e-03 -2.52518382e-03] [-6.58540047e-04 3.35072897e-03 -4.85276311e-03] [ 4.11239689e-03 -4.14105856e-03 2.41773633e-03] [-3.21439770e-03 -2.93350187e-03 2.44498534e-03] [ 4.50517264e-03 -5.82912181e-03 5.61913791e-03] [ 7.22278106e-05 -1.90864037e-03 1.32694545e-03] [ 2.53997929e-03 -8.55004741e-04 5.66376411e-04] [-1.68141583e-03 8.34832755e-04 -3.38390598e-04] [-2.85866651e-03 -1.55733780e-03 -3.15523988e-05] [-2.30652494e-03 2.63081120e-03 2.92035403e-04] [-1.12362567e-03 -8.92742379e-04 -6.23505276e-04] [-3.70012568e-05 2.70503427e-03 -1.79430494e-03] [-3.08326073e-03 9.35179835e-04 -8.60919061e-04] [ 1.67678276e-03 6.50838121e-05 4.99838970e-04] [ 7.92951036e-04 2.79113947e-03 -4.68043276e-04] [ 2.08787882e-03 -1.78438895e-03 2.37669693e-04] [ 7.47431105e-04 9.27894976e-04 2.40117666e-04]] Final stress: [-2.46062798e-04 -2.73641567e-04 -9.66920618e-05 -1.93462665e-03 1.31125490e-05 -3.69850190e-03] Minimization converged after 45 steps. Minimization converged after 50 steps. Minimization converged after 19 steps. Minimization converged after 48 steps. Minimization converged after 45 steps. Minimization converged after 19 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-1.68058509e-04 1.19656470e-03 -1.32323915e-04] [ 3.85153374e-03 -1.95928104e-03 7.07280507e-04] [-1.07670456e-03 1.09818357e-03 2.19469474e-04] [-1.21586478e-03 -2.38383555e-03 3.30196934e-04] [-4.13100433e-04 2.78912614e-03 3.20989891e-04] [-9.85074481e-05 5.56302372e-04 -2.04614622e-05] [ 1.68889693e-03 2.97947755e-03 1.71712942e-04] [ 8.80464986e-03 1.19935097e-03 2.18336589e-03] [ 3.20104167e-03 -4.89241950e-03 1.53189431e-03] [-2.12159616e-03 -2.41272493e-03 3.43285427e-04] [-9.43738710e-03 1.26269287e-03 -6.61173330e-04] [-3.67125211e-03 4.89053653e-03 9.09116293e-05] [-2.20716172e-04 -3.66935359e-04 9.69650084e-04] [ 4.27381927e-04 1.97689261e-03 5.25086012e-04] [ 6.64976110e-06 1.24658134e-03 1.61061016e-03] [-1.06957139e-04 -3.74295570e-04 -1.91811574e-04] [ 5.55326822e-04 -1.80123703e-03 4.82167526e-04] [-1.41461444e-03 1.17700106e-03 5.06205437e-04] [-7.01889904e-03 2.00006132e-03 -1.78341790e-03] [-3.81260371e-04 2.65938461e-03 3.91123539e-04] [-2.98257792e-03 -1.25730374e-03 1.30664480e-03] [ 7.35105877e-03 -3.34330975e-03 3.08757461e-03] [ 2.66043013e-04 -2.63332060e-03 -6.50954379e-06] [ 3.31527254e-03 4.13248697e-04 -9.52180155e-04] [ 1.99826325e-03 2.22059959e-04 -5.06149126e-04] [-1.80635890e-03 -5.15712763e-04 -2.79728603e-04] [-4.50751029e-04 1.35529537e-03 -8.07522925e-04] [-1.94285322e-03 2.56794546e-04 -3.66568084e-03] [ 1.96632732e-04 -1.90198764e-03 -9.24256763e-04] [ 2.89142322e-03 -1.12546231e-04 -1.68600899e-03] [-2.90722804e-03 -3.13601411e-03 -1.71237002e-03] [ 2.77013981e-03 1.29632039e-03 -2.75914037e-03] [ 6.66028683e-04 -1.63757548e-03 2.74224221e-04] [ 1.04015001e-03 -3.77156353e-04 1.08373164e-03] [ 4.33811466e-04 7.91661553e-04 -5.25401611e-04] [-2.02961681e-03 -2.61880515e-04 4.78012083e-04]] Final stress: [ 0.00227934 0.00118163 0.00020676 -0.00095311 -0.00031794 -0.00059214] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-5.29904131e-03 2.89816653e-04 9.64063288e-04] [ 5.49247201e-03 -4.28700152e-03 1.05158143e-03] [-3.35420238e-04 1.63037228e-02 2.24535261e-03] [ 1.57797218e-03 -1.21447251e-02 2.04104054e-03] [-6.69612780e-03 3.85306177e-03 1.07636572e-03] [ 6.03773265e-03 5.87549197e-03 1.43653453e-03] [-1.75356487e-02 -2.50504524e-02 -7.15954757e-03] [ 1.24943775e-02 6.63610370e-03 -7.03062342e-03] [ 7.00649917e-03 -1.54113331e-02 1.05666208e-02] [ 2.08274695e-02 3.56151849e-02 7.93204110e-03] [-2.65955171e-02 4.79378067e-03 4.50808294e-03] [-2.05381011e-02 1.10361748e-02 -1.74430092e-02] [ 2.02809690e-03 5.92255661e-03 -3.74534996e-03] [ 2.97139594e-03 -9.14417037e-03 -6.26086450e-03] [-1.01163818e-02 -5.28496601e-03 -3.39878944e-03] [-7.27680483e-03 4.02271792e-04 2.04865308e-03] [ 1.17615516e-02 9.99165294e-03 3.69379224e-03] [ 3.55134286e-04 -4.02383816e-03 4.91437877e-04] [-1.72690693e-02 1.65416207e-02 -2.80016062e-03] [ 1.29378367e-02 -4.07229196e-03 4.26805854e-03] [ 1.27029507e-02 1.28788695e-02 8.62813620e-04] [ 3.23813070e-02 -1.00126787e-02 4.28443856e-03] [-3.98782905e-03 -6.52307541e-03 -4.66663356e-03] [-1.12777820e-02 -2.15442288e-02 -3.69324365e-04] [-3.32001646e-03 1.29263841e-02 5.19060162e-03] [-4.49109866e-04 -4.87461436e-03 1.54258953e-03] [-5.38239450e-03 -6.65537316e-03 -1.09115351e-03] [-1.01630112e-02 -1.08327544e-03 -2.33511367e-02] [ 5.58245685e-03 -4.83144663e-03 -7.09570575e-03] [-1.15071226e-03 -2.94520834e-03 -2.47989030e-03] [ 5.02807264e-03 -1.54942704e-02 -5.53655759e-03] [-2.92397066e-03 7.37708284e-03 2.14809898e-03] [ 3.28043060e-03 2.19670459e-03 3.06227624e-04] [ 9.55537513e-03 2.37302656e-03 2.69958807e-02] [-2.70209711e-03 2.17884483e-03 8.69191971e-03] [ 9.97903767e-04 -3.80940197e-03 8.25514991e-05]] Final stress: [-0.00301778 -0.00195678 -0.00042152 0.0010258 0.00022024 0.00074197] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 3.38613167e-03 1.62450511e-03 -5.28316519e-04] [-1.38091321e-03 1.81973504e-03 -3.83316024e-04] [ 5.34588470e-04 -5.28508460e-03 -8.68718303e-04] [-3.07561037e-05 4.53459815e-03 -6.61644230e-04] [ 1.71602113e-03 -1.56006924e-04 -3.22179261e-04] [-4.52263361e-03 -1.75596146e-03 -6.71593380e-04] [ 8.27590718e-03 9.51252914e-03 -3.20780608e-03] [-1.30943236e-03 -1.13616935e-02 1.38082918e-03] [-1.28577198e-03 5.71291479e-03 2.53419191e-03] [ 1.36895946e-02 9.10787360e-03 3.07996247e-03] [ 4.85629562e-03 5.97450676e-03 -5.84311867e-05] [-5.81217633e-03 -4.18152509e-03 -1.70038125e-03] [ 7.25938627e-03 -1.13621784e-04 -2.53273580e-03] [-6.31109576e-04 1.55018294e-03 1.46119283e-04] [-4.11199258e-03 -1.55446264e-03 2.55049578e-04] [-5.87379239e-03 -2.05602858e-03 2.32396654e-03] [-7.92906069e-04 5.82072697e-03 4.66106282e-04] [ 4.66932909e-03 -3.19005390e-03 2.61581578e-04] [-1.00631359e-02 -7.87229104e-04 -2.12412180e-04] [-3.34666382e-03 -1.97570642e-03 -1.17517943e-03] [ 6.26774007e-03 -2.54315439e-03 1.69964977e-04] [ 2.20074094e-03 -4.65400518e-03 -4.81707074e-04] [-6.77875761e-03 -4.42987883e-04 7.64132630e-04] [-7.34105976e-03 -6.00702093e-03 -7.43119000e-04] [-3.23823107e-03 -3.43799884e-03 -6.32299535e-04] [-1.99169857e-03 -8.71320471e-04 -1.18394961e-03] [ 5.75767497e-03 -1.65186486e-03 5.88279708e-03] [ 1.06533704e-03 -4.12480261e-03 1.52245522e-03] [ 9.12497603e-04 2.84922450e-03 -2.55548385e-04] [-2.44307954e-03 -2.02233997e-04 -4.29823331e-04] [ 2.64625794e-03 3.43404830e-03 5.49386857e-04] [ 2.35514244e-03 -2.25558506e-04 1.30195574e-03] [-4.31900560e-03 1.92212255e-03 -4.75096812e-03] [-5.90655687e-04 3.23024094e-03 -1.36314392e-03] [-1.73063409e-03 -2.62540646e-03 -1.48444315e-04] [ 2.00176083e-03 2.11051932e-03 1.67321761e-03]] Final stress: [-0.00288632 -0.0016255 -0.00033379 -0.0009751 0.00028833 -0.0006375 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 46 steps. Final forces: [[-2.92932019e-03 -3.60180508e-03 6.38972143e-04] [ 1.69588033e-03 -1.08841118e-03 2.61811004e-04] [ 9.01467822e-04 1.47339982e-03 3.09914366e-04] [ 1.22323599e-03 -1.00989069e-03 2.16375984e-04] [-2.31723530e-03 1.49084094e-03 4.62998500e-04] [ 4.43567576e-03 5.00622250e-04 5.24040393e-04] [ 1.42929159e-03 5.28223496e-04 -8.76857999e-04] [-4.23391547e-03 -4.75144128e-03 -3.77329875e-04] [ 1.04281833e-02 -4.11153986e-03 1.46700525e-04] [-3.63127566e-04 2.02056851e-04 1.90113509e-04] [ 6.55650576e-03 5.93870705e-03 -6.71980254e-04] [-7.48490219e-03 2.49511862e-03 -1.29149613e-03] [ 2.75998490e-03 -2.67255941e-03 1.86943092e-04] [ 9.51364208e-04 2.91171485e-03 4.54939977e-04] [-4.54264286e-03 -3.33950356e-03 -1.35666430e-03] [-5.65529062e-03 3.02529455e-03 -2.08241992e-04] [ 8.76416200e-04 -1.21492194e-03 3.22724464e-04] [ 3.92292899e-03 2.35026433e-03 -1.07612154e-03] [-6.71291633e-03 8.79444440e-03 6.06003619e-04] [-4.91086685e-03 3.62795394e-04 2.31292148e-03] [ 1.78629627e-03 2.64080604e-03 -1.92176988e-03] [ 3.48693266e-03 -2.80131326e-03 7.05768741e-04] [ 3.90709760e-03 -7.82225348e-04 1.82822875e-03] [-8.51014615e-03 -3.51743377e-03 -2.39286730e-03] [ 9.60575767e-04 -1.43425778e-03 -1.24561846e-03] [-1.91039619e-03 -9.99341299e-04 -2.12473718e-03] [-1.15189403e-03 -1.98714719e-03 -4.48054252e-03] [-5.31642793e-04 -3.88106154e-04 2.65063901e-03] [ 7.91463193e-04 -1.41436289e-03 1.97194434e-03] [ 3.43722742e-03 5.48634350e-04 3.06231479e-03] [-1.34453517e-03 8.59824800e-04 3.24937628e-03] [ 3.60346069e-03 -6.55690280e-05 2.32449280e-03] [-9.01417976e-04 -1.06573710e-03 2.79200505e-03] [-5.39826429e-04 1.32073366e-04 -3.88817304e-03] [ 2.58032588e-03 1.19063890e-03 -2.16497365e-03] [-1.69423819e-03 8.00106825e-04 -1.14185469e-03]] Final stress: [1.67092701e-03 1.75360012e-03 2.33164180e-04 1.52240240e-06 6.84755402e-04 5.62801816e-06] Minimization converged after 44 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 9.08783622e-03 6.85503320e-03 -1.79249765e-03] [ 6.67122925e-03 2.61533056e-03 1.01335449e-03] [ 2.57576456e-03 2.38226042e-03 4.72401393e-04] [ 3.75811468e-03 -8.82943849e-03 8.96315831e-04] [-1.04453418e-02 1.18308647e-02 2.19219903e-03] [-2.86005775e-02 -1.45307084e-02 -5.44369056e-03] [ 2.39437362e-03 6.23708705e-03 1.01823872e-02] [-4.75635947e-02 1.27446848e-03 -5.41879813e-03] [-2.82432797e-02 -1.87920682e-02 2.81902526e-02] [-2.20296945e-02 2.36706338e-02 -6.85998100e-03] [ 8.74630573e-02 -7.26677237e-03 4.60858831e-03] [ 3.45968719e-02 5.82870376e-03 -2.90114481e-02] [-3.15581622e-03 1.15652413e-02 -1.52641319e-02] [ 2.19398043e-03 1.75321713e-02 1.25933795e-03] [ 6.03297371e-03 -9.63644506e-03 -1.31153641e-02] [ 1.56221432e-02 -1.68706814e-02 1.04105214e-02] [-6.49351823e-03 -1.29351438e-02 2.94749587e-03] [-1.31460148e-02 9.70316748e-03 1.51764699e-02] [ 3.81819515e-02 7.69316653e-03 -1.95362793e-03] [ 1.94822088e-02 -9.53765100e-03 1.45723650e-02] [ 1.87495352e-02 -4.78998541e-03 -5.40581148e-03] [-3.81513198e-02 -1.79150724e-02 -1.27354692e-02] [-3.07996010e-02 -8.21350937e-03 -4.85868498e-03] [-3.95343542e-02 1.52313645e-03 9.68802113e-03] [ 1.10096773e-02 8.41420002e-03 5.83940785e-03] [ 9.97445397e-03 -6.31184110e-03 -6.26774845e-03] [ 1.35151071e-02 1.83083197e-03 -2.06913338e-02] [-2.29603336e-03 1.10066431e-02 -2.51843052e-02] [-6.48033099e-03 5.47096687e-03 -4.06799004e-03] [ 1.54740661e-02 -1.41022138e-02 -1.75458200e-02] [-3.45076573e-03 -4.40443532e-03 -1.02753220e-02] [-3.04440121e-03 3.32781351e-03 1.20469011e-02] [-4.52507427e-03 6.31207172e-03 1.78408108e-02] [-8.58356182e-05 9.36967633e-04 2.05551630e-02] [ 2.00996207e-03 -4.45617536e-03 1.21530416e-02] [-1.07477531e-02 1.25813816e-02 1.58469900e-02]] Final stress: [ 2.18357332e-03 8.78526125e-04 8.09496850e-05 6.37429203e-04 -1.48346892e-04 1.31015682e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.00208414 -0.00087242 0.01033197] [ 0.0040233 0.01162769 -0.00339797] [ 0.02635004 -0.0134249 0.0004821 ] [-0.00881589 -0.00797605 -0.00770447] [ 0.00415641 0.00266277 -0.00131529] [ 0.00286512 -0.01315235 0.00844732] [-0.01250116 0.00095758 0.01064056] [-0.0157539 0.00606474 0.0126653 ] [ 0.01179503 0.00574539 0.0086799 ] [-0.00272634 0.02095458 0.00577657] [ 0.0461813 -0.01004011 -0.00073568] [ 0.00693729 0.02778694 0.0138109 ] [-0.01024838 0.00865198 0.0022449 ] [-0.00295668 -0.00575748 0.00043963] [ 0.01143668 -0.00347868 -0.00306791] [-0.0149271 -0.00464007 -0.0106881 ] [ 0.00749807 -0.01301955 0.00158746] [-0.00228744 0.00138015 0.00869321] [ 0.03075702 -0.00466658 0.00095908] [ 0.00896994 0.03869241 -0.00659925] [-0.02682477 -0.03562938 -0.01265076] [-0.05892735 -0.01140784 -0.00951377] [-0.00852816 -0.0181389 -0.01320609] [ 0.00262192 -0.00514798 -0.0092418 ] [ 0.00900344 0.00177542 -0.00132333] [ 0.00531135 0.01157935 0.00465347] [ 0.01115604 0.00297298 -0.00820691] [-0.00214534 0.01480467 -0.00092668] [-0.00895194 -0.00566129 -0.00419802] [-0.01042254 -0.0019846 -0.00301869] [-0.0175585 0.01045057 0.00930668] [ 0.01220494 0.00813082 0.00226815] [ 0.00320277 -0.00903552 0.00421482] [-0.00230029 0.00115172 0.00100241] [-0.00466779 0.00713203 -0.00988029] [ 0.00398878 -0.01848809 -0.00052939]] Final stress: [ 0.02907443 0.02842281 0.01646851 -0.00037008 -0.00017631 -0.00086835] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-3.77628939e-03 -2.37489786e-03 7.91778888e-04] [-9.59906347e-04 6.85181403e-04 -1.19480443e-04] [ 5.04977248e-04 -1.46858121e-03 -2.26778888e-04] [ 2.17442321e-04 3.40865768e-03 -6.60507413e-04] [-1.87075368e-04 5.05039523e-05 5.93068836e-06] [ 1.00518527e-03 -6.12427992e-06 7.76551429e-05] [-1.15101925e-03 -4.31138640e-03 1.31557594e-03] [ 3.51405500e-03 1.83009693e-03 -9.32861589e-04] [-2.00532360e-05 7.57681192e-04 4.30865940e-04] [ 5.39951123e-03 7.17333974e-03 -1.28785910e-03] [-2.30712608e-03 -3.37058592e-05 2.10698946e-04] [ 1.63909056e-03 2.24591229e-03 3.29051033e-04] [ 3.12365758e-04 1.14778112e-03 -1.07413015e-03] [ 1.16668920e-03 2.43316990e-03 6.26544865e-04] [-2.04845013e-03 -2.33856563e-03 9.78925129e-04] [-7.27746115e-05 -3.30850575e-04 1.09036925e-03] [ 4.69091788e-04 -6.77975980e-04 -9.57870781e-04] [ 6.54053086e-05 1.46811980e-04 -6.15375118e-04] [-4.28421443e-03 -9.44096144e-04 2.20632958e-03] [-4.00660182e-04 -4.10173804e-03 -4.93641550e-04] [ 1.06286065e-03 1.89548193e-03 -2.66248939e-04] [-1.31469251e-03 1.19960416e-03 -2.37139169e-03] [-1.70915488e-03 -4.77743965e-03 4.99661499e-04] [ 1.88161018e-03 -1.64970334e-03 4.64680008e-04] [ 2.18695365e-03 2.40719935e-03 -8.48956706e-05] [ 1.43198070e-04 -4.80835335e-04 -3.54282685e-04] [-1.81382755e-03 -3.51158634e-04 4.81746276e-04] [ 1.99595494e-03 6.96386751e-04 -1.47446501e-03] [-1.99914074e-03 1.11468161e-03 -4.20169870e-04] [-2.62772118e-04 -6.29729080e-04 7.12818937e-04] [-1.66221631e-03 -2.70795625e-03 1.81739564e-04] [-1.10018976e-04 3.84104979e-04 3.10079360e-04] [ 1.77126843e-03 7.14900673e-04 -5.08669667e-04] [-1.47117183e-03 -8.28572588e-04 1.32014550e-03] [ 2.09823516e-03 -1.04410022e-03 4.63506294e-04] [ 1.16669159e-04 7.65921434e-04 -6.49474281e-04]] Final stress: [-0.00274171 -0.0016662 -0.00030684 0.00062228 0.00031863 0.00122302] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-9.38905178e-04 1.51770533e-03 -3.15065955e-04] [-1.27777843e-02 3.01588472e-03 -2.17325664e-03] [ 8.08685439e-05 -2.07110139e-02 -3.51429489e-03] [-4.07165476e-03 2.57680367e-02 -3.54030011e-03] [-6.99002098e-03 3.67883109e-03 1.57041757e-03] [-5.79165251e-03 -6.67988959e-03 -8.28891914e-04] [ 1.45182410e-02 6.53065694e-03 7.77382836e-03] [-6.09776027e-03 8.13839107e-03 6.01330147e-03] [-4.99327905e-05 -4.08298790e-02 -3.76571528e-03] [ 8.57417397e-03 4.90606154e-02 -9.20480628e-03] [ 1.58567015e-02 -1.07962645e-02 -1.50313539e-03] [-2.74008723e-02 6.56110190e-02 7.30167091e-03] [ 6.42772592e-03 -1.12699927e-02 9.93707302e-03] [-2.97479190e-03 -2.07633362e-02 -2.13865255e-03] [ 1.09065667e-02 5.66375711e-07 -4.72610699e-03] [ 3.14342405e-02 -3.43303965e-03 -8.27476964e-03] [-1.52932120e-02 2.71920100e-02 1.34925345e-03] [-3.26634249e-02 1.52351343e-03 8.27833785e-03] [ 5.33673576e-03 -1.13918579e-02 -3.41539901e-03] [-1.07749012e-02 -2.21684073e-02 6.68404599e-03] [ 2.18428283e-02 -1.75559140e-02 7.71010385e-03] [ 3.94173171e-03 -6.74685916e-03 5.07603699e-03] [ 1.42367447e-02 -1.28716857e-02 -1.11759085e-02] [-2.50231032e-02 -7.18481321e-03 -8.69363162e-03] [-1.00760747e-04 5.75328237e-03 -8.19420073e-03] [ 1.63489867e-02 -1.57018849e-03 7.40745344e-03] [ 9.16856709e-03 2.40097307e-03 3.49454606e-03] [-1.51338452e-03 4.05970800e-03 -4.39363998e-03] [ 1.19891645e-02 -9.64496212e-03 -1.12535082e-02] [-8.95222540e-03 6.93753259e-03 -7.93154595e-03] [ 1.07821932e-03 -3.73017284e-03 1.98267903e-03] [-1.42907928e-02 -1.93366757e-03 -1.11549629e-02] [-6.30415673e-04 -7.15727721e-03 5.15588631e-03] [ 7.99607163e-03 -7.45705673e-03 8.94740366e-03] [-1.53345376e-02 1.70418092e-02 3.39091174e-03] [ 1.19325651e-02 -4.33425747e-03 1.41248429e-02]] Final stress: [-0.00318322 -0.0020211 -0.00040013 -0.00054229 0.00027803 -0.00127618] Minimization converged after 44 steps. Minimization converged after 51 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 2.68738815e-03 2.63459022e-03 -6.38565466e-04] [-3.33344085e-04 2.48574038e-04 -1.08769993e-04] [-5.68828808e-04 -1.11532013e-04 5.43864417e-05] [-1.01859426e-04 2.46739878e-05 4.63248913e-05] [ 2.07614016e-03 -6.71023593e-04 -2.98586781e-04] [-1.61461904e-03 7.80288198e-05 -2.55830358e-04] [ 1.97439864e-03 3.29972725e-04 -5.50839368e-04] [-1.28618292e-04 3.33572111e-04 6.18208846e-04] [-3.07943574e-04 -1.39576914e-03 -3.65409429e-04] [-1.07660195e-04 -4.23620445e-04 8.20241133e-04] [ 8.15094219e-04 7.00660312e-04 -1.53504796e-04] [-1.62982079e-03 3.60076698e-06 7.27674224e-04] [ 2.68481665e-04 2.70608119e-04 -4.75860551e-05] [-4.28276927e-04 1.41710005e-03 -5.97857864e-06] [-4.69170103e-04 1.97309143e-04 9.13108522e-04] [ 5.81969049e-05 1.49242789e-04 -2.79925245e-04] [-7.99266826e-04 -1.49093642e-03 9.00092866e-05] [ 3.50743906e-04 3.84012661e-05 -3.08100136e-04] [ 1.37192077e-03 -1.25066003e-03 -1.65038264e-03] [-1.81498499e-03 2.89783860e-03 4.76335842e-04] [ 9.08280068e-04 9.40685824e-04 1.08299179e-03] [-2.91659679e-03 -7.66606700e-04 1.55338330e-03] [ 5.97069841e-04 2.24997850e-04 -7.19103212e-04] [ 2.75145671e-04 -1.41587695e-03 -1.36840713e-03] [-4.46907634e-05 -1.03791068e-03 4.68622085e-04] [ 3.58296500e-04 6.74532614e-04 -1.61995221e-03] [-1.06288483e-03 6.91352081e-04 -2.89330097e-04] [ 1.30117308e-03 -4.09276792e-04 2.44163639e-04] [ 1.51776171e-04 -9.16197687e-04 -1.76093876e-04] [ 3.91200551e-04 2.73514269e-04 -2.51620982e-04] [-7.03749360e-04 6.45203443e-04 -4.15485837e-04] [-5.33838514e-04 -8.64185299e-04 1.19040465e-03] [ 1.64145800e-03 -1.25720474e-03 7.97388788e-04] [-1.15269832e-03 1.32923341e-04 -5.25023413e-04] [-5.22608947e-04 -3.96130223e-04 6.83371866e-04] [ 1.46962982e-05 -5.00451648e-04 2.61880290e-04]] Final stress: [0.00119746 0.00230144 0.00022706 0.00096057 0.00027814 0.00054939] Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 1.78979695e-03 1.27563464e-03 -3.95006126e-04] [-2.24975384e-03 1.53335209e-03 -4.43452966e-04] [-5.07594565e-04 -2.23200782e-03 -3.16337409e-04] [-3.69916622e-04 3.02080649e-03 -4.98146847e-04] [ 1.64175089e-03 -6.82398801e-04 -2.59185883e-04] [-1.82903797e-03 -6.59464836e-04 -3.42239891e-04] [ 2.89755208e-03 3.46963704e-03 -3.44280786e-04] [-5.41379423e-04 -3.50168707e-03 -1.94138799e-03] [-7.01625490e-05 -1.95602483e-03 -9.43655499e-04] [-1.77142144e-03 -2.63914554e-03 1.26194796e-03] [ 1.66567801e-03 1.73955529e-04 2.10372197e-03] [-1.97770988e-03 9.09987638e-04 1.56358669e-03] [ 1.49780520e-03 -1.34394264e-03 -8.41927680e-04] [-8.58853028e-04 8.44031731e-05 8.79651572e-04] [-8.99189743e-04 -6.86442519e-04 5.82585706e-04] [-1.05753901e-03 3.30641106e-03 1.08111236e-03] [ 7.46192416e-04 -1.69957381e-03 -5.70030503e-04] [ 3.51299582e-04 -3.05808522e-05 3.25220336e-04] [-2.38970437e-03 4.55588186e-03 -2.61076045e-03] [-2.37259329e-03 -4.97623785e-04 -7.64278554e-04] [-1.11493372e-04 2.88604690e-03 -2.22331451e-03] [ 2.63609200e-03 -3.54403041e-03 2.21388625e-03] [ 2.49924634e-03 5.78324085e-04 6.86520060e-04] [-2.14496296e-04 -1.58183496e-03 2.14019070e-03] [-4.64860388e-05 -2.01499066e-03 2.43892282e-03] [ 2.11615434e-03 -2.16132617e-03 3.44738625e-03] [-1.89747233e-03 1.33995100e-03 -4.21726845e-04] [-1.39701776e-03 -1.00033236e-03 3.62764360e-03] [-1.40335792e-03 -1.27329814e-03 8.21109014e-04] [ 3.38677631e-03 4.28015545e-04 1.49807778e-03] [-7.08458942e-04 2.36378533e-03 -2.39985051e-03] [-1.52452349e-03 1.31198035e-03 -3.52632876e-03] [ 2.51760261e-03 -1.26450884e-03 3.09030937e-04] [ 2.25873393e-03 5.12985757e-04 -3.83781519e-03] [ 7.89222434e-04 9.16266808e-04 -3.76475774e-04] [-2.59574123e-03 1.01788748e-04 -1.92439182e-03]] Final stress: [-0.00166698 -0.00281122 -0.00030416 0.00096944 -0.00028978 0.0006511 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-8.55871511e-04 -1.52916556e-03 2.05277073e-04] [ 2.27203489e-03 1.25283325e-04 3.13615526e-04] [ 1.76843424e-03 2.73725094e-03 4.30977020e-04] [ 1.53471194e-03 -2.10937654e-03 2.78841459e-04] [-2.12102285e-03 2.39498039e-04 3.34108049e-04] [ 2.99001189e-03 1.64260880e-04 4.08309953e-04] [ 6.35565933e-04 -1.02945630e-03 -3.50322205e-03] [-1.83395801e-03 -1.96872599e-05 -1.96905092e-03] [ 2.16715023e-03 4.35100709e-04 -1.41981622e-04] [-1.08683570e-04 3.13425897e-03 4.14296228e-03] [ 6.00233176e-03 -9.43755826e-04 1.80811552e-03] [-2.93950347e-05 -2.05439205e-03 4.06772601e-04] [ 4.74688646e-03 -1.68707560e-04 -6.10261863e-04] [ 3.69195235e-04 -3.79005038e-03 1.87663018e-03] [-3.50106253e-03 2.58022205e-03 4.93126439e-04] [-5.36611210e-03 -1.44489576e-03 1.90635285e-04] [ 7.15858543e-04 3.68482709e-03 -1.01303484e-03] [ 3.54769996e-03 -1.92071341e-03 -4.62183009e-04] [ 4.57740519e-03 1.18326380e-03 1.01815580e-03] [-1.36809080e-03 1.07285317e-03 7.44574966e-04] [-1.44147252e-03 -9.93801150e-04 2.38395759e-03] [-6.06443052e-03 -2.56094227e-03 -1.50204034e-03] [-3.55867396e-04 -2.91888037e-04 -5.47090610e-04] [-1.41488658e-03 -8.62393663e-04 -1.07661687e-03] [ 2.15206707e-03 1.06499201e-03 1.70674130e-03] [-3.65516500e-03 1.79857048e-04 -6.23195111e-04] [ 3.48570863e-03 1.67617627e-03 -1.65503146e-04] [ 4.46286761e-05 2.09980620e-04 -2.91425914e-04] [-2.34202701e-03 -4.06008495e-04 9.54674927e-04] [-3.04028831e-03 -3.09339517e-04 -2.42712553e-03] [-9.85199733e-04 4.00431022e-04 -2.53417804e-03] [ 1.85191441e-03 6.88333318e-04 9.72573749e-04] [-5.56850454e-03 -2.11470707e-04 -1.32939725e-03] [-1.62562170e-03 -3.51016985e-04 -7.04597679e-04] [ 1.80042436e-03 1.89340928e-03 -1.52083869e-03] [ 1.01563032e-03 -4.72937048e-04 1.75169375e-03]] Final stress: [-0.00158907 -0.00281652 -0.00031331 -0.00097737 -0.00031205 -0.00065163] Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.85651553e-03 -2.01357204e-03 5.33102354e-04] [-1.06535441e-03 5.59246094e-04 -2.19437573e-04] [-1.96003509e-04 2.87256552e-03 4.71806683e-04] [-9.62995609e-04 4.69789617e-04 -8.26033834e-05] [-1.41634901e-04 -1.00352615e-03 -9.25117502e-05] [ 3.03369394e-03 2.09788839e-03 6.43202515e-04] [ 8.02293769e-04 -6.58707642e-04 2.83100121e-05] [ 5.52719558e-03 6.58008543e-04 -1.61913402e-03] [-1.76177491e-03 3.93287205e-03 1.00141316e-03] [ 5.69097410e-04 1.06972128e-03 -1.82768748e-03] [-7.68062056e-03 -1.51749948e-03 2.09421035e-04] [ 1.50986545e-03 -7.57839718e-04 1.09929659e-03] [ 8.63128196e-05 -8.47696968e-04 -1.38237928e-03] [-7.38391050e-04 -5.27555357e-03 -5.79125685e-04] [ 1.34996466e-04 2.75470511e-04 7.26781030e-04] [-5.70488971e-04 -6.85399502e-05 6.20470414e-04] [ 5.71525869e-04 4.97070562e-03 -5.45185776e-04] [-4.79639045e-04 -4.03578713e-05 4.51517876e-04] [-5.37116606e-03 1.85524932e-03 -1.25086052e-03] [ 5.35273645e-03 -4.73666559e-03 4.77032472e-04] [-3.55710852e-03 -2.10920426e-03 -4.51384509e-05] [ 7.59174455e-03 -4.42454662e-03 7.67287635e-04] [-5.71856309e-03 1.12892883e-03 -8.14474360e-05] [ 3.75119669e-03 4.12215652e-04 7.40965665e-04] [ 2.86887516e-03 4.37648041e-04 6.94060467e-04] [ 3.80301099e-04 1.40357677e-03 -3.70466623e-04] [ 2.22601470e-03 -2.48891950e-03 -6.50026404e-04] [ 6.42352413e-04 -1.06573526e-04 -5.37622054e-04] [-6.39323298e-04 -3.24791278e-03 -8.41970337e-04] [ 7.57717439e-04 -4.84837262e-04 1.82249749e-03] [-2.11690987e-03 9.42449201e-04 5.54795152e-04] [ 8.10138266e-04 -9.65881215e-04 -1.27358854e-03] [-2.46583754e-03 2.24548385e-03 1.10673828e-03] [-9.74713461e-04 4.92699581e-04 -9.84639458e-04] [ 3.15956223e-04 4.63247818e-03 1.77255035e-03] [-6.34973976e-04 2.90837101e-04 -1.33742440e-03]] Final stress: [0.00117028 0.00231096 0.00022599 0.00061255 0.00029378 0.00119025] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-3.53869006e-03 -1.84857876e-03 5.14171888e-04] [ 1.01068369e-03 5.23752725e-06 2.80641982e-04] [ 3.29632020e-04 -6.40318738e-03 -1.18600785e-03] [ 5.49783079e-04 1.71819663e-03 -4.24298302e-04] [-4.73219766e-03 2.87122912e-03 1.07542906e-03] [-1.26648341e-03 -1.17374067e-03 -2.15391808e-04] [-1.84171492e-04 4.34277535e-05 8.13064617e-04] [-5.50689473e-03 -2.99544389e-04 -9.48409454e-04] [ 3.29340510e-03 -2.53709527e-03 1.23449711e-04] [-2.38106616e-03 -5.08474947e-04 6.40968121e-04] [ 8.70218077e-03 -1.23367850e-03 -8.99462251e-04] [ 1.89759093e-03 5.76715440e-04 2.61420333e-04] [-1.59313797e-03 7.66755297e-04 8.64126006e-05] [ 4.19991638e-03 -2.46081434e-04 9.43072971e-05] [-5.83569371e-04 -5.17465779e-03 -1.23830971e-03] [ 2.41036171e-03 2.73487862e-04 7.14732204e-04] [-2.64363092e-03 7.68425852e-04 -9.51288619e-04] [ 9.33253163e-04 5.21856518e-03 1.27079574e-03] [ 5.91159992e-04 -2.15025059e-03 8.93606630e-04] [-5.99529225e-03 -4.75305258e-03 1.31801214e-03] [ 1.26569691e-02 6.98849077e-03 -3.81874716e-03] [-4.95882265e-03 6.16880186e-03 -9.27019354e-04] [ 6.10251414e-03 3.91518388e-03 -1.13612311e-03] [-9.30631461e-03 -3.33597504e-03 3.71656231e-03] [ 2.55733339e-03 -4.64472998e-03 2.30150142e-04] [-1.23599987e-03 5.42754673e-04 -1.52482836e-03] [-9.93736380e-04 -2.66554206e-03 -2.02486550e-03] [-1.35090406e-03 -3.72391950e-03 3.91545962e-03] [-3.59276156e-03 8.06735785e-04 2.84660319e-04] [ 8.79778677e-04 3.51152029e-03 6.28054716e-05] [-1.32713930e-03 4.04483514e-03 2.38637319e-04] [ 1.12083330e-03 -1.35080022e-03 1.43047747e-03] [ 3.13708118e-04 2.97366504e-03 1.20930103e-03] [ 5.29714270e-04 3.86259497e-03 -4.35259665e-03] [ 4.09115193e-03 -1.27849829e-03 6.66814156e-04] [-9.79157341e-04 -1.72881567e-03 -1.94532023e-04]] Final stress: [ 0.00115368 0.00232896 0.0002559 -0.00057516 0.00034848 -0.001216 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 3.11060421e-03 2.23341412e-03 -7.59642917e-04] [ 9.98670569e-04 -5.66065246e-04 1.46463042e-04] [-3.92349416e-05 -9.80133361e-04 -1.42436925e-04] [-2.46778606e-04 -3.12026993e-03 4.86381122e-04] [ 1.04783079e-03 -5.56970635e-04 -1.03609024e-04] [-2.75372162e-03 -2.06163782e-03 -6.10532774e-04] [-2.87008316e-04 6.88720826e-03 1.74442699e-03] [-2.90746528e-04 -2.20709198e-03 -5.45523146e-05] [ 5.17431163e-03 9.65600924e-04 9.28631740e-04] [-9.74087284e-04 -3.72132060e-03 -1.02620750e-03] [ 8.53408669e-03 -1.21929683e-03 1.02482831e-04] [-7.18624230e-03 -3.52520731e-03 -1.07596117e-03] [ 7.32151097e-04 2.01152664e-03 3.05095966e-04] [ 3.54412334e-03 1.39206865e-03 1.92031808e-04] [-4.14384272e-03 -4.39006937e-03 1.39056319e-04] [-1.72362079e-05 -3.20940071e-03 -9.03994562e-05] [-1.34412972e-03 5.56738511e-03 4.45741202e-06] [ 1.94963285e-03 -1.32300047e-03 -7.88512676e-05] [-1.81563418e-03 2.25108471e-03 3.94801611e-04] [-4.87532425e-03 -2.72715751e-03 1.21725475e-03] [-1.16293762e-03 1.94674313e-03 -4.49867316e-04] [ 1.37256877e-04 4.59694481e-04 -2.58223367e-04] [ 6.23542314e-03 2.91698068e-03 -1.68313833e-03] [-2.57285566e-03 -9.17394192e-04 6.06104017e-04] [-8.92794008e-04 2.67097391e-03 -5.08195759e-05] [-8.22615541e-04 -5.81202283e-04 -9.97220278e-04] [-8.24156943e-04 3.49229326e-03 -1.20842602e-03] [-7.61943356e-04 1.24326031e-03 -1.70394986e-04] [ 6.91662027e-04 2.91671962e-03 7.50015772e-04] [-3.88900778e-03 -1.10332242e-03 -1.53018904e-03] [ 2.60349276e-05 -1.16265664e-03 2.77306110e-04] [ 4.34874029e-04 8.15077399e-04 6.89440555e-04] [ 3.92248987e-04 -2.02025357e-03 1.05851745e-03] [ 7.47787647e-05 -1.40278310e-03 -1.74988773e-04] [-1.21102010e-03 -2.45878834e-03 -2.30970503e-04] [ 3.02762777e-03 1.48399111e-03 1.65396403e-03]] Final stress: [-0.00167316 -0.00281778 -0.00034314 0.00062213 -0.00030678 0.00119414] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.25142433e-03 -6.73657574e-04 1.07346491e-04] [ 3.96230554e-03 4.09434120e-04 5.99908373e-04] [ 4.46690475e-04 -2.98953939e-03 -4.48558858e-04] [ 2.04418891e-03 -1.28991106e-03 1.67090656e-04] [-3.84919931e-03 6.50613082e-04 7.55586776e-04] [-5.83462196e-04 -1.00381456e-03 -1.29022876e-04] [ 1.29603908e-02 1.78250759e-02 6.03307608e-04] [ 3.71074644e-03 -4.24270582e-04 1.92594976e-03] [-6.54589774e-03 1.79055930e-02 1.19804505e-03] [-1.38852362e-03 -6.13796047e-03 -7.25496230e-04] [ 1.75677191e-04 -2.60185793e-03 -1.79641509e-03] [-4.39233113e-03 8.02108754e-03 -2.19880961e-03] [ 3.13454278e-04 8.50718328e-04 -1.23517505e-03] [ 4.76604907e-04 1.11234796e-03 -7.07238105e-04] [-2.00132216e-03 -2.34009306e-03 -1.44135965e-03] [ 8.40551195e-04 -2.26610658e-03 3.68660826e-04] [ 1.51969594e-03 4.14721505e-03 1.51879497e-03] [-7.26050275e-04 -1.19879339e-03 7.91264834e-04] [ 1.29763210e-03 -2.20524596e-03 8.85994896e-04] [ 1.14277852e-03 -2.18793477e-02 -6.91657643e-04] [-7.08341155e-03 -4.78177082e-03 1.69511469e-04] [ 3.71695036e-03 -2.41698779e-03 -1.27437804e-03] [ 2.87165139e-03 -2.54300814e-03 7.67860849e-04] [-6.67873479e-03 -3.56118886e-04 1.43055950e-04] [ 6.15999972e-05 3.10672708e-03 -3.52025886e-03] [ 7.76910856e-04 -6.99877458e-04 -2.43297009e-04] [ 2.06296021e-04 9.45536999e-04 2.35719456e-04] [-7.50097138e-04 2.92422030e-03 -8.70455149e-04] [ 2.76182323e-04 3.70517595e-03 -1.40787839e-03] [ 3.85978584e-04 -5.42799940e-04 -1.50594279e-03] [ 1.27389759e-03 -5.78857534e-04 2.80526675e-03] [-2.54454845e-03 1.14056873e-03 1.02064270e-03] [ 2.84513995e-05 -3.61896396e-04 -1.35538784e-05] [-7.73057998e-04 -3.94518742e-03 9.99311402e-04] [ 3.37566303e-04 -2.11389986e-03 3.85578709e-04] [-2.58140403e-04 6.06688438e-04 2.76059970e-03]] Final stress: [-0.00172724 -0.00283882 -0.00034172 -0.00062586 -0.00031749 -0.00120672] Minimization converged after 16 steps. Minimization converged after 13 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.49677867e-03 2.19169179e-03 5.11147811e-04] [-1.67504280e-03 -2.06866710e-03 -1.03842935e-03] [-4.56678465e-03 4.83219323e-04 1.38002539e-04] [ 1.23704093e-03 7.50040784e-04 -2.74019853e-03] [-1.72769907e-03 6.54060739e-04 -1.01355352e-03] [-2.67822358e-03 3.34052325e-03 -1.65564663e-03] [-1.94120358e-04 1.50308002e-04 -3.64541331e-03] [-3.82314421e-03 -3.66029244e-03 -6.63184637e-05] [ 3.80355521e-03 -1.40751506e-02 7.42454473e-04] [ 2.33915822e-03 5.67736990e-04 1.52698664e-03] [ 1.75733477e-04 5.58112132e-03 -5.37087275e-04] [-2.77119495e-02 2.53563232e-02 1.23977841e-03] [ 1.34057548e-03 3.30827253e-03 -1.18901055e-03] [-1.26418050e-03 -3.83064366e-03 6.10084370e-04] [-1.84137685e-04 1.99508578e-03 3.93765284e-03] [ 7.36777382e-04 -6.37076922e-05 -8.90639979e-04] [-6.58886154e-04 -7.25305361e-04 -2.22678747e-03] [ 2.96555410e-03 4.29403800e-04 -1.24154926e-03] [-1.61941583e-03 1.83456554e-02 7.04158217e-04] [-2.06923643e-03 1.37760571e-03 1.07453455e-03] [ 1.73864454e-03 -1.75309279e-03 -2.26872311e-03] [ 1.86757794e-02 -1.14646787e-02 2.25807797e-03] [ 1.53675153e-02 -9.42339793e-03 3.22417999e-03] [-3.49961656e-03 -6.64500133e-03 -2.34426863e-03] [ 1.23409592e-03 -2.05119534e-03 -1.05694419e-03] [-2.36587256e-03 -1.96464661e-03 6.50185412e-04] [-4.35280154e-04 -2.51723915e-03 -3.31285057e-04] [ 3.88412296e-03 1.59131147e-03 4.34145857e-04] [-2.41736377e-03 -6.89595253e-04 -2.23113653e-03] [ 2.12241197e-03 1.38604875e-03 4.00961331e-03] [-1.54060252e-03 -6.77255226e-04 -8.07300146e-04] [ 2.58790999e-03 -3.13716418e-03 -2.63785474e-03] [ 1.30296071e-03 -2.00261849e-03 9.84446407e-04] [-1.09650757e-04 -3.76399121e-04 4.48119910e-03] [-5.01583836e-04 7.82133136e-05 6.53916470e-04] [ 1.02773400e-03 -4.60571159e-04 7.41582360e-04]] Final stress: [2.79829844e-02 2.78493812e-02 2.04997885e-02 8.83798856e-04 3.33718427e-05 3.45307931e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 1.22983545e-03 1.36052460e-03 -1.34299913e-04] [-1.26372968e-03 1.19215749e-03 -2.50304020e-04] [ 1.88893326e-04 2.18892863e-03 4.20677760e-04] [ 5.51785674e-04 -2.95722339e-03 4.01520772e-04] [ 4.26771095e-03 -1.77502900e-03 -8.97335403e-04] [-3.23666761e-04 -6.61117706e-04 -1.77012821e-04] [ 2.63017126e-03 1.84056875e-03 -1.93505535e-03] [-5.72471847e-03 2.99592565e-03 -2.10477371e-03] [ 9.76600998e-04 -8.23783797e-03 4.13945352e-03] [ 4.92917792e-03 7.48096051e-03 3.39490895e-03] [-3.75294997e-03 2.72260051e-03 2.44330882e-03] [ 4.67556069e-03 -5.90880775e-03 -5.20529345e-03] [ 1.64527766e-03 -9.69559239e-04 -1.32471356e-03] [-2.17919863e-03 -1.27909163e-03 -1.91655957e-03] [ 4.61026577e-04 -3.09029279e-04 -9.62733798e-04] [-1.73593223e-03 3.28727011e-04 1.75166609e-03] [ 1.36239968e-03 2.04961441e-03 2.09376457e-03] [-2.37382829e-04 -1.95302388e-04 4.93705094e-04] [ 2.75279887e-03 8.50277913e-04 -2.50638116e-03] [-4.95972669e-04 8.23458363e-04 -2.98966773e-03] [-2.42066540e-03 -3.89928106e-03 -1.94451122e-03] [ 1.27964060e-03 5.65570315e-03 2.45979325e-03] [-5.35637401e-03 1.06768874e-03 2.74687948e-03] [ 8.66461022e-04 -2.29714097e-03 2.14257698e-03] [-2.61457441e-03 1.08924727e-04 2.30497472e-04] [ 2.74083313e-03 2.92927373e-03 -9.85263688e-04] [-2.48418885e-03 4.28125365e-03 2.87304163e-04] [-4.05894335e-03 -8.75518072e-04 -6.49700861e-04] [-1.52164602e-03 2.53775783e-04 1.51219259e-03] [ 1.56711206e-03 -3.70500586e-04 3.27524388e-03] [ 1.31348741e-03 -3.55847552e-04 -3.97169976e-04] [-4.00208574e-03 -2.85532479e-03 1.99329732e-03] [ 1.69697167e-03 -3.74593682e-03 -1.42249490e-03] [ 3.99438689e-03 9.15870831e-05 1.49211036e-03] [ 1.06067505e-03 -9.69871024e-04 -1.01002498e-03] [-2.01877787e-03 -5.59531488e-04 -4.46560496e-03]] Final stress: [ 2.19297766e-04 2.37091051e-04 4.42432430e-03 -9.69035903e-04 -1.80690232e-05 -5.30470724e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 1.37618975e-03 9.31271831e-04 -3.17620981e-04] [-1.73523059e-03 6.00811281e-04 -2.50464742e-04] [-7.02060547e-04 -4.08928817e-03 -5.43174289e-04] [-3.60438351e-04 3.24232218e-03 -5.08631758e-04] [ 2.07595246e-03 -8.36408684e-04 -3.45482266e-04] [-2.61443247e-03 -7.82176196e-04 -4.48104278e-04] [ 3.38569505e-04 6.55861977e-03 3.55905753e-05] [ 4.46977972e-03 -3.16346631e-03 1.81859053e-03] [ 2.79407098e-03 -5.94443547e-03 -2.07744560e-04] [ 5.94787780e-03 2.15659042e-03 3.82221948e-04] [ 1.34282978e-03 3.02695850e-03 4.96824875e-04] [-8.13716372e-03 1.26517328e-02 -9.10522838e-04] [-1.64171450e-03 2.24017593e-03 -7.10145916e-04] [ 7.69398058e-04 1.72794045e-03 -3.19216312e-04] [ 1.33580928e-04 -3.91550101e-03 -2.22455468e-03] [-4.87854932e-03 2.88645592e-03 1.14687126e-03] [ 1.36888194e-03 -5.34534274e-03 1.27834212e-03] [ 5.05735397e-03 2.40246657e-03 2.03261186e-03] [ 1.08155850e-03 -6.15291863e-03 -2.24043675e-03] [-5.05647229e-03 6.87570109e-03 -7.18802088e-04] [-5.39534958e-03 -3.34223310e-03 -2.78550638e-03] [-1.70057779e-03 3.72553033e-03 1.92280779e-03] [ 4.59957453e-03 -1.48801035e-02 4.28748859e-05] [-1.84423330e-03 -3.09468300e-04 2.78020403e-03] [ 4.40770848e-04 1.07212338e-03 -2.52538031e-04] [ 1.11636179e-03 -1.24761153e-03 1.10749867e-03] [-2.10754594e-03 8.91630091e-04 9.82532735e-04] [-1.07787946e-03 -3.28470156e-03 1.35326840e-03] [ 9.95256102e-04 1.49578212e-03 9.23459007e-04] [ 3.07109581e-03 7.48007864e-04 -2.42007649e-03] [-1.00409677e-03 -1.61981655e-03 -1.57471903e-03] [-7.94719275e-04 3.00107290e-04 -1.46012600e-04] [ 3.32541995e-03 -7.24541882e-04 1.21840836e-04] [ 2.56813228e-03 3.44191964e-03 7.07679612e-04] [-1.34017185e-03 -1.56517245e-03 -2.09368496e-03] [-2.48201893e-03 2.27038687e-04 1.88421982e-03]] Final stress: [-2.06450957e-04 -1.65758103e-04 -4.45985757e-03 9.45761264e-04 9.78849464e-06 5.78105016e-04] Minimization converged after 55 steps. Minimization converged after 47 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[-3.37737029e-03 -8.64905032e-05 5.96550890e-04] [-1.78128224e-03 9.64945089e-04 -1.83458454e-04] [-7.44083893e-04 2.57039465e-03 3.66041720e-04] [ 7.43958271e-04 9.50720165e-04 -1.42257208e-04] [-1.28687292e-04 1.49971119e-03 1.05826548e-04] [ 3.94493229e-03 2.77871509e-03 7.90548078e-04] [-6.92305042e-04 1.87437855e-03 5.61318461e-04] [ 2.18973627e-03 -1.52537342e-04 3.03995332e-05] [-1.70733764e-03 -7.50185305e-04 -2.86154104e-03] [ 5.59554739e-04 1.50676475e-03 2.25839388e-03] [-5.57480065e-03 5.82545703e-05 2.25303167e-04] [-1.22437386e-03 5.32555256e-03 -9.94667983e-04] [ 3.92365898e-04 -6.67799005e-04 7.93485745e-04] [ 5.98039195e-04 -1.27242179e-03 -2.40866038e-04] [ 1.53961355e-03 1.15535134e-03 5.38273272e-04] [ 5.83757132e-03 -6.45962838e-04 -4.89562799e-04] [ 5.22810185e-04 1.86156838e-03 6.12501040e-04] [-8.16270237e-03 -2.12659822e-03 -1.80894528e-03] [-2.91804480e-03 2.01280809e-03 2.19563576e-03] [ 1.66770471e-03 -1.72337011e-03 1.04538888e-03] [-8.09119889e-04 -1.75435448e-03 -3.95616309e-03] [ 9.25899232e-03 -3.04082488e-03 -1.74411515e-03] [-5.09897830e-04 7.42101058e-04 -9.15101245e-04] [-9.96900637e-04 1.29295229e-03 3.64999988e-03] [-2.36239437e-03 -2.43260971e-03 4.22980990e-03] [-1.22195846e-03 -3.40446556e-04 1.64916678e-03] [-2.65545036e-03 2.83042140e-04 -1.46942104e-03] [ 1.32078839e-03 -5.84257684e-04 1.34742296e-03] [ 4.52269600e-03 -4.84931615e-03 -2.70783237e-03] [ 5.34760916e-03 -3.20865353e-04 1.80117633e-03] [ 1.88139658e-03 6.11287734e-06 -5.57936908e-03] [ 1.14773500e-04 -1.62967796e-03 1.35702901e-03] [ 1.52038432e-03 -2.37132454e-03 -4.75311644e-04] [-3.47787469e-04 -4.08891012e-04 1.18752307e-03] [-2.78155846e-03 2.58617489e-03 2.54052671e-03] [-3.96687113e-03 -2.31161425e-03 -4.31370920e-03]] Final stress: [1.19948269e-04 5.01481462e-05 4.39844892e-03 6.16276127e-04 5.95599186e-05 1.18735218e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 6.94947351e-05 2.18836317e-05 -4.44667967e-05] [-4.57234964e-03 2.45124743e-03 -8.36036527e-04] [-3.26741178e-04 -2.66045233e-04 -2.39538526e-05] [-1.77726235e-06 3.14644206e-03 -4.61219471e-04] [ 2.45116341e-03 -9.84918177e-04 -4.93480066e-04] [ 1.34507235e-03 9.90169251e-04 1.57555412e-04] [ 2.45272028e-03 4.68528011e-03 2.85308422e-04] [-6.90514896e-03 1.80676214e-04 3.84106319e-04] [ 1.90885982e-03 -1.25472649e-03 1.11881609e-04] [-9.87030013e-04 -1.38815089e-04 -6.18174179e-05] [ 1.11471504e-03 -5.21915925e-04 7.58401353e-04] [ 8.86548150e-04 -3.73150750e-03 -2.78787192e-04] [-2.68532327e-03 1.76028526e-03 -1.17983528e-03] [ 3.61658360e-04 2.08003263e-03 9.79858050e-04] [ 3.32183475e-03 5.75468132e-04 -9.22291511e-05] [ 3.56348233e-03 -1.83312668e-03 1.29228976e-03] [-9.98043975e-04 -2.30524773e-03 -4.09788247e-04] [-3.35939957e-03 -1.57585386e-03 1.35667383e-04] [ 2.54256553e-03 1.37272187e-03 2.99748095e-03] [-2.10992354e-03 -4.30228537e-03 -3.57176237e-04] [ 4.40154126e-03 2.73373078e-04 -3.56418936e-03] [-1.99125295e-03 1.77991662e-03 -2.93534821e-03] [-4.36736124e-04 2.33481523e-03 3.11460493e-04] [-1.84265264e-03 -1.25297376e-03 3.08463325e-03] [-3.55855689e-03 -9.10520773e-04 2.33351030e-03] [-4.20806754e-03 -8.81495964e-04 1.43824471e-03] [-1.93941038e-03 -7.73348196e-04 1.37837180e-03] [ 3.42083053e-03 1.41822863e-03 -1.33722328e-03] [ 9.55886635e-04 3.50057352e-03 -3.56930709e-03] [ 1.10841907e-03 1.37940474e-04 -9.41105068e-04] [ 2.80659287e-03 3.29273653e-04 -2.93190590e-03] [ 4.39853003e-03 4.22987873e-06 -7.39650378e-04] [ 1.98969227e-03 -3.29512759e-05 -1.24994152e-03] [-1.96654868e-03 -2.35265775e-03 1.93862204e-03] [-7.09744766e-04 -3.90244845e-03 3.18148569e-03] [-5.00900038e-04 -2.17194275e-05 7.38583506e-04]] Final stress: [ 1.65078645e-04 4.69484379e-05 4.38106244e-03 -5.91960218e-04 4.41164654e-05 -1.17718320e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 1.16020520e-03 4.40369627e-04 -2.59017623e-04] [-1.51831478e-03 5.68492119e-04 -2.21605310e-04] [-2.66253744e-04 -3.89708668e-03 -5.63874117e-04] [-4.43949066e-04 2.69160840e-03 -4.55073790e-04] [ 3.08365034e-03 -1.82865586e-03 -5.30150120e-04] [-1.31037691e-03 -3.97667560e-04 -2.83280817e-04] [-1.02077891e-03 -1.61540858e-03 -4.38746587e-04] [-7.94656534e-03 2.54034641e-04 9.26184656e-04] [ 1.61251055e-03 3.37079084e-05 -4.36071898e-04] [ 3.25396480e-03 2.73143256e-03 3.45297505e-04] [ 6.37875378e-04 1.57021635e-03 5.05650976e-05] [-3.54342597e-03 -5.22185157e-04 9.08851443e-04] [ 1.54408096e-04 1.66626084e-03 -1.91168046e-04] [-3.14116095e-04 -3.96840824e-05 1.94338255e-04] [ 1.68451184e-03 -1.00263656e-03 -1.77595500e-03] [ 4.91860256e-04 -1.10703213e-03 5.12120171e-04] [-8.53888798e-04 6.63331374e-04 1.99621795e-04] [-1.32345906e-03 2.74949285e-04 2.08526577e-03] [ 3.71379970e-03 -4.38039370e-03 -1.05611292e-03] [-9.44625770e-04 3.52142418e-03 -1.80510474e-03] [ 4.48440015e-03 4.24592623e-04 -2.80800953e-03] [-3.73160045e-03 4.47286210e-03 7.20191908e-04] [ 6.34677793e-04 -5.13364146e-03 1.32783533e-03] [ 1.55847803e-03 -1.12393307e-03 2.89103319e-03] [ 3.60732473e-04 -2.71096408e-03 1.69920781e-03] [ 2.42923477e-03 -4.88444927e-04 -1.03980102e-03] [-1.81507892e-03 2.62703234e-03 1.34114861e-03] [-1.07601920e-03 -1.99974818e-03 -1.15191554e-03] [-5.83664841e-04 9.31010691e-04 2.55869123e-04] [ 3.21774014e-03 2.17332616e-04 3.62502088e-03] [-8.94981107e-04 3.14937434e-03 -1.91640459e-03] [-2.06389891e-03 -7.01188015e-05 9.40114039e-04] [ 2.59255222e-03 -2.25372534e-03 -6.82987270e-04] [ 1.81261092e-03 1.92797420e-03 1.49520386e-03] [-1.09726355e-04 -5.94056796e-04 -6.17669520e-04] [-3.12248845e-03 9.99376771e-04 -3.28492102e-03]] Final stress: [-3.06093397e-04 -3.75307513e-04 -4.47593632e-03 6.22659643e-04 5.06431052e-08 1.16902992e-03] Minimization converged after 57 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[ 1.79323677e-02 -1.89639416e-02 -7.82702489e-04] [-5.51511051e-03 -2.21529248e-02 6.09909615e-04] [-7.72828288e-03 -4.70602235e-02 -5.15744954e-03] [-7.05793103e-03 3.63055052e-02 -7.05438819e-03] [-1.33813339e-02 -2.56424344e-02 -1.99342333e-03] [-4.74879437e-02 -3.34144513e-02 -1.04667992e-02] [ 3.03936985e-02 1.45620043e-01 -8.77975941e-03] [ 1.21322258e-01 7.71752091e-04 1.40659508e-02] [-4.55990029e-02 7.58737876e-02 4.06012545e-03] [ 8.08292579e-02 1.80545339e-01 -2.97482766e-02] [ 1.12035137e-01 -3.93277895e-02 8.82200863e-03] [-3.47113939e-02 1.21171852e-01 2.41633426e-02] [-3.77176791e-02 3.72067276e-02 4.49785135e-02] [ 3.76492992e-03 3.39866731e-02 -4.82585901e-03] [ 5.62454129e-03 -2.71471555e-03 -3.79786802e-02] [ 7.50977049e-02 -3.13096241e-02 -3.09638475e-05] [-8.19895258e-03 -1.20931158e-02 -1.38803684e-02] [-2.73031366e-02 -1.27435045e-02 1.38811834e-02] [-1.40554956e-02 3.86654865e-02 -1.10040365e-02] [ 4.57999617e-02 -1.51907817e-01 -1.25172495e-02] [-1.14559972e-01 -5.28251273e-02 3.48472334e-02] [-1.66043262e-02 -3.56779481e-02 6.78701517e-02] [-8.35666180e-03 -9.97779503e-02 -6.91277055e-03] [-9.59237183e-02 -6.65285559e-02 -7.02442667e-02] [-4.04504795e-02 -5.04169525e-03 -5.87139610e-03] [ 8.76094133e-03 1.24557769e-02 -1.46765467e-02] [ 5.78567668e-03 -6.03267859e-03 2.55945838e-02] [ 4.16678515e-03 9.18824867e-03 -4.50178425e-03] [ 2.98494532e-02 6.48048799e-03 -1.34347895e-02] [-2.73524029e-02 3.51595745e-02 5.88510022e-03] [ 1.59059684e-02 -1.25825555e-02 2.75767613e-02] [ 1.03695909e-02 -2.01903227e-02 -4.13068562e-02] [ 1.62344997e-02 6.45981668e-03 5.04147689e-03] [-8.48347620e-03 -1.89195486e-02 1.65039026e-02] [-1.50551154e-02 -5.48473730e-03 -3.03597969e-02] [-8.33035763e-03 -1.94994105e-02 3.76279191e-02]] Final stress: [-1.76773932e-04 -5.72634833e-04 1.15687596e-06 1.88596922e-03 -6.86881556e-04 1.42572094e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-3.61772456e-03 9.54315742e-02 -4.14699215e-03] [ 1.62046758e-01 -5.56497053e-02 2.74421742e-02] [-4.11805013e-02 -3.25344247e-03 -6.74285485e-03] [ 1.37013174e-03 -7.55985636e-02 8.17839094e-03] [-6.70209407e-02 1.44272618e-01 2.57168305e-02] [-9.57165843e-02 -4.08255805e-02 -1.02992799e-02] [ 1.39552520e-02 8.60235821e-02 6.41136839e-02] [ 6.05944623e-02 -2.17367222e-02 -4.01548805e-02] [ 5.80349734e-02 -4.52221597e-02 -4.49123218e-02] [ 1.41631609e-01 6.13504264e-02 4.30886827e-02] [ 1.60894821e-01 -3.76976840e-02 -4.18315334e-02] [-1.64380052e-01 1.30746606e-04 2.99634101e-03] [-8.15347035e-02 -1.65331136e-02 -2.77513718e-02] [-9.79092336e-03 -1.52721418e-01 -1.67453216e-02] [ 4.88110078e-02 4.29736483e-03 5.90158797e-02] [ 1.46567200e-01 -2.18155080e-01 2.15857391e-02] [-1.07183539e-01 2.53245573e-01 -3.26838041e-02] [ 5.45781971e-02 4.40244990e-02 -1.70582362e-02] [ 1.30490406e-01 4.61606254e-02 -1.56699056e-02] [-2.56847860e-02 1.43310571e-01 2.93747755e-03] [-6.70895055e-02 3.74559488e-02 3.99692631e-02] [-1.26838794e-01 4.66730229e-02 7.17456046e-03] [ 3.67853776e-02 -1.88415229e-01 -2.39472928e-02] [-7.79490016e-02 -4.82829393e-02 1.29958834e-02] [ 8.91182220e-03 7.89028580e-03 9.17371928e-03] [ 6.99285866e-03 3.01726361e-02 -2.81840431e-02] [ 1.43950875e-02 4.55273263e-03 1.90459744e-02] [-2.14446881e-02 8.63747480e-03 -4.15682754e-02] [ 3.11613989e-03 -2.60746554e-03 5.09245914e-02] [-1.07658290e-02 1.60427244e-02 -2.25399240e-02] [-3.13799310e-02 -4.01185087e-02 -1.49750380e-02] [-6.58909460e-03 -5.17728172e-02 3.73264470e-02] [-1.01496831e-01 6.91268261e-02 -4.37539280e-02] [ 1.95355276e-02 -3.38087777e-03 2.59100623e-03] [ 2.32407539e-03 -2.80758763e-02 5.56750780e-02] [-3.13722777e-02 -6.87520485e-02 -5.69867198e-02]] Final stress: [-0.00020467 0.00234046 0.00010115 -0.00189105 -0.00070446 -0.00206469] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 1.06899033e-03 -5.16961628e-04 -1.27424433e-04] [-1.01511425e-03 -8.42799716e-04 -9.27752836e-05] [ 1.19802731e-05 4.51398747e-03 7.76855228e-04] [-1.64503981e-03 -6.41880646e-04 1.63915742e-04] [ 2.13271927e-03 -1.92192724e-03 -3.96823005e-04] [ 1.60482780e-03 1.24726333e-03 2.67150395e-04] [-5.09367324e-03 3.11212535e-03 -1.86763687e-03] [-3.53422745e-04 -6.57222178e-03 4.71364934e-04] [ 8.83617435e-04 1.45005174e-03 -8.20148746e-04] [-5.36860649e-03 4.29582617e-03 7.58085470e-04] [-1.96732853e-04 -9.74403205e-03 2.91898137e-04] [ 3.51474852e-03 -5.00997072e-05 6.08605395e-04] [ 2.94578831e-03 4.31505466e-03 4.27652373e-04] [ 2.48977456e-03 -3.22862405e-03 -2.21740393e-04] [-4.10987829e-03 1.17097223e-03 -1.60794776e-04] [-4.49810502e-04 1.83684624e-03 -1.10940103e-03] [ 1.45434768e-03 -3.60727230e-03 5.25581218e-04] [-2.56679960e-03 -1.35775893e-03 2.44329488e-04] [-7.01412696e-04 2.00507787e-03 -2.16360569e-03] [ 1.73449501e-03 -2.92482847e-03 1.28029669e-04] [-1.54005273e-03 -4.89742360e-04 -5.56391774e-04] [ 5.71014114e-03 2.46086536e-03 1.80227009e-03] [-9.04769705e-05 1.89911591e-04 2.12838612e-04] [-1.29844271e-03 2.43748531e-03 7.99823148e-04] [ 1.05166533e-04 -2.04234528e-03 1.58404110e-03] [ 1.91589270e-03 -1.55138534e-03 1.76798007e-03] [-1.17530904e-03 1.37165567e-04 9.59440985e-04] [-1.87753891e-03 1.86205566e-03 -3.22302928e-04] [-2.37994154e-03 1.01739356e-03 8.44304330e-04] [-1.98074667e-03 3.77292690e-04 -1.82506071e-05] [-3.84106578e-06 2.24288527e-03 -1.36062520e-03] [-6.25559229e-05 2.25543610e-03 -1.74430902e-03] [ 1.33014990e-04 3.72041953e-05 -4.46253264e-04] [ 2.97963032e-03 -7.08246602e-04 3.13286046e-04] [ 2.06940799e-03 -5.79216741e-04 -1.30281732e-03] [ 1.15485317e-03 -1.85557519e-04 -2.36152102e-04]] Final stress: [-6.61156879e-04 5.37563527e-04 -6.14009572e-06 9.61837535e-04 9.52614664e-04 6.48026484e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[-5.90690180e-03 -3.28385346e-03 1.19062590e-03] [-3.76295714e-03 3.13470779e-03 -9.27838976e-04] [-5.78109988e-04 -2.11442014e-04 -1.25042645e-04] [-2.77118974e-04 6.03850102e-03 -8.47690601e-04] [-1.92679247e-03 -7.17238253e-04 1.38185112e-04] [ 2.12115248e-03 1.86933509e-03 7.01000821e-04] [-1.61959964e-03 -2.72185887e-03 1.24129903e-03] [-6.17513078e-03 -1.19981110e-02 -6.59905292e-03] [ 2.33475336e-03 2.13454715e-04 5.61079673e-03] [ 6.21545904e-04 1.16311826e-02 -1.12558144e-03] [ 1.33172971e-02 -1.94699097e-03 2.21401715e-03] [-2.83834287e-04 2.44763446e-03 -1.22314376e-03] [-1.45128197e-03 2.75538541e-04 1.23272723e-04] [-6.83723417e-03 -1.51324451e-02 -1.43603862e-03] [ 1.11455520e-02 1.32027707e-02 9.04586140e-04] [ 1.38943618e-03 1.90159434e-05 -5.55704379e-04] [ 5.03097149e-03 7.89356891e-03 1.27489039e-03] [-5.62584638e-03 -7.66945889e-03 -2.67009792e-04] [ 5.70866434e-03 2.43170117e-04 2.91163894e-04] [ 3.38582586e-03 -3.15060722e-04 1.09787508e-03] [ 8.06068682e-03 2.51878289e-03 -2.37310231e-03] [-4.04345914e-03 -2.27244778e-04 4.88457970e-04] [-1.04931263e-03 -9.13980950e-04 -2.67083005e-03] [-8.80487255e-03 -3.78405328e-03 2.92756702e-03] [ 3.58861394e-03 -3.34566518e-04 1.69366266e-03] [ 3.65232340e-03 2.55571571e-03 -2.19454004e-04] [-2.15937317e-03 -1.04212931e-04 -3.40837593e-04] [ 7.04569980e-04 -2.40744273e-03 -1.05915584e-03] [-4.86173949e-03 -4.59761152e-03 -1.09173851e-04] [-7.45403408e-04 -1.60123362e-03 -6.98399294e-05] [-4.55945319e-03 2.65157826e-03 1.20469362e-04] [-4.35770638e-03 -1.59202662e-03 -1.93042231e-03] [ 1.37376660e-03 -9.71245184e-04 1.12435660e-03] [-1.92078000e-03 6.15314591e-04 -2.83767976e-05] [ 4.01552520e-03 4.28226982e-03 9.49698327e-04] [ 4.96222886e-04 9.37536269e-04 -1.83629081e-04]] Final stress: [ 6.27356219e-04 -7.05127589e-04 5.55814253e-05 9.97410829e-04 -9.32056030e-04 6.02791598e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[-1.95285621e-03 1.68246279e-04 2.38498172e-05] [ 1.01576224e-03 -3.22314282e-04 1.93035288e-04] [-1.81763285e-03 -6.15821527e-03 -1.13052733e-03] [ 5.04904025e-04 4.17489053e-06 9.83002136e-05] [ 6.84426337e-04 6.18523294e-04 1.75339043e-04] [-5.22992139e-04 1.08004138e-03 -8.59082398e-05] [ 6.20934668e-04 7.20322999e-04 1.68020355e-03] [ 8.25321119e-04 -2.79253645e-03 6.03669150e-04] [ 9.55872048e-04 2.51120110e-03 -2.15891519e-03] [ 1.82335707e-03 1.79415748e-03 7.63836397e-04] [ 1.36917668e-03 -2.91568107e-03 -2.18925157e-03] [-3.69703859e-03 -8.07184448e-04 1.98960437e-03] [-6.87235798e-03 1.23223698e-03 1.69258089e-03] [-7.89377817e-04 -1.81668143e-04 1.12674941e-03] [ 4.79362910e-03 1.39789254e-03 -1.12978079e-03] [-7.11791696e-03 -2.14066272e-05 -3.07272913e-04] [ 3.33945229e-04 -5.75730146e-07 -1.73085452e-03] [ 9.31394407e-03 -3.85816903e-04 7.08783841e-04] [-2.17522200e-03 2.53106660e-04 2.68402397e-03] [-3.33752231e-03 -1.75295293e-03 3.55542651e-03] [ 4.52115677e-03 3.50896047e-03 -2.19463038e-03] [ 1.71935454e-03 -3.53491729e-03 -2.40733849e-03] [-2.36792499e-03 4.48241376e-03 -3.33556979e-03] [ 1.02395548e-03 3.91785490e-03 1.50179662e-03] [-2.11640431e-03 -2.05786459e-04 1.05550494e-03] [-9.77137446e-04 4.11318428e-04 3.77961898e-05] [ 1.41588399e-03 -8.32448591e-04 -1.09065785e-03] [ 3.97077378e-04 1.62925570e-03 -7.55022790e-04] [-4.56688776e-04 -1.47550604e-03 -7.42063311e-04] [-5.07121605e-04 9.92851372e-04 -5.46050422e-04] [ 1.85995776e-03 5.78764807e-04 4.18711598e-04] [-2.29750165e-04 -6.19393790e-04 -2.20360796e-04] [-7.56792864e-04 -6.18752783e-04 -2.45918668e-04] [-1.28357311e-03 -2.81568224e-03 5.97102482e-04] [ 7.51471417e-04 5.92243819e-04 2.12916084e-03] [ 3.04818021e-03 -4.52727800e-04 -7.65352064e-04]] Final stress: [-6.63522220e-04 5.37839381e-04 -2.30838344e-06 -9.22279643e-04 9.95235611e-04 -6.08423097e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 65 steps. Final forces: [[ 5.37278764e-04 -2.39727037e-04 -1.96262900e-04] [ 4.69340448e-03 -1.73131469e-03 1.16181683e-03] [-6.97613957e-04 -8.06032427e-03 -1.08462906e-03] [ 1.03904925e-03 4.34579710e-04 -2.07625135e-04] [-7.12110704e-03 4.55905560e-03 1.42548048e-03] [-7.69778211e-03 -1.80285227e-03 -1.31926441e-03] [-3.95814965e-03 -3.26718261e-03 2.65486941e-03] [ 2.09054743e-02 1.13044579e-03 1.86081655e-03] [ 1.43603487e-02 -1.62637949e-02 2.19385428e-03] [-1.22862436e-02 -1.66704680e-02 -4.60449668e-03] [-2.93873242e-02 -4.50401547e-03 3.27514924e-03] [-8.00646794e-03 1.73045055e-02 -5.13925123e-03] [-1.92585835e-03 1.64695499e-04 4.05619049e-03] [ 2.81935555e-03 8.57232428e-03 -3.55034703e-03] [-1.00931211e-03 -6.69535453e-03 -3.34796019e-03] [ 1.01322373e-02 -5.58513808e-03 -6.07801163e-03] [-4.15844316e-03 -3.61766985e-04 7.71490619e-03] [ 1.46447364e-03 7.30054802e-03 1.64778324e-03] [-8.11692744e-04 6.25431788e-04 3.33979255e-03] [ 3.78671201e-05 2.28693744e-02 -3.44348144e-03] [-2.63434056e-02 -7.28871696e-03 -2.75481920e-03] [ 2.00363689e-02 -4.44316660e-03 -3.35124833e-03] [ 3.65240660e-03 -4.77319423e-04 3.90482509e-03] [ 2.07145637e-02 1.55302398e-02 2.33955525e-03] [-1.98930433e-03 -2.24834023e-03 -6.79360917e-03] [-5.24293938e-05 8.23834263e-05 -2.33849237e-03] [-4.48629450e-03 -4.00530225e-03 7.74392537e-04] [-8.93059612e-04 1.22795727e-04 -1.30822341e-04] [-2.22607321e-03 -3.39357229e-03 -3.30651022e-04] [ 1.10172938e-04 -2.05537360e-03 2.30588346e-03] [ 5.86178898e-03 3.28089557e-04 5.31103180e-04] [-6.88804041e-04 -1.25031559e-03 4.90503080e-03] [ 5.48144430e-03 1.40983080e-03 2.33341678e-03] [-1.45021293e-04 1.89495832e-05 1.36995694e-03] [ 6.07109021e-04 3.61555202e-03 -4.28626247e-03] [ 1.43104330e-03 6.27524437e-03 1.16241131e-03]] Final stress: [ 7.71187534e-04 -5.42820677e-04 2.32518602e-05 -1.00201492e-03 -9.32824182e-04 -5.12252993e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.23739135e-04 -9.07797826e-04 -1.23312454e-03] [-4.02979454e-04 -7.69637880e-04 -1.29118253e-04] [-1.26362019e-03 8.86702327e-04 1.20129590e-03] [ 4.48960514e-04 -6.24217840e-04 -2.11121724e-03] [ 8.51635141e-04 6.24033135e-04 1.22562463e-03] [ 5.56215167e-04 1.14165651e-03 -1.32475318e-04] [-2.74778184e-03 -2.23155228e-05 1.39483095e-03] [ 1.07249546e-02 2.92664215e-03 7.82974987e-04] [ 5.97181165e-03 -7.63498788e-03 2.24438617e-04] [ 6.61303366e-03 8.24409874e-03 1.29130889e-04] [-2.32461972e-02 8.14078237e-03 1.04756035e-03] [ 1.06590348e-03 7.15012802e-06 -2.05377879e-04] [ 2.42192088e-03 1.41840738e-03 -7.69169813e-04] [-9.28680428e-04 1.09880288e-03 9.78181174e-05] [-3.16455532e-03 -4.93493860e-04 -8.11580880e-04] [-7.14719988e-04 1.69615532e-03 -1.35583053e-03] [ 1.84325998e-03 2.13986889e-03 -4.51383802e-04] [-1.65017323e-04 -2.03925847e-03 -2.03666074e-04] [-4.70694591e-04 2.95306107e-03 1.65866412e-03] [-4.13670387e-03 1.25228494e-02 2.62557455e-05] [-9.69009799e-03 -7.22900788e-03 7.07264558e-05] [ 1.12061487e-02 -4.72726984e-03 3.42707705e-03] [-9.43617260e-04 -4.48784332e-03 -9.50819132e-04] [ 3.87328231e-03 -1.29710407e-02 1.91138715e-03] [ 7.22873918e-04 1.25071828e-03 -8.39559616e-04] [ 1.93609506e-03 -2.05479513e-03 -3.18373440e-04] [ 3.48402010e-04 7.79351565e-04 -8.99327399e-06] [-2.23316556e-04 1.23621797e-03 2.42355816e-04] [-4.37916155e-04 -7.52275244e-04 5.64801491e-04] [-1.15817054e-03 -1.82424257e-03 1.14008639e-03] [ 6.24455589e-04 9.53926017e-04 -1.22885242e-03] [-1.18832951e-03 -5.45040876e-05 3.91785281e-04] [ 7.88422172e-04 -7.46463226e-05 -3.98245890e-04] [-1.08683210e-04 -1.16753658e-03 -1.64041913e-03] [ 1.43865449e-04 1.18952279e-04 -2.41195711e-03] [ 4.26102071e-04 -3.04505474e-04 -3.36649601e-04]] Final stress: [2.80217765e-02 2.80615815e-02 1.65833414e-02 1.22871448e-03 1.93943281e-05 1.10427108e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-1.49421527e-03 -7.95292160e-04 3.17460184e-04] [ 2.10526133e-03 -6.76894191e-04 3.64044223e-04] [ 3.97424615e-04 4.43104825e-03 7.33526992e-04] [-7.27253211e-04 -3.25620859e-03 4.95391395e-04] [-1.55714455e-03 5.56511558e-04 2.18140123e-04] [ 7.20708109e-04 1.53242255e-03 2.01086513e-04] [ 8.01763591e-03 8.03823692e-03 -1.94119817e-03] [ 3.71919163e-04 -1.56964636e-03 -5.80922207e-04] [-6.97048758e-05 -7.72881928e-04 1.73107270e-03] [ 3.19275057e-03 -1.36072698e-03 -4.01139542e-05] [ 1.78143607e-03 -1.45670760e-03 1.18004264e-03] [ 3.56639700e-03 -1.37321654e-03 -1.74578628e-03] [ 3.94909269e-03 7.13491691e-04 -3.07244216e-03] [-5.29925640e-04 -2.49445591e-03 -1.81746211e-03] [-3.53235389e-03 2.37121770e-03 2.05561826e-03] [-2.84276363e-03 -1.74791828e-03 1.12152143e-03] [-8.37267226e-05 -1.31752408e-03 1.33956741e-03] [ 3.32617294e-03 1.14985804e-03 -6.50230687e-04] [-1.66530550e-03 -2.52644856e-03 -2.19839093e-03] [-4.65140479e-03 -4.34368147e-03 -1.41122810e-03] [-4.28635338e-03 -4.51923951e-03 -2.58741938e-03] [-4.90800600e-03 2.94761138e-03 5.48328257e-04] [ 2.71460805e-04 3.10862187e-03 1.47522275e-03] [-1.13467942e-03 -4.82949610e-03 4.82500177e-03] [ 2.67978720e-03 2.91602369e-04 -1.29114803e-03] [ 1.95511945e-03 1.57917923e-03 2.18934354e-03] [-1.64611851e-03 1.38497088e-03 -9.78234957e-04] [-2.31316134e-03 -2.61793733e-03 5.83829015e-04] [-1.40738898e-03 2.79375030e-03 1.06322567e-03] [ 6.10913936e-03 -3.72647796e-04 3.06247471e-03] [-7.01426530e-04 1.21523642e-03 9.41889580e-05] [-1.66658328e-03 3.66383859e-04 -2.27153829e-03] [ 4.55549889e-04 -1.06086982e-03 2.30371505e-03] [ 2.37278157e-03 3.83544479e-03 -1.08755042e-03] [ 9.46174716e-04 -3.69251638e-04 -1.18286067e-03] [-7.00129587e-03 1.14545705e-03 -3.04627525e-03]] Final stress: [ 1.29055043e-05 -7.51183268e-05 7.66490150e-08 3.75655232e-04 1.08199863e-05 -5.73782755e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 0.00442802 0.0002571 -0.00041438] [-0.00535616 0.00761854 -0.00147604] [ 0.00453671 -0.00646831 -0.00101574] [-0.00240796 0.0136337 -0.00224584] [ 0.00340282 -0.00412673 -0.00095167] [ 0.00168825 -0.00386546 -0.00011414] [ 0.00266921 -0.01357625 0.00350387] [-0.00152391 0.00279203 0.00389282] [-0.00040607 0.01339382 0.01169057] [-0.0080973 -0.0072816 -0.00112967] [-0.00139765 -0.00656794 -0.01037258] [-0.00703883 0.00205279 0.0040224 ] [ 0.01407082 -0.00619284 -0.0131593 ] [-0.01030766 0.0085484 0.00110786] [-0.00214014 0.00015242 0.00453038] [ 0.0138545 0.00335438 0.01301328] [ 0.00644717 -0.00619844 -0.00034974] [-0.02258342 -0.00080959 0.0039772 ] [ 0.01596293 -0.01342933 0.01005426] [ 0.01284916 0.00944045 0.00300462] [-0.01263794 -0.01369788 0.00331218] [-0.00974809 -0.00620398 -0.00994426] [-0.00274958 -0.00280806 -0.0039675 ] [ 0.02813127 0.01789326 -0.00158286] [-0.00308857 0.00754764 -0.00505966] [-0.01518372 -0.00313695 -0.01393748] [ 0.00555989 -0.00477041 -0.01011923] [ 0.00175092 0.00533857 -0.00407544] [-0.00905353 0.0059566 -0.00115866] [-0.00628948 -0.00092856 -0.01602194] [-0.00033372 -0.00151781 0.01034497] [ 0.01753982 0.00417462 0.00552242] [-0.01054038 0.00989575 0.009132 ] [-0.00500177 -0.00959952 -0.00915066] [ 0.0032725 -0.00510328 0.00334902] [-0.00027811 0.00423287 0.01578895]] Final stress: [ 2.12071006e-04 8.35360017e-05 -3.57221567e-05 -4.17377493e-04 8.33778181e-05 5.91894589e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 1.04992645e-03 6.89705893e-04 -2.18790196e-04] [ 3.30055239e-03 -1.17125165e-03 5.87222447e-04] [ 6.67996889e-04 -2.68216602e-03 -4.38401587e-04] [-3.49520675e-04 4.03459301e-04 -4.20686814e-05] [-2.22426049e-04 -5.89080777e-04 5.94496141e-05] [-2.85325282e-03 -1.30281893e-03 -4.33270506e-04] [ 1.90425017e-03 7.14304839e-04 7.66823999e-04] [-1.83414094e-03 -2.40337018e-03 -1.15891520e-03] [ 1.18039357e-03 9.49642104e-04 7.72329994e-04] [-2.26322625e-03 -2.40205845e-03 -9.19434504e-04] [ 2.35076876e-03 -1.50008871e-03 1.05384807e-03] [ 7.89348617e-04 -2.88783592e-03 -6.93914285e-05] [ 5.01529832e-04 1.27273834e-04 -4.47124118e-04] [ 3.53947247e-04 1.66802978e-03 7.99742510e-04] [-1.02367904e-03 -1.30056740e-03 -6.16532385e-04] [-9.20236020e-04 1.26658935e-03 -5.75885101e-04] [-3.83651346e-04 -2.10997057e-03 -1.03770183e-03] [ 8.79131328e-04 1.38222515e-03 1.99868671e-03] [ 1.33015354e-03 -1.12052005e-04 -2.44919347e-03] [ 1.83264990e-03 2.56505153e-03 -1.03147280e-04] [ 2.97465424e-04 -2.62401989e-03 1.55850972e-03] [-9.81326520e-04 -3.56737519e-04 5.67273543e-04] [-3.55974367e-03 -8.40607048e-04 8.63481263e-05] [-1.47214834e-04 4.18900538e-03 1.75136744e-04] [ 2.38951372e-03 3.81854552e-03 -1.10597137e-03] [ 2.80578812e-03 4.22196713e-04 7.08065524e-04] [ 1.17363097e-03 -6.79566029e-04 -1.29138559e-03] [-3.13595957e-03 -1.66364432e-03 -7.12636836e-04] [-9.28961387e-04 4.02343720e-04 1.52379656e-03] [-1.39408729e-03 1.92887365e-03 -4.58896713e-04] [-1.27120503e-03 -1.74080899e-03 7.21712427e-04] [-3.26820962e-03 2.08869867e-04 -4.32781683e-04] [-1.33776833e-03 1.78202432e-03 1.78191012e-03] [ 2.32916249e-03 2.93809949e-03 2.56733368e-05] [-6.83724762e-04 9.61669660e-04 -8.49227814e-04] [ 1.42212473e-03 -5.12656983e-05 1.74226837e-04]] Final stress: [-1.75796642e-04 -8.38617783e-05 -3.46599474e-05 -1.55756028e-03 -2.02575379e-05 -1.73981655e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-1.70108044e-03 -2.55456604e-03 5.04593464e-04] [ 2.90056345e-04 3.23608563e-03 8.73501775e-05] [-1.52459855e-03 3.96894522e-03 8.94412574e-04] [ 1.52877349e-03 4.47830823e-03 -1.03414177e-03] [ 8.38437277e-04 -2.31152828e-03 -3.51525626e-04] [-1.44238603e-04 3.19148685e-03 -6.23287377e-05] [ 6.68752747e-03 -3.15028387e-03 2.80840428e-03] [-7.33509215e-04 2.66599508e-03 -1.12987347e-04] [-9.61179428e-04 -1.90669242e-02 -2.31380433e-03] [ 3.49538193e-03 1.37459811e-02 -1.54388355e-03] [-8.61778356e-03 -1.19900821e-02 1.53472132e-04] [-5.23116845e-03 2.07107746e-02 1.52821189e-03] [ 1.90585236e-03 -5.07368294e-04 -2.58769499e-03] [ 9.18588509e-05 3.31241376e-03 9.43304061e-05] [-2.23798733e-03 -6.64387010e-04 2.61900436e-03] [-2.07575342e-03 -2.45015968e-03 -3.94994409e-04] [-4.84121089e-06 2.17920309e-03 -3.41525652e-04] [ 2.20681172e-03 -2.35028060e-03 6.90418975e-04] [-2.75546598e-03 -4.17806505e-04 -2.07281335e-03] [-1.01927182e-02 7.17856041e-03 -2.06337922e-04] [ 8.76103619e-03 4.91365273e-03 2.17132574e-03] [ 1.53980046e-02 -1.05551027e-02 -1.59996165e-05] [-4.30138783e-05 -1.30005388e-02 1.08611351e-04] [-4.77670750e-03 -5.27929037e-03 -2.07263053e-04] [-1.86086180e-03 -1.24470622e-04 -1.15630466e-03] [ 5.43838928e-04 -1.28307810e-03 2.25091571e-03] [-2.63441927e-03 3.40548746e-03 -1.57923242e-03] [ 2.38699454e-03 3.80099044e-03 1.83318644e-03] [ 1.64161633e-03 -4.55885980e-04 1.24310465e-03] [-1.28662859e-04 -1.61168203e-03 -2.82724227e-03] [-6.57948662e-04 -5.54706301e-04 -8.28499348e-04] [ 2.88005463e-03 5.89555520e-04 -1.14156310e-03] [ 4.07817497e-04 1.24713142e-04 2.37616623e-03] [-3.77054698e-04 1.90573785e-04 -2.22755740e-03] [ 8.07441478e-04 -2.20044377e-04 4.82936315e-04] [-3.21251054e-03 8.55458715e-04 1.15925484e-03]] Final stress: [-1.30973319e-03 1.10438989e-03 9.96299475e-06 -3.12932200e-06 1.92880021e-03 -4.12542702e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-4.67406158e-03 -8.08996450e-04 5.24349984e-04] [-7.17357522e-04 1.42254356e-03 -4.86790819e-04] [ 1.69443323e-03 1.88679472e-03 2.15752832e-04] [ 9.20736584e-04 -3.00668663e-04 1.27317869e-04] [-3.32422257e-04 1.18786382e-03 1.99724219e-04] [ 5.74096570e-03 6.82375581e-04 1.13675718e-03] [ 7.51867756e-03 9.15990977e-03 -1.45231858e-03] [ 1.33364142e-03 3.30360464e-03 -1.08932885e-03] [-3.47581931e-04 -1.57725844e-02 2.44773247e-03] [ 8.69077403e-03 -1.63732919e-02 -2.69834917e-04] [-1.79929303e-02 1.21592331e-03 -4.08517922e-04] [-4.86746269e-03 5.07742328e-03 -4.87110953e-04] [ 2.25317124e-03 -4.13058795e-03 -2.24117695e-03] [ 2.34158788e-03 1.06924742e-02 3.60133859e-04] [-6.37101990e-03 -7.98976754e-03 8.74178116e-04] [ 3.68643873e-03 -9.75644118e-03 5.32729687e-04] [-6.17287099e-03 4.67337540e-03 1.04294653e-03] [ 2.76586467e-03 2.41653371e-03 -1.57700669e-03] [ 8.03065394e-03 1.69264043e-03 9.52481627e-04] [-1.64133620e-02 -5.37202099e-03 8.38132420e-04] [ 3.29492483e-04 1.14837978e-02 -8.33419209e-04] [ 1.31606062e-02 7.95954772e-05 -2.08501914e-03] [ 8.60127134e-04 -5.93530892e-03 1.16489663e-03] [-5.94222060e-04 5.19538875e-03 1.16318460e-03] [ 5.29236128e-04 2.04080271e-03 -1.28455114e-03] [ 3.05159921e-03 -5.72856170e-04 -1.14137003e-03] [ 1.33611047e-03 -2.81617531e-03 1.10437088e-03] [-3.25109325e-03 -1.08018985e-03 -1.79818241e-03] [-1.30766576e-03 1.05708146e-03 1.90355253e-04] [-2.13830492e-03 -1.11120077e-03 1.07268804e-03] [ 2.32007822e-03 2.55393469e-03 3.88811470e-04] [-7.75900580e-04 6.31769194e-04 1.18263053e-04] [-2.31178034e-03 5.54190428e-04 3.75127481e-04] [ 1.64353291e-03 1.57663588e-03 -7.81588250e-04] [-1.49658895e-03 2.60884204e-03 -7.36917833e-04] [ 1.55689726e-03 8.26589153e-04 1.84319950e-03]] Final stress: [ 1.12033646e-03 -1.24150703e-03 -1.71014594e-06 -5.49844054e-06 -1.91224800e-03 -7.11726800e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-0.02280175 -0.02015576 0.00491871] [ 0.00682642 -0.00336181 0.00170085] [ 0.00460402 0.01595355 0.00309301] [-0.00589986 -0.01512665 0.00238262] [ 0.00330683 -0.00536284 -0.00025542] [ 0.02790895 0.01943387 0.00434463] [-0.07376942 -0.12844239 -0.0346247 ] [-0.02845834 0.05978634 0.01739432] [ 0.05822498 -0.11205056 0.02333586] [ 0.07670477 0.09847956 0.00513651] [ 0.03492782 -0.046 -0.02180955] [-0.05691679 0.07671862 -0.00275574] [ 0.0063467 -0.01981551 -0.02410199] [-0.02350478 0.0222513 -0.01329871] [-0.01780976 -0.00607295 -0.00440912] [-0.00300463 0.00850244 0.02226027] [ 0.02616729 -0.01958441 0.01041476] [ 0.00786804 0.0104679 0.00345244] [-0.0382998 0.06531857 -0.00897802] [ 0.00110124 -0.03193113 0.00520903] [ 0.07414433 0.08997252 -0.00277758] [ 0.01223723 -0.05257799 0.00498503] [-0.00791215 0.01337441 -0.00301986] [-0.05894267 -0.08269079 0.01154029] [-0.02128435 0.00236896 -0.0091765 ] [-0.00159024 0.01184835 -0.01800462] [ 0.02314125 -0.01264148 0.00670973] [-0.0445462 -0.00260155 -0.00353067] [ 0.00432198 0.00279754 -0.00369089] [ 0.02105764 0.00800107 0.0191006 ] [ 0.02704449 0.00525852 0.01034094] [ 0.00942221 0.00538585 0.00417628] [-0.02043603 0.01622434 0.00175945] [ 0.03389434 0.01196511 -0.00751569] [-0.004554 0.0116603 0.00287903] [-0.02951974 0.00264673 -0.0071853 ]] Final stress: [-0.00111859 -0.00092339 -0.00022496 0.0007509 0.00092747 0.00103647] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 2.73919816e-03 1.00216672e-03 -8.54109647e-04] [ 5.97522138e-03 -4.80032237e-03 1.29569920e-03] [-1.38786906e-03 -1.41274372e-02 -2.78891427e-03] [-3.40452835e-03 6.20421450e-03 -9.85188112e-04] [ 7.21546524e-03 6.46360872e-03 -3.77070678e-04] [-1.83706130e-02 -1.42133253e-03 -2.11064612e-03] [ 1.65478814e-02 1.78923996e-02 3.76865817e-03] [ 2.63826753e-03 4.39817503e-03 -1.85269832e-03] [-7.78243317e-03 8.79424172e-03 -7.36984439e-03] [-1.49763828e-02 -8.36765714e-03 -6.99233190e-03] [-1.78170429e-02 -5.55784535e-03 1.94198594e-02] [-4.05715953e-03 9.43704640e-03 -4.08747443e-03] [ 1.17607774e-02 5.49042895e-03 -1.15352864e-03] [ 1.27196875e-02 1.80300884e-02 6.55833829e-03] [-2.44263871e-02 -2.33644650e-02 -2.16190768e-03] [ 6.07117136e-03 -2.74369534e-03 7.09220770e-03] [ 2.20199685e-02 4.55689681e-02 -3.57874618e-03] [-2.69068674e-02 -4.24155280e-02 -5.17879035e-03] [ 2.76678440e-03 7.29848228e-03 -1.84575626e-03] [ 1.17859409e-02 -1.04267635e-02 -2.36115749e-03] [-2.24746509e-02 -2.23518578e-02 -1.19461129e-03] [-8.11235361e-03 -2.69096843e-03 3.10871903e-03] [ 7.89170000e-04 1.61855430e-02 2.29378518e-03] [ 1.51361909e-02 3.90732065e-03 -1.33259443e-03] [ 3.32372460e-03 -7.98685980e-03 6.10029863e-03] [ 1.05122216e-02 -8.86398062e-03 4.02026199e-04] [-2.10822478e-03 -3.14000767e-03 5.16196659e-03] [ 6.01942018e-03 7.39129927e-03 -8.60769747e-05] [ 7.54620451e-04 5.23527352e-03 -7.19474055e-03] [-1.55076803e-03 1.08757696e-02 -3.70003025e-03] [-4.32463640e-03 -5.67202014e-03 -1.60107282e-02] [-4.52717660e-03 5.33183480e-03 7.70687225e-03] [ 1.55076298e-02 -8.79699496e-04 -1.18206830e-03] [-9.65488654e-04 -6.58561731e-03 1.10656225e-02] [ 4.90868352e-03 -2.77760194e-03 -3.43735088e-03] [ 4.00055743e-03 -5.33320166e-03 3.86231222e-03]] Final stress: [-5.26470091e-04 1.89232971e-04 -5.01110258e-06 -6.56982844e-04 9.15723815e-04 -1.15901598e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 5.12191973e-03 -3.97875487e-03 4.73146356e-05] [ 1.03135173e-02 -5.54424943e-03 1.97481653e-03] [ 4.59081123e-03 -5.16350944e-03 -6.09610879e-04] [-1.52855840e-03 -3.68704224e-03 6.37798874e-04] [-4.71021953e-03 -2.95652705e-03 -3.08197877e-05] [-1.15821258e-02 -1.27221286e-02 -3.74452043e-03] [ 4.53285612e-03 -7.86887124e-04 4.09634092e-03] [ 3.18495911e-03 5.80282367e-03 3.48454970e-03] [ 4.26559870e-03 -5.06350464e-03 8.14750333e-04] [ 4.10982780e-03 1.03551663e-02 -1.21069822e-03] [-3.53171893e-03 -1.76624070e-03 -1.02002038e-02] [-6.32800633e-04 -4.03677033e-04 5.87488605e-03] [ 1.50336902e-02 2.56011905e-03 -4.40483473e-03] [-1.60586496e-03 3.40913747e-03 9.11862666e-04] [-1.46092148e-02 1.09612306e-03 -2.29119249e-03] [-1.64854982e-02 3.85324752e-03 7.31857524e-03] [ 1.53280489e-03 -9.85039808e-03 -1.83285540e-03] [ 1.34990454e-02 3.88362065e-03 2.58767160e-03] [ 4.66394364e-03 1.28277974e-02 -1.46478831e-03] [ 8.49771621e-03 -3.00679656e-05 3.30043786e-03] [-7.35051208e-03 -1.74835625e-03 3.92827382e-03] [-1.15743771e-04 -2.00269192e-03 -2.22512203e-03] [-7.78415318e-03 -1.37664255e-03 -2.23132129e-03] [ 5.01192831e-03 1.89553071e-03 -9.00080161e-04] [-1.04824839e-04 4.89177720e-03 -1.43669889e-03] [-5.74016858e-03 -7.01719174e-03 -5.81278257e-03] [-7.83761359e-04 6.50073119e-06 -1.10636015e-02] [-1.07533560e-02 5.11152497e-03 -5.96078392e-03] [-3.94162484e-03 -2.75939606e-03 -3.36664713e-04] [ 8.90645906e-03 -1.72587008e-03 -6.03452826e-06] [-2.04935117e-03 1.99463275e-03 7.66271851e-03] [-3.10259283e-03 7.58334804e-03 1.85352608e-03] [ 2.23239382e-03 6.31638895e-03 3.33358339e-03] [ 3.20499832e-03 -6.77865115e-03 4.63978319e-03] [ 1.28989511e-03 4.59101329e-03 4.71708553e-03] [-3.58027503e-03 -8.16964925e-04 -1.42136132e-03]] Final stress: [ 6.47696714e-04 -9.22166467e-04 -6.75873754e-05 6.48433308e-04 -9.72404786e-04 1.27269288e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-5.06195897e-03 -4.35091616e-03 1.14856774e-03] [-1.25094959e-02 7.88262789e-03 -3.52761630e-03] [-7.97128529e-04 8.36009807e-03 8.40922165e-04] [ 2.02987041e-03 3.92534005e-03 -1.26759437e-04] [-2.50334657e-03 5.03508098e-04 3.16674041e-05] [ 1.50725042e-02 9.71016175e-03 3.65296800e-03] [-2.26183410e-03 2.42543819e-04 -1.94994095e-03] [-2.25793866e-02 2.12946184e-03 -4.11591578e-04] [-4.98477344e-03 -1.08784539e-03 4.35117041e-03] [ 9.13243185e-03 8.87467708e-03 -7.66227660e-04] [ 9.43477364e-03 -4.37716709e-03 -1.10596283e-04] [ 3.10914887e-03 5.49186068e-03 -1.82490501e-03] [-1.45610649e-04 -2.09445746e-04 -4.65157972e-03] [ 1.46856654e-04 6.47006613e-03 1.57209597e-03] [-5.29476557e-03 1.49762902e-03 5.69798786e-03] [ 1.45505129e-04 -5.43093858e-03 3.09698364e-03] [ 2.55254985e-04 -9.56829429e-03 -4.55118729e-04] [ 6.53647894e-03 -2.90444114e-03 -6.09574213e-03] [ 1.92771674e-02 1.86327724e-03 2.43449794e-03] [-4.23324986e-03 -1.36033135e-02 1.32603246e-02] [ 1.27555954e-02 4.89251196e-03 -4.00638711e-04] [-1.46771700e-02 -7.60073119e-03 -3.26626617e-03] [ 4.22101059e-04 1.10369775e-02 -1.18902638e-02] [-8.62677089e-03 -1.34467524e-02 1.38943189e-03] [ 1.39893024e-02 5.84372607e-04 -2.46846908e-03] [-9.20465711e-04 -4.61302141e-03 -5.42773428e-03] [-2.55692344e-03 -1.63130546e-02 -1.01285506e-02] [ 5.62361768e-03 -5.47019820e-03 -4.01281706e-03] [-7.89043576e-03 -5.35570366e-03 5.65948392e-04] [-2.02953700e-03 3.79724130e-03 8.29234938e-03] [-1.17810511e-02 -1.75893501e-03 2.63832454e-03] [ 5.14542511e-03 1.42233276e-03 4.88881827e-03] [ 4.77668553e-04 1.58162292e-02 9.45833953e-03] [-2.82352866e-03 5.72352385e-03 2.55124384e-03] [ 8.93345996e-03 4.82594961e-03 -1.45127892e-03] [-8.09729506e-04 -8.95963194e-03 -6.90554517e-03]] Final stress: [ 0.0008646 -0.00092795 0.00013186 -0.00048389 -0.0009479 -0.00126691] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[-0.01864094 -0.01420486 0.00484474] [-0.00892494 0.00485876 -0.00089838] [ 0.00465949 -0.00134131 -0.000222 ] [ 0.00252034 0.01712976 -0.003536 ] [-0.00764023 0.00419402 0.00076889] [ 0.00364317 -0.00281517 0.00032713] [ 0.03593219 0.0213619 -0.00575288] [ 0.06880232 0.02540325 0.00779532] [-0.02285815 -0.0299907 -0.00464228] [-0.00385103 0.00143105 0.00458944] [ 0.07059149 0.00122365 -0.01122969] [ 0.02092723 -0.03456743 0.00832988] [ 0.00639738 -0.03915674 -0.00340822] [-0.02316309 0.02135943 0.0056711 ] [ 0.02435873 0.00662977 -0.00083578] [-0.02647773 0.04249842 0.00508222] [ 0.0305039 -0.01456838 -0.00346264] [-0.00752774 -0.0122362 -0.00351956] [-0.02127949 0.02019302 0.00602987] [-0.00319874 -0.01243725 0.01306453] [-0.06189669 -0.01792858 -0.0134415 ] [-0.07364019 0.02550211 -0.00777518] [ 0.00128724 0.01791081 -0.00364739] [-0.01728372 -0.00670161 0.00531095] [-0.00323455 -0.00022662 -0.00080087] [-0.0037633 -0.00886703 0.00463743] [ 0.0016907 -0.00687498 -0.00912599] [ 0.00278918 0.00468358 0.00643685] [-0.00076401 0.0006158 0.00144273] [ 0.00482916 -0.00697007 -0.00416902] [ 0.00697795 -0.00364342 0.00539512] [ 0.00894569 -0.00351374 -0.00326081] [ 0.00553692 0.00357892 0.00548667] [-0.00661643 -0.00221861 -0.00830482] [ 0.0088284 -0.00389026 -0.00368807] [ 0.0015395 0.00357871 0.00650824]] Final stress: [ 8.12737042e-05 -4.91522620e-05 -4.42807441e-05 1.29929415e-03 1.62216556e-04 2.18645948e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 7.38200568e-03 4.47452925e-03 -8.74754585e-04] [-1.63910954e-03 -5.98964264e-03 3.70988235e-04] [-8.62679339e-03 1.68157801e-02 3.33540785e-03] [-7.34394203e-03 -1.48674877e-03 2.61267411e-04] [ 1.57927110e-02 -1.66692012e-02 -4.39494985e-03] [ 6.18154194e-03 6.48305691e-03 7.74859878e-04] [ 8.57140093e-03 6.69901217e-03 -3.79009298e-03] [ 6.01669279e-02 -5.55619983e-03 4.69623480e-04] [ 2.04439207e-02 -2.39711089e-02 4.65473829e-03] [ 7.05756070e-03 8.73433707e-03 1.59890469e-03] [-6.49390947e-03 2.88962796e-03 2.83220573e-03] [-1.07828470e-03 -6.82277698e-03 -5.55886702e-03] [-1.25476954e-02 -4.25623792e-03 1.15003269e-02] [ 3.51891392e-03 1.52042692e-03 -1.45185074e-04] [ 1.06897343e-03 -8.05827753e-03 -5.39784422e-04] [ 1.47909040e-02 -7.42368138e-03 -5.81528035e-03] [-5.30023435e-04 2.47837064e-02 -6.24480982e-03] [-5.84725411e-03 -9.07040772e-03 1.85452963e-03] [-3.04739156e-02 5.13236722e-03 1.91691623e-02] [-1.44838612e-02 1.79452433e-02 -1.19325019e-02] [-3.69557668e-02 -1.34310918e-02 5.83912913e-03] [-2.10032592e-04 1.30897632e-02 -1.84027941e-03] [ 3.50405187e-03 -1.18770472e-02 -7.27760899e-03] [ 1.04098716e-02 1.06359579e-02 -5.40400796e-03] [-5.14548938e-03 7.18222052e-03 -3.21029509e-03] [-1.09273483e-02 1.88285442e-03 -2.91790388e-03] [ 6.92541310e-03 -7.29485976e-03 -2.57293029e-03] [ 5.82228389e-03 -3.92354414e-03 1.11196844e-02] [ 4.58816038e-03 6.78841335e-05 -8.18566742e-03] [-3.79491522e-03 -4.97992419e-03 -2.66972459e-04] [-1.08854933e-02 -7.44167824e-03 4.76991359e-03] [ 2.71385454e-03 8.62456377e-03 -7.37112963e-03] [-1.16736744e-02 6.98652633e-03 9.14372035e-03] [-1.57483498e-03 -7.12215982e-03 -5.15787577e-04] [-2.21810848e-03 1.40047229e-03 1.19793058e-03] [-6.48804327e-03 2.62581983e-05 -3.35837239e-05]] Final stress: [-1.55751918e-04 2.31203555e-05 -8.27176188e-05 -1.25656351e-03 1.15052670e-04 -2.38045810e-03] Minimization converged after 43 steps. Minimization converged after 49 steps. Minimization converged after 18 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 18 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 3.44083214e-02 4.88115082e-03 -3.43441828e-03] [ 2.57996474e-02 5.61364546e-02 1.63249194e-04] [ 3.46387504e-02 7.97964204e-02 1.27774354e-02] [ 6.59554147e-02 -1.76360672e-02 3.16786406e-03] [ 7.14580519e-02 -2.01344683e-02 -1.17464075e-02] [ 1.39976004e-02 2.78843384e-02 3.47391006e-03] [ 4.16773571e-03 8.94480696e-02 -8.14431407e-04] [-1.81492153e-02 -5.54084757e-02 -3.84004036e-03] [-8.56219567e-02 1.32598027e-01 -7.82344054e-03] [ 9.28342980e-02 -6.15762860e-04 8.41739460e-03] [-9.70224224e-02 5.05310318e-02 -1.80514368e-03] [-7.22895453e-02 1.72434512e-02 4.87039497e-03] [ 2.03362196e-02 -4.08455874e-03 -2.10089235e-02] [-3.24543721e-02 -4.54031700e-03 5.72603166e-02] [-1.13166562e-02 4.22806109e-02 2.02149277e-02] [-2.88004294e-03 -1.89230834e-02 -3.52993106e-02] [ 2.56832065e-02 3.23959349e-02 -4.04402369e-06] [ 8.62776171e-03 -4.07779625e-02 -1.88110129e-02] [ 1.61031989e-01 -1.23342911e-01 2.48135656e-03] [-3.01101346e-02 -1.42568512e-02 2.83780902e-02] [-8.89803509e-02 -3.13374141e-02 -3.32984605e-02] [-6.83993887e-02 1.21862813e-02 -4.40401939e-02] [ 2.35183674e-03 -1.22823762e-01 1.56915183e-02] [ 3.73551506e-02 -4.20898221e-02 3.19163479e-02] [ 2.12362119e-02 3.76101702e-03 1.31400619e-02] [-6.69996839e-02 -3.24344108e-02 -4.46277385e-03] [-5.58136413e-03 1.53592431e-02 -2.88474879e-02] [-1.10771402e-03 -3.09709799e-02 -7.78616293e-03] [ 2.42565627e-02 -1.85998102e-02 3.05603158e-03] [ 6.11308601e-03 -1.17794889e-02 -1.24520052e-02] [-2.93573414e-02 2.32202297e-03 -1.57157991e-02] [ 2.03616728e-02 2.49953078e-02 4.99870675e-02] [-7.02694108e-03 5.65474602e-03 -7.44275417e-03] [-2.54453867e-02 -1.33830652e-03 -4.07590579e-02] [-9.94949345e-03 -7.11292219e-03 2.96496588e-02] [-1.79215072e-02 7.33267339e-04 1.47462428e-02]] Final stress: [ 0.00033508 -0.00024811 -0.00018709 0.00050244 0.00075231 -0.00083918] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-3.44962613e-03 -1.67493135e-03 5.59374868e-04] [ 2.43849483e-03 -1.30110593e-03 4.43402567e-04] [-1.63417155e-04 7.73576597e-03 1.26971022e-03] [-1.13504697e-04 -3.62146939e-03 5.63680002e-04] [-3.64102708e-03 1.88534004e-03 6.95655981e-04] [ 6.35187175e-03 3.93759077e-03 1.09527341e-03] [-1.70914748e-03 -8.45344220e-04 2.75737453e-03] [ 4.42677660e-03 -4.47285001e-04 6.50958734e-04] [ 3.37589654e-03 -3.09797800e-03 2.70576712e-03] [-6.50936634e-03 -1.03284022e-02 -3.72972862e-03] [ 1.46873376e-03 -9.09688872e-04 -1.87207453e-03] [-8.91170580e-04 -1.26298956e-03 -3.85508446e-03] [-4.34669961e-03 1.60599746e-05 -1.84653863e-03] [-1.49213049e-03 -4.10270277e-03 -2.83240222e-03] [ 1.38069108e-03 -1.14963579e-03 1.14932242e-03] [ 2.26634391e-03 -1.59304860e-03 1.19499703e-03] [ 5.35710694e-03 6.14447425e-03 1.96203642e-03] [-3.34296003e-03 -7.91460241e-04 -1.33195264e-03] [ 2.76262185e-03 -2.84868277e-03 -8.19335329e-04] [ 1.23637457e-03 1.31608722e-02 -3.57061489e-04] [-2.18422244e-03 -1.46326663e-05 1.38995905e-03] [ 5.85326900e-04 -7.24103982e-04 1.45913932e-03] [ 1.14081764e-03 4.39850796e-03 4.22980275e-04] [-2.51890205e-03 1.76161963e-04 -2.19082008e-04] [-1.15179174e-03 6.26602467e-04 -1.46064063e-03] [ 1.05156244e-03 1.03471750e-04 -7.24182449e-04] [-2.77066085e-03 5.60275110e-05 2.52907618e-03] [ 2.38372240e-03 -1.11873667e-03 -1.43131476e-03] [ 8.40818580e-04 1.30264190e-03 -3.29142448e-05] [ 1.00687897e-03 -2.04235893e-03 1.48133360e-04] [ 2.11493237e-03 -1.44387590e-03 1.11248661e-03] [-1.77982676e-03 9.69688534e-04 6.50131111e-04] [ 9.73067937e-04 -1.15263436e-03 -2.86891739e-03] [-3.63818269e-03 1.47394502e-03 1.63750796e-03] [ 5.78408991e-05 -1.15283794e-03 5.65362458e-05] [-1.51724383e-03 -3.63245270e-04 -1.07227402e-03]] Final stress: [-0.00179017 -0.00098734 -0.00019588 -0.00059316 0.00014451 -0.00045214] Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 4.31758449e-03 1.71136018e-03 -8.54141493e-04] [ 4.93033754e-04 -1.87058304e-03 1.60596915e-04] [ 2.32569096e-03 8.86363438e-04 -1.18577345e-04] [ 6.48179104e-04 -4.51455415e-03 8.09722652e-04] [ 1.79944812e-03 5.18696043e-04 -1.03236649e-04] [ 3.78700811e-04 -2.45797163e-03 8.83838610e-05] [-3.63710357e-03 -2.55455476e-03 1.41371250e-03] [-2.01168467e-03 -1.78449499e-04 -2.79423574e-03] [-2.15166030e-03 -4.93180151e-05 7.85013541e-04] [-1.83884371e-03 2.79906304e-03 -1.40013471e-03] [-1.62893733e-03 1.53940686e-03 1.67838843e-03] [ 1.29192386e-03 -2.68718233e-04 3.68148996e-04] [-2.09257430e-04 -8.09490127e-03 6.67739161e-04] [-3.02857963e-03 5.80652830e-03 1.36212700e-03] [ 2.37400691e-03 -3.94003062e-03 -2.72513808e-03] [-1.82758402e-03 -4.89427149e-03 1.07818084e-04] [-2.86349811e-03 8.38434583e-03 1.01959137e-03] [ 7.00028881e-03 1.99685121e-03 -4.08622987e-04] [ 5.58584531e-03 -5.03733802e-03 1.74357727e-04] [-1.40455369e-03 5.38331836e-03 7.99175264e-04] [-5.42086951e-03 -9.08059310e-04 -2.48654320e-03] [ 4.93644940e-03 1.70285224e-04 -1.42507165e-04] [-2.40685235e-03 7.47464336e-03 1.95820437e-03] [-5.24450340e-03 -1.66582892e-04 -3.11050470e-04] [ 7.83056127e-04 1.75724134e-04 2.14690858e-03] [ 2.87966206e-04 6.42842712e-04 -2.99098111e-04] [ 8.06163714e-04 -1.85505566e-03 -2.43044419e-03] [-1.31662043e-03 -2.43413167e-03 -1.35728045e-03] [-7.90580292e-04 7.41523017e-04 3.70578107e-03] [ 1.47260071e-03 6.87957313e-04 -2.21129209e-04] [ 9.58712126e-04 1.57786978e-03 1.11468831e-03] [-4.68406679e-04 6.24980021e-04 -1.12310882e-03] [ 4.08643323e-04 -2.64137289e-04 -2.69774752e-04] [-1.60883278e-04 2.88839511e-05 -1.25291262e-03] [-3.25278383e-04 -1.56315444e-03 -2.28383963e-03] [ 8.67403063e-04 -9.88308251e-05 2.22141780e-03]] Final stress: [-0.0017615 -0.00099266 -0.00019645 0.00037732 0.00020604 0.00074693] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[-2.75361088e-04 -1.02542468e-03 7.00935822e-05] [-4.39907072e-04 4.26082740e-04 -2.19729624e-05] [-3.51581443e-04 -4.80581846e-03 -9.17117143e-04] [ 1.33670341e-04 1.80151395e-03 -3.08846352e-04] [-3.43552961e-03 1.56259453e-03 7.68776299e-04] [-2.46480292e-03 -6.85299018e-04 -3.04326445e-04] [ 3.83778452e-03 4.38335364e-03 4.52457520e-04] [ 3.97982951e-03 -1.75475427e-03 1.62668084e-04] [-1.19412300e-03 2.63370025e-04 -1.79031744e-03] [ 2.76198078e-03 5.50129009e-03 4.28241657e-04] [ 1.93328251e-03 1.18111857e-04 -3.48939314e-04] [-2.00548090e-03 4.30023012e-03 1.79271645e-03] [-2.27548591e-03 -1.91325942e-03 1.28261441e-03] [ 2.31954560e-03 -7.44415462e-04 -3.11344540e-04] [ 2.99796790e-03 -3.18082813e-03 9.35180929e-04] [ 3.01961602e-03 9.06180371e-04 -9.77557660e-04] [-6.47352433e-04 6.63973402e-03 4.04088962e-04] [-2.35549978e-03 -1.49968194e-04 -9.28344154e-04] [-4.58270461e-03 -1.03695790e-02 -8.30180812e-05] [-2.87319290e-03 7.80571602e-03 1.13500762e-03] [ 4.85672712e-03 -7.85515198e-03 -1.91444673e-03] [-4.23026389e-03 -6.91334094e-03 -9.40100559e-04] [-2.28323019e-03 9.82949051e-03 -7.59939261e-04] [ 2.84656917e-03 -4.11820639e-03 2.08049822e-03] [-2.11867554e-05 -3.75388448e-04 8.91960135e-04] [-4.30933729e-05 -3.11144923e-04 1.48774512e-03] [-6.28561330e-04 2.26691102e-03 1.37657681e-03] [-1.09560534e-04 -8.73640568e-04 2.23095241e-03] [ 7.30368048e-04 -1.09077878e-03 -1.94121471e-04] [-2.03067941e-03 -1.84764924e-04 -1.89262921e-03] [ 1.43410660e-03 -6.22337283e-04 3.53665620e-05] [ 8.66002554e-05 -3.20431553e-04 -1.16515026e-03] [-1.10950142e-04 -8.52958397e-04 -1.55961804e-03] [ 3.60762422e-04 8.58309003e-04 -1.92245523e-03] [-7.10838925e-04 -3.33087955e-04 -2.40814707e-04] [ 1.77057542e-03 1.81769087e-03 1.04611478e-03]] Final stress: [-0.00181475 -0.0010271 -0.0002115 -0.00038654 0.00022096 -0.00075715] Minimization converged after 43 steps. Minimization converged after 49 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.19808699e-03 -4.02572721e-04 1.64460096e-04] [ 1.47509780e-03 -1.04689083e-03 3.14752801e-04] [-3.83292770e-05 1.53793052e-03 2.21673359e-04] [ 3.19264649e-04 -2.19419982e-03 3.01008340e-04] [-9.20826005e-04 1.00670610e-03 2.29258550e-04] [ 7.69186960e-04 9.44254908e-04 1.96608522e-04] [-8.65574243e-04 3.36608338e-03 2.27950310e-05] [-1.01277783e-03 -3.08334108e-03 -2.73311072e-04] [ 3.00504948e-03 2.04040903e-03 -2.11475765e-03] [-1.98748766e-03 4.03900600e-03 -6.58535378e-05] [-2.82365595e-03 -2.97375730e-03 6.48471445e-04] [ 1.21175321e-03 1.11312835e-03 7.05735029e-04] [-1.17011174e-03 -1.88093279e-03 2.00081211e-03] [-2.11447192e-03 -1.96128150e-03 -4.87555313e-04] [ 3.47589104e-03 3.55663523e-03 -8.57286527e-04] [ 2.53873622e-03 1.83229554e-04 -2.52445062e-03] [ 1.28922675e-03 2.23024873e-03 4.57730283e-04] [-3.95162735e-03 -1.98034769e-03 4.75016721e-04] [ 8.22985360e-04 1.11032816e-03 7.00009846e-04] [-2.32590839e-03 -2.62074326e-03 2.70844455e-05] [-8.47951077e-04 1.12208607e-03 -1.17913270e-03] [ 4.56387939e-03 -2.96773074e-03 -1.15266648e-03] [ 6.77574965e-04 3.99790634e-03 4.85266461e-04] [-2.42636628e-03 -4.90748132e-03 1.52162008e-03] [ 4.29853439e-04 -3.01359034e-04 -1.74201317e-04] [-4.91374103e-04 -2.89088396e-05 1.66864406e-04] [ 3.15234237e-04 -1.77173081e-04 1.04035072e-03] [ 4.02193234e-04 7.55268532e-04 -1.62224679e-04] [ 6.76105313e-04 3.49581740e-04 -4.96900629e-04] [ 5.11641516e-04 -9.53356261e-04 -1.46972032e-06] [ 1.95189948e-04 -1.14624601e-04 -1.00495259e-04] [ 3.10029311e-04 2.42714674e-04 3.81864794e-04] [-4.32785068e-04 -3.42881650e-04 -1.14496768e-03] [-3.17426644e-04 6.45755306e-06 9.74036998e-04] [ 8.34946051e-05 -1.07146488e-05 2.53942094e-05] [-1.47626890e-04 3.46322306e-04 -3.25541052e-04]] Final stress: [-0.00106584 -0.00183927 -0.00020333 -0.00059692 -0.0001854 -0.00041524] Minimization converged after 50 steps. Minimization converged after 43 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-2.09540794e-03 -8.31376499e-04 3.46745690e-04] [-7.14609669e-05 2.46090636e-03 -1.83457842e-04] [-1.01049432e-03 7.42851652e-04 1.69737574e-04] [-4.12337620e-04 -3.43016994e-03 5.83326864e-04] [ 4.38967764e-03 3.94279869e-04 -5.07581433e-04] [ 9.97500063e-04 3.93392201e-04 1.21622673e-04] [-1.52240602e-03 -3.06633503e-03 -4.32544043e-04] [ 2.46077475e-03 -1.04040854e-03 -1.40473924e-03] [ 1.32110577e-04 -5.13751658e-04 -3.56706745e-04] [ 2.54799250e-03 5.36346145e-03 -7.31547049e-04] [-6.44840085e-03 2.37137431e-03 1.02949250e-03] [ 2.64495333e-03 -1.46600959e-03 1.89079472e-04] [-1.01148564e-03 -1.11832081e-03 -5.84064732e-04] [-9.18058737e-04 2.01124268e-03 3.62491548e-04] [ 1.67297910e-04 -2.69855681e-04 1.25361063e-04] [ 7.03120192e-04 1.29509629e-03 -7.04065194e-05] [ 6.76195048e-04 -1.65575141e-03 -1.84094864e-04] [-6.61889482e-04 9.17237019e-04 4.26782883e-04] [-2.14210880e-03 1.28941066e-03 2.64444314e-04] [-3.62667682e-04 5.37854787e-04 1.64321905e-03] [ 3.22892816e-03 2.66548613e-03 3.59190435e-04] [ 2.98294889e-03 -7.74332686e-05 -9.78087689e-04] [-2.93172426e-03 -6.02330480e-04 -1.01783620e-04] [-2.23188787e-03 -4.37573811e-03 1.08974778e-04] [-4.89804492e-03 -1.14523386e-03 -1.33028159e-03] [-1.25303241e-03 5.61583779e-04 -1.31855467e-03] [-1.92208876e-03 -1.86749660e-03 -2.53736569e-04] [ 2.69287284e-03 1.47454612e-03 1.41451395e-03] [ 1.45114341e-03 1.47574508e-03 2.33750207e-04] [ 2.59097120e-03 1.98793864e-03 3.46453347e-04] [ 3.67656957e-03 -3.81338094e-04 1.16252655e-03] [ 2.57309832e-03 -7.67136436e-04 1.21247049e-03] [ 1.77632387e-03 2.28731619e-03 3.94737003e-04] [-3.46606548e-03 -2.64772650e-03 -2.59245005e-03] [-1.58249854e-03 -1.51638531e-03 6.61435566e-04] [-7.50418001e-04 -1.45692540e-03 -1.26319311e-04]] Final stress: [0.00072071 0.00143271 0.00013504 0.00037949 0.00019296 0.00068636] Minimization converged after 56 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[ 2.06393129e-03 1.24183243e-03 -6.28258352e-04] [ 9.48418828e-04 -3.11526437e-04 1.40825262e-04] [-7.17580195e-04 2.02335313e-03 2.72807879e-04] [ 5.77332859e-05 -8.16060783e-03 1.41695176e-03] [ 3.91284231e-03 -2.20504505e-03 -3.88829687e-04] [-1.99468721e-03 -4.12213677e-05 -3.29031167e-04] [ 2.77157779e-03 4.74608456e-03 2.77389040e-03] [ 5.70656929e-04 6.35145634e-04 3.72639986e-05] [-8.66524889e-04 -4.30117054e-03 -2.83376049e-03] [ 1.09462978e-03 4.59091574e-03 -3.11102735e-03] [-1.75371642e-03 7.24189957e-04 1.00076513e-03] [ 2.16563851e-04 1.68256271e-03 3.14814253e-03] [-1.89715712e-02 6.35970963e-03 -2.66603942e-04] [-3.80546783e-04 -1.16872877e-04 -1.02725470e-03] [ 1.66978517e-02 3.37096910e-03 -3.66804498e-03] [ 3.99301231e-03 -6.36159405e-03 1.72909630e-04] [-5.94405036e-04 5.83556116e-04 1.49890215e-03] [-2.23307794e-03 -1.36382463e-03 3.91439649e-03] [-1.53610453e-03 5.26522164e-04 -1.69786633e-03] [-1.18130131e-03 5.28091383e-04 -2.61756754e-03] [-2.96618827e-03 -7.58385119e-04 -4.27639404e-03] [ 1.94817028e-03 6.53482434e-04 1.69656277e-03] [-1.51560781e-03 -3.49668192e-03 3.13746864e-03] [ 1.09711466e-03 -3.09948376e-03 4.12402742e-03] [-2.92458618e-04 -2.43196151e-03 1.30686493e-03] [ 3.80820398e-03 1.77042362e-03 -6.85605297e-05] [-2.89411997e-03 4.52006874e-03 2.10499289e-03] [-4.47966050e-03 -7.07696833e-05 -1.16149155e-03] [-1.88477680e-03 6.69466791e-06 4.41476975e-04] [ 1.20041330e-03 1.25475665e-03 1.06416482e-03] [-4.60292176e-04 2.97719292e-03 -1.46321078e-03] [-3.71947856e-03 2.72438360e-04 -1.18286299e-03] [ 3.30338393e-03 -5.05011859e-03 -1.46459071e-03] [ 4.16070366e-03 3.96753465e-04 -1.92234678e-04] [ 1.37705478e-03 1.33171892e-04 -8.60911376e-04] [-7.80164466e-04 -1.22865194e-03 -1.01391249e-03]] Final stress: [1.13754587e-04 1.07083708e-04 2.77118983e-03 6.01036921e-04 9.77532097e-06 4.11052144e-04] Minimization converged after 57 steps. Minimization converged after 50 steps. Minimization converged after 54 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.21108772e-04 1.35290460e-03 -1.70380746e-04] [ 3.81980580e-03 -1.31535480e-03 5.79692788e-04] [ 5.47403772e-04 -1.89675151e-03 -2.52818576e-04] [ 1.70906704e-04 -1.57084171e-03 2.30430936e-04] [ 1.09737660e-04 1.74954085e-03 1.66588984e-04] [-4.66687592e-03 -2.43149155e-03 -8.54114836e-04] [ 1.84862225e-03 1.82362550e-03 4.55757451e-04] [-4.09602777e-03 -1.12037203e-03 -8.26910497e-04] [ 7.11491667e-04 -3.08287874e-03 3.58145609e-04] [ 2.00609854e-03 2.77899259e-03 -6.28105149e-04] [-5.47580861e-04 -1.85054803e-03 9.50759827e-04] [ 5.93346054e-04 -3.76105839e-03 1.53621163e-04] [ 2.44190031e-03 1.50040725e-03 -5.01340677e-04] [ 8.57790103e-04 -2.07022624e-03 4.21684176e-04] [-1.30600462e-04 2.63200281e-03 1.83554689e-03] [ 3.83076470e-04 -5.80260387e-04 -1.39638222e-03] [-1.02866685e-03 1.46754100e-03 2.36089648e-04] [-2.51172189e-03 -1.65860178e-03 -3.69327726e-04] [ 1.28220145e-03 2.42896998e-03 -2.78925912e-04] [-2.17549241e-03 -1.15402747e-03 1.14256568e-03] [-5.45924286e-06 -8.50702902e-04 4.83866681e-04] [ 1.06098134e-03 -1.62883928e-04 -1.61746853e-03] [-2.41205196e-03 6.02743625e-04 -5.93554844e-04] [ 3.72960675e-04 1.78583914e-04 8.90085340e-04] [-7.64466034e-04 -2.04777882e-03 5.32126911e-03] [-2.42214004e-03 2.67737010e-03 -2.92032325e-04] [ 2.07606631e-03 -1.06473061e-03 -1.55589410e-04] [ 2.51989071e-03 2.46127204e-04 -6.81473575e-04] [-8.51359925e-05 -1.30478223e-03 -3.83350042e-03] [ 3.78214705e-03 -6.46925974e-04 1.08943808e-04] [ 1.36492343e-03 2.58000439e-03 -6.49873235e-03] [ 2.54342950e-03 -9.73428545e-04 5.11049182e-04] [-1.84229312e-03 2.54243773e-03 8.65377657e-04] [-2.14334127e-03 1.05648398e-03 -7.04883395e-04] [-2.77413626e-04 1.71746992e-03 4.81074769e-03] [-3.26240358e-03 2.20844022e-03 1.33318582e-04]] Final stress: [1.46430044e-04 2.79503313e-05 2.75143176e-03 3.76658384e-04 3.91015405e-05 7.39669507e-04] Minimization converged after 55 steps. Minimization converged after 54 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-7.95134605e-04 2.87355583e-03 -1.95440165e-04] [ 4.51121612e-03 -2.86525259e-03 8.20764605e-04] [ 5.69856766e-04 -1.22774346e-03 -1.04491511e-04] [-3.96761908e-03 -2.22301277e-03 2.96681183e-04] [ 1.07667422e-03 3.59140553e-03 1.91923848e-04] [-4.85926134e-03 9.61790857e-04 -4.86851771e-04] [ 2.78418385e-03 -8.37304091e-04 -2.12014643e-03] [ 4.94784948e-03 3.17067676e-03 -1.52031664e-03] [ 1.12621323e-02 1.14493415e-03 1.10119506e-03] [-3.78588708e-03 -3.42676661e-03 -5.05338858e-03] [-7.50693041e-03 -3.75875566e-03 5.34670405e-03] [ 5.44000563e-03 4.26769466e-03 1.50144360e-03] [ 7.85318707e-03 7.88110088e-04 -2.33680232e-03] [ 1.97618845e-03 5.12716476e-03 -9.64739823e-04] [-8.21403073e-03 3.66559863e-05 4.12680462e-03] [-1.47980647e-03 1.93196905e-03 -2.76417090e-03] [ 1.97603246e-03 -7.14656507e-04 9.42810900e-04] [-1.15722439e-03 -3.27354996e-03 3.96132464e-04] [-6.88961688e-03 -3.54956399e-03 -9.36848468e-04] [-4.30917492e-03 -4.51746175e-04 -9.42834074e-04] [-6.42438960e-03 -6.58222816e-03 -1.72510099e-03] [ 3.50120429e-03 -4.55363791e-03 -1.66900924e-03] [-6.03820516e-03 -3.28155957e-03 8.11498372e-04] [ 3.72189673e-03 5.22576185e-03 4.66762593e-03] [-1.06094780e-03 7.95321200e-04 -9.48298853e-04] [ 6.75083267e-04 2.10533223e-03 -1.15082888e-03] [ 1.93507467e-03 1.58120395e-03 5.28839132e-03] [-2.99198364e-03 -2.38344941e-03 -1.61252657e-04] [-1.43776990e-03 4.76836693e-03 3.00447728e-03] [ 9.89658853e-04 -1.42711111e-03 1.50166535e-03] [ 2.10120751e-03 -2.92099523e-03 -3.63830445e-03] [ 2.31698274e-03 -7.11547136e-04 -2.02661115e-03] [ 7.61078431e-04 -7.01136575e-04 1.44394878e-03] [ 2.27212473e-03 5.81125102e-03 -2.00026512e-03] [ 2.02928154e-03 -3.88640456e-03 -3.34091752e-03] [-1.78293712e-03 4.59522663e-03 2.64455217e-03]] Final stress: [-1.91385524e-04 -2.42612043e-04 -2.82393631e-03 -4.00122793e-04 8.92980718e-06 -7.00388915e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 62 steps. Final forces: [[-3.29700690e-03 -1.51286405e-03 5.07980411e-04] [ 1.04158642e-03 3.15203551e-04 2.29405989e-04] [ 3.59520415e-04 -3.07211292e-04 9.06204727e-06] [ 4.74116825e-04 -3.16854276e-03 5.52459825e-04] [ 3.11801037e-03 -7.09319529e-04 -2.21612321e-04] [ 2.62936311e-03 1.13481545e-03 3.61208329e-04] [-5.32736401e-03 -7.19026814e-03 -7.61333695e-04] [-2.52324802e-03 7.24229686e-05 -4.89544441e-04] [-3.41784415e-03 3.81076668e-03 1.09568124e-03] [ 5.29637313e-06 2.12221357e-03 6.15011820e-05] [ 6.73683317e-03 -4.18967176e-03 2.00171237e-05] [-4.23346823e-04 2.71618632e-03 -1.53788625e-03] [ 3.17478453e-03 -1.66266499e-03 -3.02408234e-04] [ 1.21896989e-03 -2.35619371e-03 1.78968551e-03] [-2.46568515e-03 3.44495098e-04 1.81287390e-03] [ 8.43057891e-04 2.15883736e-03 -9.20548916e-04] [-8.04811184e-04 2.28078211e-03 -1.46846249e-03] [-2.54376687e-03 5.28747342e-04 -1.61315053e-03] [ 1.21880801e-03 -5.75734452e-04 2.74977200e-04] [ 2.51467286e-03 3.37007224e-03 2.25141672e-03] [ 3.82148726e-03 2.67706292e-03 3.85650415e-03] [-4.55094380e-03 -2.13028818e-03 -1.53351668e-03] [ 1.94395170e-03 -2.16637765e-04 -1.83623977e-03] [-1.81723824e-03 -1.11725473e-03 -2.76562104e-03] [-6.38740710e-04 3.88345559e-04 -7.08533712e-04] [-3.85006097e-03 1.20749995e-04 -1.05957821e-03] [ 1.59737122e-03 -3.58173570e-03 -9.83398027e-04] [ 3.08128239e-03 2.16919061e-03 9.12358026e-04] [ 3.31260400e-04 -1.07409667e-03 -6.95034123e-04] [-3.66472836e-04 1.31617867e-04 -2.41621815e-04] [ 4.13799518e-04 2.14562993e-04 3.94593715e-04] [ 3.35132525e-03 7.38959892e-04 1.33638646e-03] [-2.69374060e-03 4.19027899e-03 1.12911444e-03] [-3.26026590e-03 -1.91644230e-03 -1.22418288e-03] [-2.28282299e-04 2.00429349e-03 1.13387526e-03] [ 3.33320875e-04 2.19321037e-04 6.33571588e-04]] Final stress: [-1.88188645e-05 -1.89940080e-05 7.51006140e-06 1.20007016e-03 -9.77381011e-06 7.75704848e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-0.00285815 0.0030554 -0.000474 ] [ 0.03663684 -0.03408251 0.00803873] [-0.00418947 -0.02276392 -0.00445263] [-0.00663668 -0.01335181 0.00149579] [-0.02164087 0.02496449 0.00633002] [-0.03228873 -0.01519768 -0.00402528] [-0.01332502 0.04066362 -0.00955095] [ 0.00733052 0.0066517 0.00976695] [ 0.0281119 -0.00247522 -0.02492226] [ 0.0063093 0.00554417 0.01643309] [ 0.00010315 -0.0069922 -0.00183121] [-0.02968749 -0.04800061 0.00430278] [-0.00337312 0.00888523 -0.02427113] [ 0.01060022 -0.03393348 0.00869068] [-0.01781487 0.00289535 0.04038736] [ 0.00999844 -0.02685774 0.00359226] [-0.01600714 0.08121785 -0.00205529] [ 0.02465461 0.0017335 -0.0280612 ] [ 0.0071617 0.0078528 0.00725181] [-0.03848273 0.04440133 0.00737911] [ 0.00876883 0.02806538 -0.01627572] [ 0.01799419 -0.00978252 0.00114411] [-0.0188537 -0.02676239 -0.00517933] [ 0.00539646 0.01290181 0.00912138] [ 0.03252664 0.01625356 -0.00036743] [ 0.01249309 -0.00939865 0.00315382] [ 0.01398582 0.02516243 0.01020205] [-0.01530404 0.00883979 0.01228993] [ 0.00160653 -0.01042386 0.00697518] [ 0.02449664 -0.00689715 0.01399501] [-0.03336206 -0.03015884 -0.0155578 ] [-0.00070238 0.00417007 -0.00469544] [-0.01320771 -0.03223956 0.00938903] [ 0.03132471 0.00049039 -0.01590336] [ 0.00478317 0.00773434 -0.01546244] [-0.0165486 -0.00216508 -0.00685364]] Final stress: [-5.16923919e-04 5.36674550e-04 -1.03983442e-04 -1.19161001e-03 3.40121776e-05 -8.19778421e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 3.94740782e-03 2.62837807e-03 -8.61743249e-04] [-7.89259227e-04 1.79354070e-03 -2.93430962e-04] [-2.02255960e-03 1.38837204e-03 2.36958736e-04] [-9.13832551e-04 7.54872760e-04 -3.77568280e-05] [ 4.39601014e-03 -6.87595333e-04 -5.81790445e-04] [-1.07851417e-03 -1.83807317e-03 -2.57042240e-04] [ 8.75363083e-04 -1.26297768e-03 -2.60910855e-03] [ 7.69277831e-04 -2.07992111e-03 1.52980097e-03] [ 1.04383180e-03 -1.66284342e-03 1.08940656e-03] [-1.72970608e-03 2.42891526e-03 1.02336275e-03] [ 1.53136428e-03 4.05951008e-03 -1.69399511e-03] [-2.58445789e-03 4.85474087e-04 -1.84493995e-03] [ 9.26892173e-04 2.14229103e-03 1.76191308e-04] [ 7.10665235e-04 -1.20271897e-03 8.77733261e-05] [-8.92423676e-04 -2.91063404e-04 -1.12217956e-04] [ 1.00455283e-03 -2.25863243e-03 -1.25897066e-03] [-2.56320682e-03 2.35520072e-03 9.87792787e-04] [ 2.84183532e-04 -5.51900824e-04 -3.15714695e-04] [ 2.56969170e-03 -3.00909742e-03 -4.01377252e-05] [-3.70267845e-03 3.04913648e-03 -5.41659351e-04] [-2.89585711e-03 9.42307886e-04 -5.45077325e-04] [-6.05241480e-03 3.92378730e-03 -2.24879050e-05] [ 3.15163655e-03 -5.66307539e-03 1.06664526e-03] [ 4.12821061e-03 -2.35595445e-03 2.67204404e-04] [-5.01541267e-03 3.09961406e-03 -8.53129779e-04] [ 4.15090575e-03 -8.91050116e-04 8.89997400e-04] [-2.54707790e-04 6.96800583e-04 1.69499324e-03] [ 5.54075098e-04 1.18943274e-03 -7.08809983e-04] [ 2.94597602e-03 1.62905252e-03 6.90133673e-04] [ 9.47655676e-04 -2.85621220e-03 8.85409440e-04] [ 2.77273689e-03 -4.22508667e-03 9.66453017e-04] [-3.11574535e-03 1.36096779e-04 -2.95032448e-05] [ 4.67078799e-04 4.21731421e-04 -3.56155142e-04] [-7.50186080e-04 -2.65691390e-03 1.26323573e-03] [-4.54038389e-03 -3.03402444e-03 -2.61664036e-04] [ 1.72383036e-03 3.40262642e-03 3.69976517e-04]] Final stress: [-3.82716514e-04 3.49944779e-04 -5.32056327e-05 5.97096586e-04 5.90120916e-04 3.69211961e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-5.53640892e-03 6.46841839e-04 8.27334890e-04] [-4.01438700e-03 -3.69527468e-03 -2.63518784e-04] [-4.78095708e-04 -1.56886186e-03 -3.15169197e-04] [-8.38448864e-03 4.17996988e-03 -5.62448340e-04] [-2.02499973e-03 3.85705220e-04 2.64370403e-04] [-4.60099716e-04 1.14676953e-03 3.22217271e-05] [-1.27092404e-02 -1.89442202e-02 1.06615507e-03] [-6.81979388e-03 4.47176175e-03 -7.62952945e-04] [ 7.91842122e-03 -7.86822879e-03 -1.83080202e-03] [-3.09925764e-03 -8.89995644e-03 2.47064715e-03] [-3.09544284e-03 1.00518993e-03 -3.98091250e-03] [ 3.39803268e-03 -4.10218000e-03 2.62543181e-03] [-1.46087233e-03 -1.98208111e-03 1.54764968e-03] [-1.92689644e-03 4.68585541e-03 -2.51149815e-03] [-1.82783529e-03 -1.16341533e-03 1.93323400e-03] [-1.68545722e-03 3.75209282e-03 2.16693999e-03] [ 4.87740722e-03 -5.53825954e-03 1.06028093e-03] [ 5.13695579e-04 -3.39639478e-03 -4.44869889e-03] [ 1.98061214e-03 1.78241144e-03 -5.10520537e-04] [ 1.62935609e-03 2.24529841e-02 9.76383127e-04] [ 3.02584609e-03 5.57669528e-03 -9.86433863e-04] [-1.18714709e-03 4.11621708e-03 -7.96411597e-04] [ 5.24541020e-03 -1.28186477e-04 -2.59629666e-04] [ 6.65304836e-03 2.05747876e-03 1.10584978e-03] [ 2.26266464e-03 -4.33527859e-03 2.71716245e-03] [ 6.78874527e-03 2.58094680e-04 2.20732185e-03] [-6.76676801e-04 -9.26467352e-04 -2.37224942e-04] [ 7.63674113e-03 5.50732492e-03 1.13046026e-03] [-2.35424895e-03 -1.49583948e-03 2.82642429e-04] [-1.99878114e-03 -7.82932625e-04 -2.95910578e-03] [-2.15431219e-04 3.92822414e-03 2.82544201e-04] [ 3.89283768e-03 2.73039082e-03 -1.89171666e-03] [ 1.20259356e-03 -3.12807846e-04 -4.08461629e-03] [-2.54661198e-03 -5.92212526e-04 1.10191869e-03] [ 2.23630781e-03 -4.26092867e-03 3.44695415e-03] [ 3.24045324e-03 1.30951877e-03 -8.43842446e-04]] Final stress: [ 4.66255518e-04 -3.23303583e-04 1.17190148e-05 6.09124211e-04 -5.96643001e-04 3.13058804e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 1.01216753e-04 -3.33996976e-03 1.55029227e-04] [-4.70458038e-03 -3.29646314e-04 -5.08799665e-04] [ 2.33628665e-03 -3.02883198e-03 -6.19319599e-04] [ 6.16640051e-04 4.40486025e-03 -6.71498301e-04] [-2.03663522e-04 -1.16728808e-03 -6.88681296e-05] [ 7.81394217e-04 -2.37915694e-03 7.85903546e-06] [-7.69483352e-03 2.71476579e-03 -9.91367671e-04] [ 4.27258597e-03 -5.45224073e-03 -3.00868244e-04] [ 1.62996828e-03 -5.45635834e-03 -1.78383855e-04] [-3.95797527e-03 1.41953821e-04 1.11405056e-03] [ 2.57668985e-03 -1.95782760e-03 4.98694845e-03] [ 4.33224121e-03 -2.68343594e-03 -3.60877074e-03] [ 2.65013059e-03 -2.79179558e-04 -1.69817001e-04] [-3.67110990e-03 -7.45561608e-03 1.32152337e-03] [-1.11018199e-04 5.50440141e-03 8.73643036e-04] [ 3.11677822e-03 6.16198183e-04 4.75938849e-04] [ 3.08252584e-03 4.13281185e-03 2.62623904e-04] [-1.95227800e-03 -4.96538960e-03 -2.31416621e-03] [ 6.15072788e-04 4.15846275e-03 -5.90298645e-04] [ 2.92522252e-03 7.80806052e-03 -4.81311313e-04] [-6.48853715e-03 -2.90500918e-03 4.29301694e-04] [-4.49011732e-03 1.73323018e-03 -2.56893811e-04] [ 1.13425865e-03 4.65761565e-04 -7.34347180e-04] [ 2.31260405e-03 3.94626054e-04 7.05493944e-04] [-5.12477645e-03 4.79863507e-04 7.64238500e-04] [ 2.12842462e-03 -4.67401351e-03 2.40192172e-03] [ 1.44863503e-03 4.12135846e-04 -1.02640685e-03] [ 2.61610204e-03 3.23259389e-03 2.54268356e-03] [ 3.39504302e-03 6.44570153e-03 -1.86054936e-03] [-3.83817801e-03 -3.36139345e-03 1.79777819e-03] [ 6.49678218e-03 4.91472186e-04 -3.67376704e-03] [-2.63971814e-03 3.08277278e-03 1.02438540e-03] [-2.21612219e-03 2.53358533e-03 8.96371612e-04] [ 1.18101921e-03 -1.36995369e-03 1.90280047e-03] [-3.70514787e-03 -2.04827814e-03 -2.30003543e-03] [ 1.04843417e-03 4.10033146e-03 -1.30712248e-03]] Final stress: [-4.21332941e-04 3.08265328e-04 -7.33354985e-05 -5.88910726e-04 6.05209969e-04 -4.09004898e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[ 9.04264628e-04 4.72371748e-03 -4.42531461e-04] [-1.33100769e-03 1.73373871e-03 -4.58279792e-04] [-5.94773024e-04 3.38373277e-03 4.12566921e-04] [ 1.12964720e-03 -1.40668714e-03 1.53917642e-04] [ 2.67273355e-03 -4.37319021e-03 -7.06333873e-04] [ 7.59814782e-04 -4.07072008e-03 -9.20875910e-05] [-6.63186036e-03 -5.74042986e-03 -1.84714735e-03] [-4.90595360e-04 4.15642219e-03 3.33664402e-03] [ 5.70689750e-03 -3.13926699e-03 -7.46841587e-04] [-6.15901137e-04 2.94526406e-03 2.79919753e-03] [ 9.06702952e-03 7.70529490e-03 -2.79670503e-03] [ 7.68274467e-03 -3.54395203e-03 -1.34565017e-04] [-7.03783322e-04 3.02190987e-04 8.83129723e-04] [-2.92380431e-03 9.35116014e-04 -2.79294346e-03] [ 2.08891898e-03 2.62711156e-03 2.72691459e-05] [ 1.48570722e-03 5.95280085e-04 -2.81212324e-03] [ 4.34446744e-03 5.70375174e-03 1.54916565e-03] [-7.81577641e-03 -7.43002245e-03 3.76114213e-03] [ 1.97251646e-03 -4.00853822e-03 -2.04389855e-03] [-8.34805823e-04 6.14816048e-03 1.09488387e-03] [-7.09603244e-03 -3.04946976e-03 -1.16690605e-03] [-6.32076024e-03 4.36588732e-03 -1.96412560e-03] [-2.11559875e-03 -3.91869842e-03 2.62505870e-03] [-3.89266034e-03 -8.14219084e-04 1.27608465e-03] [ 6.47864531e-03 2.83068100e-03 -3.06423540e-03] [ 5.90523319e-04 -1.70909270e-03 -6.43684982e-04] [-3.08155695e-03 -1.60831316e-03 2.46373291e-04] [-9.75698682e-05 -2.05064796e-03 -2.03703001e-03] [-2.03390212e-03 2.64640180e-04 1.15679302e-03] [ 2.70797238e-03 4.50558401e-03 4.34508720e-03] [ 1.75802278e-03 -2.51099446e-03 3.28273334e-03] [ 1.38901213e-04 -1.92561452e-03 2.89926084e-03] [-3.25797657e-03 7.50283859e-04 -2.20505402e-03] [ 1.37284890e-03 3.30859396e-03 -2.43856620e-03] [-2.33279222e-03 -5.80203791e-03 2.29331111e-03] [ 1.30950107e-03 1.16443638e-04 -3.74955955e-03]] Final stress: [ 4.51667252e-04 -3.39384916e-04 1.41497021e-05 -5.92216328e-04 -6.07796877e-04 -4.03230567e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-9.45148279e-03 1.23075143e-02 3.73595902e-04] [ 1.77349420e-02 5.49876267e-03 1.79876469e-03] [ 7.15315326e-03 -6.48378209e-03 -9.73740056e-04] [ 5.25775960e-03 -5.15748040e-03 5.90144555e-04] [ 1.55482498e-03 1.38002273e-02 1.09819057e-03] [-1.35446032e-02 -1.00948854e-02 -2.88122352e-03] [ 5.01915912e-04 -3.77741737e-03 4.73630760e-03] [-7.94252026e-03 -6.46311112e-04 -4.12188859e-03] [-8.25904719e-04 -6.40008054e-03 5.79504564e-03] [-2.29666404e-03 5.75252040e-05 1.88953685e-03] [ 2.49699707e-02 -1.66078855e-02 -1.14269140e-02] [-3.32332020e-04 -4.85731445e-03 4.54869488e-03] [ 7.88820004e-03 -1.48239042e-02 4.85805999e-03] [-7.99175166e-03 1.28054769e-02 -2.95976942e-03] [-3.49027015e-03 8.65562538e-04 2.17168500e-03] [ 1.68148064e-02 -1.84311750e-02 -1.46331809e-02] [-1.25274224e-02 1.64440608e-02 2.73655232e-03] [-1.18792652e-03 3.50962755e-03 1.02450419e-02] [ 1.45870896e-02 5.37140665e-03 -3.48281373e-03] [-3.63856506e-03 -2.45861877e-02 6.96770978e-03] [ 1.28813596e-03 8.49780225e-03 1.05951027e-02] [ 4.04549907e-03 -9.42438159e-03 -8.44796934e-03] [-8.53356038e-03 3.00502561e-03 -4.76845011e-03] [-6.06546756e-03 1.75552783e-02 -7.41862465e-04] [-5.65091127e-03 8.32414892e-03 -3.11181975e-03] [-5.12914720e-03 1.17166114e-02 2.88006556e-03] [ 1.20748943e-03 1.07718310e-03 -7.48289942e-03] [-4.66810559e-03 2.43717533e-03 -9.79799330e-03] [ 5.25335701e-03 -3.88468490e-03 7.56648102e-03] [-5.38969922e-03 1.31039778e-02 -2.55433709e-03] [ 4.75550389e-03 -6.79524818e-03 2.82225158e-03] [ 2.35299876e-03 -2.33777583e-03 -5.52503572e-04] [-9.71278958e-03 1.30681213e-02 4.92823074e-03] [ 4.44502070e-04 -1.08684804e-03 -8.69598302e-03] [-7.10759414e-03 -6.52278747e-03 1.30012505e-02] [-3.23430855e-04 -7.52733818e-03 -2.96936343e-03]] Final stress: [-2.88860156e-04 -1.21141536e-04 -3.20726226e-05 1.01712602e-03 2.50475423e-05 1.20060302e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-2.32162737e-04 -5.22726924e-04 1.44524659e-04] [ 1.97825550e-03 -2.85083320e-03 5.85175106e-04] [-1.15054931e-03 4.15508548e-03 6.36223023e-04] [ 9.96525815e-04 -4.25037872e-03 5.88323098e-04] [-1.78679486e-03 9.51571240e-04 2.59785597e-04] [-1.77687241e-04 -9.76042247e-04 -1.03478668e-04] [-1.02452545e-03 4.15994207e-03 7.50271272e-04] [ 1.01574064e-02 4.99327567e-03 -1.87303418e-03] [-2.01558097e-03 -4.51262925e-03 -1.53649008e-03] [-6.78230880e-03 3.41788573e-04 1.75422836e-04] [ 6.29979871e-03 2.60926952e-03 2.12720876e-03] [ 4.38146632e-03 -9.28679399e-03 -7.20323394e-04] [-1.58972020e-02 1.06163157e-04 -2.29672285e-03] [ 3.19766598e-03 3.66965153e-03 1.02675390e-03] [ 1.81712990e-02 -1.35464519e-03 -8.95220426e-04] [-4.20874951e-03 -4.90837999e-04 2.44870010e-03] [-1.55641926e-03 -1.91048475e-03 -2.83172261e-04] [ 5.95611675e-04 1.34563977e-03 -8.18349722e-04] [-8.34054400e-03 -7.48260662e-03 6.71087127e-05] [-5.36734678e-03 5.47926729e-03 -2.34213803e-03] [ 3.73483966e-03 1.11773672e-03 -3.58317742e-03] [-4.05888439e-03 2.09907233e-03 1.08471575e-03] [ 1.26687394e-04 1.03056176e-02 2.96115481e-03] [ 8.40467744e-04 -3.46759369e-03 2.38692133e-03] [-5.46927778e-03 -5.78475089e-03 -1.93271701e-03] [ 2.37495910e-03 3.08539555e-03 -1.22590808e-03] [ 3.18484003e-04 -1.51793126e-03 -1.22858135e-04] [ 7.48974703e-03 2.31471770e-03 5.37209665e-03] [ 1.47738977e-03 3.41212550e-03 2.29829968e-03] [ 1.22862016e-03 -3.80676705e-03 2.25614087e-03] [ 5.45892681e-03 4.51347371e-03 1.48593634e-03] [-3.21762013e-03 -2.67196835e-03 1.41898851e-03] [-3.63150029e-04 4.62368771e-04 -4.49882941e-04] [-7.04138645e-03 -1.46179363e-03 -3.74188996e-03] [-9.19472583e-04 -4.22601157e-03 -3.49884754e-03] [ 7.81511288e-04 1.45263319e-03 -2.64954029e-03]] Final stress: [-1.17483365e-04 -6.62562162e-05 3.84502010e-06 2.17651049e-04 8.04633750e-06 -3.96667097e-04] Minimization converged after 56 steps. Minimization converged after 53 steps. Minimization converged after 50 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-2.30895894e-03 -1.18422018e-03 4.23273828e-04] [ 4.00034075e-04 -1.95425262e-04 1.18851428e-04] [ 2.18078472e-05 1.72299192e-03 2.88686717e-04] [ 2.44029561e-05 -8.15654940e-04 1.15510408e-04] [-4.09323365e-04 1.31257188e-04 8.00158811e-05] [ 3.06000439e-03 1.82093741e-03 4.87047493e-04] [-1.61156654e-03 -3.54535344e-04 1.47924156e-04] [ 5.86753915e-03 2.45788398e-04 -3.07590835e-04] [-1.59528661e-03 -7.59846667e-04 8.85951988e-04] [ 2.18040263e-03 2.29943378e-03 -5.95540797e-04] [-5.94695087e-03 -2.10490125e-03 -2.15704269e-04] [ 2.71298788e-04 -3.47955895e-05 -1.22151872e-03] [-2.38152962e-03 1.95363333e-03 -2.01483749e-04] [-6.08899746e-05 -1.60115702e-03 -1.16719921e-03] [-1.00081820e-03 3.31841764e-04 -4.84811621e-04] [ 6.69021872e-04 -2.24731029e-03 -1.10487083e-04] [ 8.41987167e-04 1.34822179e-03 8.67969036e-04] [ 1.76776775e-03 -3.64841466e-05 2.71741233e-04] [-9.99023934e-04 -2.98813671e-03 9.15531512e-04] [ 1.09861736e-03 2.11403095e-03 -7.28217582e-04] [ 1.70096460e-04 -2.31904263e-04 9.20099553e-04] [ 1.09528753e-03 1.20133847e-03 -8.83089489e-04] [-1.44959666e-03 2.59320843e-03 9.20622835e-04] [ 4.78189121e-04 -2.39648323e-03 -6.15653251e-04] [ 1.75643181e-04 1.35938305e-03 -1.36596407e-03] [ 1.91710256e-04 -2.64701862e-04 8.91611327e-05] [-6.53359888e-05 1.19859988e-03 3.80729896e-04] [-1.21335937e-03 -1.31705976e-03 1.76648036e-03] [ 7.44456499e-04 -1.06217204e-03 -7.80714786e-04] [-1.38550059e-03 -2.03887139e-03 -1.77133931e-03] [ 1.35820782e-04 -1.37236989e-03 1.49934344e-03] [-2.46040835e-04 3.55969909e-04 -7.27181991e-05] [-5.69871624e-04 -1.66338269e-03 -5.77431979e-04] [ 8.77952052e-04 1.41970395e-03 -1.68518331e-03] [-1.47921617e-04 1.21343571e-03 8.79324977e-04] [ 1.31993486e-03 1.35963660e-03 1.72638238e-03]] Final stress: [-4.63290022e-04 2.69727561e-04 -3.22280436e-05 3.69282336e-04 6.06783925e-04 7.16053814e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 4.89794070e-03 3.16364572e-03 -7.27922062e-04] [-6.85454385e-03 3.82916904e-03 -1.19507901e-03] [-1.06704184e-04 -1.30679902e-03 -1.76749465e-04] [ 1.16247903e-05 4.64315366e-03 -7.30362041e-04] [ 6.19048954e-03 -2.98124484e-03 -1.26061266e-03] [-2.71099479e-03 -1.79246859e-03 -4.71964290e-04] [-1.11491587e-03 9.80203786e-04 -2.53803883e-03] [ 9.66040612e-03 1.95760876e-03 2.38543780e-03] [-1.23251699e-03 -1.69133953e-03 3.34155099e-04] [-3.25951900e-04 -4.16412957e-03 3.94894509e-03] [-8.04866474e-03 3.66301882e-03 -9.96312937e-04] [ 3.52105548e-03 1.42101765e-03 -9.32861784e-05] [-4.02400944e-03 3.03004028e-03 1.16356737e-03] [-2.36293915e-04 -1.91354381e-05 1.08327819e-03] [ 6.91367666e-03 8.68088283e-04 -1.68814276e-03] [ 1.87735962e-03 -1.93233176e-03 -9.58272083e-04] [-2.07578071e-03 2.14926916e-04 -3.22237866e-04] [-3.13033071e-03 -2.94636399e-03 2.64928053e-03] [-2.22408554e-03 -6.52798498e-03 2.80412073e-03] [-5.91516487e-03 -3.38467956e-03 -5.07623021e-03] [-3.66805659e-03 3.03213993e-03 -2.23617585e-03] [ 3.64046613e-03 2.14214490e-03 -3.74154087e-03] [ 3.40887430e-03 3.90154739e-03 4.88113667e-03] [ 1.70729125e-03 -1.59910229e-03 1.57294254e-03] [-2.93243417e-03 3.20228420e-03 -5.98936051e-04] [ 2.23992555e-03 3.32237724e-03 2.52646185e-03] [-2.22475349e-03 1.02665401e-03 2.28918398e-04] [ 5.34477569e-03 -1.54215511e-03 -4.18278099e-04] [-1.91602034e-03 -1.75310729e-04 5.56314560e-04] [ 2.37922196e-04 -2.71704292e-03 -1.45428939e-03] [ 1.25313332e-03 -3.29794870e-03 4.52862817e-04] [-2.81037791e-03 -5.41997566e-03 -1.29005185e-03] [ 3.00673315e-03 -9.66156751e-04 -4.03214432e-04] [-3.62005661e-03 1.96678000e-04 9.98765255e-04] [ 3.90214202e-04 -1.32878423e-03 2.34306223e-04] [ 8.69767931e-04 3.19825511e-03 5.57203803e-04]] Final stress: [-4.28077669e-04 2.95360983e-04 8.05763502e-08 -4.25537344e-04 6.39525135e-04 -7.59555305e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 0.03114253 -0.00750056 -0.00482397] [ 0.02432973 -0.01065791 0.0060841 ] [-0.01892848 -0.05053224 -0.00517474] [ 0.01124808 0.00505276 -0.00184329] [ 0.01327662 -0.02433896 -0.00322167] [-0.05076322 -0.02220527 -0.01204654] [ 0.00629765 0.00681481 0.01527804] [ 0.02123939 0.00754912 -0.00463154] [-0.02514649 -0.01181341 -0.01143363] [ 0.03232076 0.04114394 -0.00047468] [ 0.01391561 0.023961 0.01121934] [-0.02294679 0.05378723 -0.00582106] [-0.1090044 0.01727714 0.04809873] [-0.01502061 -0.00758524 -0.03307768] [ 0.10525783 0.00280855 -0.00551305] [ 0.01935611 0.01068558 -0.02605157] [ 0.0558076 0.05459535 0.02774132] [-0.05794917 -0.07734611 -0.00406714] [-0.01353089 -0.00813804 -0.02624221] [-0.00809724 -0.01495828 0.00429876] [-0.05930086 -0.03306225 0.00941365] [-0.00336449 0.00427143 0.03189355] [ 0.01549667 -0.02595552 -0.00570747] [ 0.03905591 0.01707101 -0.01815035] [-0.00410336 -0.01785265 0.00167857] [ 0.00014531 -0.01761176 -0.00489025] [ 0.00482804 -0.00371899 -0.00820222] [-0.00485262 -0.01529487 -0.01250892] [-0.01201478 0.03494358 0.03788768] [-0.03789108 0.01889196 -0.01280896] [ 0.00316087 0.03886439 0.00760582] [ 0.00501016 -0.00303924 0.00297994] [ 0.00256261 0.01005398 0.00693572] [ 0.00248309 0.01796394 0.02239582] [-0.00082252 -0.00709154 -0.03890362] [ 0.03680244 -0.00703291 0.01208352]] Final stress: [ 5.23958861e-04 -7.04593925e-04 8.96338619e-05 1.98668016e-04 -9.81893324e-04 4.23666459e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 0.00126595 0.0088352 -0.00225476] [ 0.03197722 -0.01446647 0.00812882] [ 0.00759699 -0.00758526 0.00072441] [-0.00440187 -0.01120948 0.00016008] [-0.00133635 0.00634872 0.00211212] [-0.02219738 -0.01917741 -0.00678756] [ 0.00760909 0.01179161 0.00654172] [-0.00729003 0.00610799 -0.01073712] [-0.00502298 -0.00384073 0.00417527] [ 0.0145436 0.01145383 0.00771127] [-0.01704916 -0.00644304 0.00800487] [-0.00127223 -0.002442 -0.01607388] [-0.01709544 0.0579749 0.00276192] [ 0.01480409 -0.05561725 -0.01905829] [-0.024728 0.00774958 -0.00126782] [-0.01034952 0.00351177 0.00060041] [ 0.01016315 0.01977157 0.00773439] [ 0.0117204 0.00337584 0.00891579] [ 0.01753806 -0.01749341 -0.00619339] [-0.00909311 0.00493252 -0.00344093] [ 0.00040757 0.00662259 -0.01755784] [ 0.01714896 -0.01137205 0.00769969] [-0.00629529 0.01366621 0.00349124] [ 0.00692897 -0.027234 0.01600162] [ 0.00364143 -0.00714109 0.00744338] [ 0.01099367 0.00536326 0.00881385] [-0.00110936 -0.00015208 -0.00873502] [-0.01302199 -0.01066224 0.00074968] [-0.0029351 0.01080413 0.01040565] [ 0.00879431 0.01250554 -0.00287288] [-0.0016981 -0.00258572 -0.00230655] [-0.02331834 0.01488161 -0.00206964] [-0.0006994 -0.00840649 0.00124194] [ 0.00541793 0.0063164 0.00423231] [-0.00319318 -0.01827246 -0.00295016] [ 0.00155544 0.0120879 -0.01534458]] Final stress: [ 3.69107075e-06 -6.90472161e-04 -8.26902766e-05 -3.08793706e-04 -5.14658956e-04 -8.90619179e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 9.94397845e-04 5.91281923e-04 -2.61997539e-04] [ 2.34045974e-03 -1.68175494e-03 3.61992042e-04] [-2.69625360e-05 -2.03358285e-03 -2.71609727e-04] [-8.50102939e-05 -6.87425799e-04 1.48421190e-04] [-3.56843170e-04 2.56423428e-04 6.23931919e-05] [-4.58294787e-03 -2.62107869e-03 -9.07112486e-04] [ 4.27152495e-04 3.71117720e-04 1.07372311e-04] [-1.70119766e-03 -5.85861871e-04 -4.85006156e-04] [ 5.42078813e-03 -6.49986979e-04 7.40343321e-04] [ 3.13387364e-03 -1.82306707e-03 -1.82708406e-04] [-7.57646204e-04 -1.42356551e-03 1.48328978e-03] [-4.85167256e-03 3.82529114e-03 -1.25742006e-03] [-3.25642702e-04 6.84444786e-03 -3.46638868e-03] [ 1.82209331e-03 8.40497899e-04 8.39390012e-04] [-3.02007275e-03 6.18193172e-04 7.39780385e-04] [ 1.06147554e-03 -7.47317239e-03 3.91227941e-03] [-2.79675973e-03 5.98092745e-04 -5.58488490e-04] [ 3.10269942e-03 -7.36777431e-04 -1.28439561e-03] [-1.34961253e-03 2.56963744e-03 3.18026236e-03] [-1.66343908e-03 6.01306189e-03 -1.99971243e-03] [ 1.03912920e-03 3.31747561e-03 -3.70211082e-03] [-1.38585476e-03 -2.77303749e-04 -2.29365588e-03] [ 2.58398779e-03 -4.20026025e-03 2.02505005e-03] [-1.57526670e-03 -4.07658647e-03 2.54090299e-03] [-1.11536399e-04 1.49240910e-04 1.09687649e-03] [-2.19376054e-03 -6.80992415e-04 -2.45269202e-03] [-1.60942760e-03 -1.31146986e-04 1.62095719e-04] [ 1.21220820e-03 -1.48103063e-03 2.01445758e-03] [ 9.87998805e-05 1.29225479e-03 -5.73109014e-04] [ 1.43712925e-03 -4.21522555e-04 6.89664471e-04] [-5.57932094e-04 -9.41604163e-05 -1.23545843e-03] [ 2.65017730e-03 1.72421211e-03 2.33922701e-03] [ 2.36718228e-03 -1.89686342e-04 4.28184457e-04] [-3.58206052e-04 1.31565037e-03 -1.76949329e-03] [ 8.19827589e-04 -9.36763903e-04 -3.74308570e-04] [-1.20159038e-03 1.87884824e-03 2.03684827e-04]] Final stress: [-5.24044235e-05 -1.90367329e-04 -3.35122509e-05 7.38054958e-04 3.45830051e-05 1.45345899e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 6.68048297e-04 -1.49262689e-05 -1.17867738e-04] [ 4.94295249e-03 -2.74902514e-03 9.49547435e-04] [-1.16822614e-04 -1.44496541e-03 -2.75521999e-04] [ 1.98931955e-05 -1.68200354e-03 2.26762765e-04] [-7.24013127e-04 -1.98307773e-04 1.78570862e-04] [-2.99393230e-03 -1.82228814e-03 -4.39138738e-04] [-5.84366076e-03 -2.21138861e-03 -4.16840441e-04] [ 3.87960656e-03 8.38001742e-04 -5.62102332e-04] [ 1.05468327e-05 3.62912448e-04 2.89265672e-04] [ 4.43928251e-03 5.88220629e-03 5.89580678e-04] [-2.33697818e-04 -5.27913189e-04 1.12545744e-04] [-1.95757580e-03 -1.72567212e-03 -1.75241575e-04] [-1.86074172e-03 2.92770090e-04 -1.33401924e-03] [-2.51440403e-04 -8.31792386e-04 1.65259663e-04] [ 2.62395983e-03 2.79151077e-03 2.33882883e-03] [ 1.92850359e-03 -4.53782065e-04 4.31521525e-04] [-1.58653255e-03 -3.40201901e-03 -1.59418477e-04] [-6.26960408e-04 1.19951687e-03 -1.19286244e-03] [ 5.31670798e-03 -5.25611396e-03 1.97990195e-03] [ 1.19922815e-04 6.19746245e-03 8.74344552e-04] [-2.16334576e-03 1.68723442e-03 -3.56699540e-03] [-4.76671444e-03 1.65730021e-03 -1.08985637e-03] [-1.64425222e-03 -6.94940094e-03 -9.84771394e-04] [ 2.97302491e-03 -1.93821913e-03 2.55704956e-03] [-1.32798034e-03 -2.02185981e-03 3.47453405e-03] [-3.78889463e-03 3.00264828e-03 -3.39082921e-03] [-4.28455327e-03 -1.53030546e-03 -4.89921898e-04] [ 3.50838980e-03 -2.38613680e-04 2.28770054e-03] [-4.45246707e-04 -1.29662542e-04 -3.21794743e-03] [ 1.22410195e-03 2.88030163e-03 3.05841024e-03] [ 8.63114039e-04 3.97319449e-03 -2.24064284e-03] [ 3.86772223e-03 1.55341603e-03 2.23738283e-03] [ 3.61897912e-04 1.96233056e-04 1.58508419e-03] [-1.03445365e-03 -9.15713088e-04 -3.77086108e-03] [ 7.06644236e-04 1.62434617e-03 2.42404184e-03] [-1.80350065e-03 1.90491731e-03 -2.33549432e-03]] Final stress: [ 1.95481520e-06 -1.19190342e-04 -9.54480122e-06 -7.48676288e-04 5.34993430e-05 -1.48452620e-03] Minimization converged after 42 steps. Minimization converged after 49 steps. Minimization converged after 15 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 17 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 50 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 49 steps. Minimization converged after 41 steps. Minimization converged after 47 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 46 steps. Minimization converged after 39 steps. Minimization converged after 45 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[ 1.15087936e-03 3.81004657e-05 -2.52670673e-04] [-1.90949611e-03 8.87845784e-04 -3.27495281e-04] [ 2.03488312e-04 -3.94729912e-03 -6.51816155e-04] [ 1.84175186e-04 1.24925888e-03 -2.18066230e-04] [ 2.01180213e-03 -1.27390275e-03 -3.48597098e-04] [-1.25248961e-03 -1.25333428e-03 -3.30886719e-04] [ 1.13246259e-03 1.61093011e-04 1.58493673e-03] [-2.83354361e-03 1.59281363e-03 -8.28251123e-05] [ 3.85482168e-03 -1.88204942e-04 -5.89266303e-04] [-9.68348921e-04 -6.78628478e-04 -1.05685089e-03] [ 6.39651740e-04 -1.95134723e-03 9.17416808e-04] [-1.53656980e-03 -5.17071865e-04 1.25210689e-03] [ 9.14574680e-04 -6.68360844e-04 7.04175013e-04] [-4.20797991e-04 -1.62338208e-03 1.56807622e-03] [-1.70842695e-03 -7.03974550e-04 4.64969447e-04] [-1.15786903e-03 1.84239203e-03 5.13563250e-05] [ 1.23916942e-04 2.34025506e-03 -6.40388967e-04] [ 2.11941586e-03 7.08601824e-06 -5.89563924e-04] [ 4.69717504e-04 1.02807600e-03 9.43229221e-04] [-2.09707554e-03 1.59277604e-03 1.68294295e-03] [ 6.45077678e-04 -1.35838755e-03 1.47547967e-03] [-4.93756805e-03 1.66697367e-03 -6.04428965e-04] [ 3.93521733e-03 2.67613575e-03 -1.08850865e-03] [ 3.41033118e-04 -1.44269990e-03 -2.83993054e-03] [-1.78095023e-04 9.02176410e-04 -7.03955338e-04] [-7.01921435e-04 -5.13638815e-04 -7.38042361e-04] [ 7.78041855e-04 -8.05660876e-04 6.88906570e-05] [ 1.37339171e-03 5.78234042e-04 -6.55253776e-04] [ 4.81815525e-04 -1.92947986e-03 -1.85732303e-03] [-1.00002676e-03 1.16424870e-03 7.51660307e-04] [-7.70300235e-04 -5.89880036e-04 1.02153796e-03] [ 1.21072309e-03 -9.62105865e-05 3.65101670e-04] [-5.17435181e-04 5.59203120e-04 -5.11613307e-04] [-8.65154982e-04 -9.92985516e-04 1.31237260e-04] [-1.06729635e-04 1.87925113e-03 1.09246095e-03] [ 1.39164257e-03 3.68529529e-04 1.19052441e-05]] Final stress: [5.03639027e-04 9.02441975e-04 8.25046500e-05 2.41689880e-04 9.95171120e-05 4.24155838e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.52867881e-05 1.54352299e-04 1.55380074e-04] [ 3.88144800e-04 2.52016993e-04 1.94940428e-04] [-2.82465426e-05 -1.94085918e-04 9.69289886e-05] [-1.36750483e-04 -1.17970467e-04 -2.19285238e-05] [ 1.88465063e-04 -4.30410279e-04 3.04857152e-04] [-7.44821389e-05 -8.90822317e-05 -2.38527044e-04] [ 4.44066392e-04 -1.50932640e-03 2.17001401e-05] [-1.12541645e-03 -2.25313641e-04 -5.09416585e-05] [-1.75809728e-03 1.36014628e-03 -2.80731153e-04] [-5.60053388e-04 -7.73663519e-04 -3.43592758e-05] [ 1.72548021e-06 -3.62825060e-04 -3.11217146e-04] [-2.74216192e-04 6.26334546e-04 2.52128746e-04] [-3.15895587e-04 5.14335522e-04 -2.73325934e-04] [ 2.98907659e-04 2.79616686e-04 2.91000212e-04] [ 3.40882651e-04 -4.00788559e-04 -3.08316344e-04] [-4.03328615e-04 -9.63563746e-05 -1.06360263e-04] [ 3.32945942e-04 4.86343896e-04 1.83756703e-04] [-1.67706264e-04 -2.00393371e-04 3.40412862e-04] [ 5.43719004e-04 4.49839968e-04 2.18771964e-04] [ 1.80869400e-03 -5.44633305e-04 1.14198905e-04] [ 4.15476952e-04 1.48183317e-03 -2.85084398e-04] [ 1.12777905e-03 3.05704881e-04 3.81863900e-04] [ 5.65500410e-04 -9.12227627e-04 3.80737993e-04] [-8.28876475e-04 6.57483823e-04 -3.44409449e-04] [ 2.48217695e-04 5.75306490e-05 1.46965634e-04] [-8.46364754e-06 -1.19071925e-04 -2.26918686e-04] [-2.07354889e-04 -1.71902285e-04 -2.88543685e-04] [-2.83566913e-04 -1.64275731e-04 -7.21822105e-05] [-1.85883478e-04 9.31368630e-05 -7.94786372e-05] [-1.76909676e-04 -8.55786666e-05 -1.53823202e-04] [-5.18237317e-04 -8.97224791e-05 2.61488162e-04] [ 3.63236098e-04 -6.35862005e-04 4.73238321e-05] [-3.90719340e-04 6.29377083e-05 -4.38438928e-04] [-3.40961014e-04 2.35836118e-04 -2.34356679e-04] [ 3.44092044e-04 -4.28940930e-04 3.99078869e-04] [ 3.58025670e-04 5.34981378e-04 -4.25913485e-05]] Final stress: [ 2.80637914e-02 2.83707556e-02 1.65938234e-02 -1.31451308e-04 6.61820817e-05 -2.84704828e-04] Minimization converged after 51 steps. Minimization converged after 49 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 56 steps. Minimization converged after 59 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-2.37820034e-04 -9.56512124e-04 1.46146295e-04] [-3.64989843e-03 1.25293281e-03 -5.45171181e-04] [ 1.63213553e-03 1.47179167e-03 1.04518051e-04] [-2.09205563e-03 1.00475998e-03 -1.58078057e-04] [ 8.93906955e-04 -4.37639068e-05 -1.40566643e-04] [ 3.67586980e-03 3.08979834e-03 8.55882165e-04] [ 1.35812747e-03 5.19906603e-04 -4.82013596e-04] [-6.04450920e-03 -2.32499386e-03 7.74592380e-04] [-2.07247756e-03 2.51162491e-04 7.68708968e-04] [ 9.74210116e-04 3.43532545e-03 2.59122548e-04] [ 3.24651993e-03 -3.12774796e-03 1.01040309e-03] [ 5.87607463e-04 -4.44710891e-03 -2.35964038e-03] [-2.27601996e-04 9.13718745e-04 -1.55118829e-03] [ 4.93466382e-04 3.17189408e-04 6.06753581e-04] [ 3.03622655e-03 1.56950782e-03 2.70314991e-04] [-4.72708712e-03 2.19691205e-03 -1.67330388e-03] [ 7.97800754e-04 -3.11818784e-03 1.11666823e-03] [ 1.15351394e-03 -1.46107034e-04 1.08230949e-03] [ 1.30537981e-03 5.95828366e-04 2.64678527e-04] [-1.96400848e-03 -4.29019797e-03 -2.35410717e-04] [ 3.42048804e-03 2.25256886e-03 6.81646101e-04] [-1.93017757e-03 5.10669359e-04 -4.21124177e-03] [-2.54568389e-03 1.19047769e-03 1.22210227e-03] [-4.38305672e-03 -2.67725807e-03 2.19479442e-03] [ 1.28735448e-03 -2.11417338e-03 -1.05042914e-03] [-1.60547145e-03 -8.34786036e-04 1.58047147e-03] [ 2.09588364e-03 -2.61568947e-04 -3.39388441e-03] [ 1.35377443e-03 7.94652598e-04 -7.16419539e-05] [ 4.49084007e-04 -1.25878132e-03 -9.32861792e-04] [ 3.87110090e-03 -1.61879987e-03 1.46425473e-03] [ 1.65127183e-03 3.73676550e-03 -3.76766638e-03] [-3.77099388e-04 -1.49250568e-03 2.95593453e-03] [ 1.16926173e-03 1.09759111e-04 2.15289773e-03] [-2.01576722e-03 4.96157623e-04 1.23549966e-03] [-1.39035237e-03 3.72441173e-03 3.31970170e-03] [ 8.10083281e-04 -7.21803300e-04 -3.49430274e-03]] Final stress: [7.51685756e-05 8.93906728e-06 1.72949744e-03 2.40287892e-04 3.87023166e-05 4.45268984e-04] Minimization converged after 56 steps. Minimization converged after 54 steps. Minimization converged after 53 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 53 steps. Minimization converged after 57 steps. Minimization converged after 55 steps. Minimization converged after 56 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 2.42967687e-03 -3.67645638e-03 -7.79984627e-05] [ 1.64458968e-03 -5.81080405e-03 6.51049777e-04] [-1.33996928e-03 -1.14300899e-03 -1.31607498e-04] [ 1.48672432e-03 -2.43201480e-03 4.43268023e-04] [-4.00860066e-03 -4.99739421e-03 1.63505277e-04] [-2.57206449e-03 -3.52493946e-03 -6.71841974e-04] [ 1.98530049e-03 4.72531125e-03 -8.87867566e-04] [-8.17791223e-03 1.81697346e-03 2.57556138e-03] [ 3.60974307e-03 3.13264199e-03 -7.21284686e-05] [ 2.79909738e-04 6.59625675e-03 2.98662349e-03] [ 3.12379984e-03 -1.61151952e-03 -5.88456944e-05] [-5.12525024e-03 8.98173727e-03 -2.14257354e-03] [-1.41103165e-03 -1.20017451e-03 1.46517286e-03] [ 3.54161466e-04 1.41380706e-03 2.36155908e-03] [ 3.33680427e-04 -1.32450299e-03 -2.80960107e-03] [-1.02356503e-03 4.44582018e-03 3.04067577e-03] [ 7.44913035e-04 -1.61624954e-03 -3.84972882e-03] [ 2.12657419e-04 2.09189932e-03 -1.44731243e-03] [ 7.08114839e-03 2.35237458e-03 4.36057414e-03] [ 2.57426685e-03 9.56355694e-04 -2.46616024e-03] [-1.48032977e-03 -3.48340020e-03 -1.43519813e-03] [-3.44717543e-03 -1.55088982e-03 4.00349390e-04] [-2.43379771e-03 -7.32320460e-03 1.74556561e-03] [ 2.27861963e-03 6.67535602e-03 -3.94014887e-03] [ 2.71680964e-04 1.84115959e-03 3.08323456e-04] [-5.28664782e-03 -4.46412167e-03 -4.40366424e-03] [ 3.06184926e-03 -6.35836253e-04 -2.15715770e-03] [-4.63830723e-03 -1.29860521e-03 3.31039770e-03] [ 1.59760953e-03 1.99133062e-03 -4.03556714e-05] [-6.54857299e-04 -4.68211675e-03 2.85793664e-03] [ 1.62802075e-04 2.60777904e-04 2.21699624e-03] [ 2.99998608e-03 1.72262433e-03 2.98128831e-03] [-5.79292989e-04 -1.83633013e-03 1.02986356e-03] [ 3.05643761e-03 1.97967605e-03 -1.47278802e-04] [ 1.13880274e-03 4.00206096e-04 -3.86316997e-03] [ 1.75044232e-03 1.22726091e-03 -2.29607156e-03]] Final stress: [ 3.36339714e-05 8.73740161e-07 -3.86723955e-05 -1.66688971e-04 2.08763123e-06 2.46893753e-04] Minimization converged after 51 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.92535700e-02 2.37088218e-01 -2.13056581e-01] [-1.18298352e-01 -2.88146793e-02 -4.70021729e-03] [ 2.04485776e-01 9.52570176e-02 -7.96806946e-02] [-1.33870662e-01 -8.83105900e-02 -8.58266970e-02] [ 2.51365175e-01 -1.38050536e-01 -1.67641092e-02] [-2.54828593e-01 2.79640178e-04 -2.76654541e-01] [ 9.11410401e-01 5.06382773e-01 3.57149805e-02] [-8.02097787e-01 2.14249313e-01 -8.45308336e-02] [-4.81770747e-02 -9.28476466e-02 -2.00385409e-01] [ 1.00856031e-01 1.57516881e-01 -5.01224844e-02] [-3.05506923e+00 -1.19513900e+00 2.02746138e-01] [ 1.19463303e-02 -1.97311695e-01 -7.90098606e-02] [ 8.00639342e-03 1.35389326e-02 1.63979603e-01] [-8.28992381e-02 9.69788814e-02 1.79231354e-01] [-2.00453544e-02 -3.63118061e-02 -7.68137224e-02] [-9.46184464e-02 -4.44074603e-02 1.29661860e-01] [-1.01992273e-01 4.88902686e-02 1.50594226e-01] [ 1.76817434e-04 4.00562522e-02 2.15656112e-02] [ 7.02392161e-01 -1.21409926e+00 5.64118526e-02] [-6.90611420e-01 5.53638957e-01 5.83678376e-02] [ 4.93899950e-02 -3.38431158e-01 7.11909514e-02] [ 1.75293568e+00 1.73123696e+00 -2.96553178e-01] [ 6.52895010e-03 -1.32663512e+00 4.04505470e-01] [ 1.02705355e+00 9.19452533e-01 2.22208727e-02] [ 3.93893938e-02 2.77905831e-01 1.35538322e-01] [ 1.45011223e-01 2.45476577e-02 -8.81970798e-02] [-2.64835423e-02 2.48827708e-02 -2.41101336e-02] [ 2.08386874e-01 -2.38367243e-02 -5.61171022e-02] [ 5.50295227e-02 -3.11798533e-01 2.07931030e-01] [ 1.78362714e-02 5.27772048e-02 -8.13865569e-03] [-4.59627466e-02 -8.79663933e-02 -2.41694909e-01] [ 2.05553726e-01 8.38850176e-02 8.84511248e-02] [-1.26718958e-01 -1.22242097e-01 5.62488775e-02] [-1.48187436e-03 1.53343335e-01 3.88438626e-02] [ 6.07277620e-02 -7.57433528e-02 -7.72714222e-02] [-1.36072921e-01 9.00376024e-02 -6.35763430e-02]] Final stress: [ 0.02101592 0.03415669 0.01157818 -0.00264369 0.00188727 -0.00722079] Minimization converged after 51 steps. Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[ 2.52059829e-03 1.63001096e-03 -4.16321034e-04] [-2.65428885e-03 1.31099265e-03 -4.72876158e-04] [-5.30813861e-04 -3.81348428e-04 -6.35347864e-05] [ 7.04613564e-04 1.73127909e-03 -2.63962849e-04] [ 2.32084705e-03 -5.44041411e-04 -4.56540782e-04] [-7.02840339e-04 -3.88025430e-04 -1.41723694e-04] [ 9.70504352e-04 -1.22625796e-03 6.44830578e-04] [-3.32471482e-03 -2.48236025e-03 -1.52033219e-04] [ 9.59109176e-05 1.01098013e-03 -1.44217961e-04] [ 2.40352133e-03 8.14077954e-04 1.08378663e-03] [ 4.83647439e-03 -3.12349431e-04 1.63916142e-03] [-8.79409314e-04 -8.13866489e-05 -1.86544723e-03] [ 1.45578046e-03 1.28683267e-04 2.06195711e-03] [-5.39616834e-05 3.44848433e-04 -7.13288429e-04] [ 1.13868272e-03 7.60824148e-04 6.64847535e-04] [-4.91346237e-04 -8.44503898e-05 -1.56374900e-03] [-9.27458410e-06 8.94444427e-04 1.44510138e-03] [-2.05010530e-03 -3.12657701e-03 -1.11666500e-03] [ 3.95196357e-04 3.72757930e-04 2.29698096e-04] [-1.14727822e-03 8.56383408e-04 -1.62654243e-04] [-1.73584821e-04 -2.68155362e-04 1.19525625e-03] [-1.12322392e-03 8.36597824e-04 -2.83877642e-04] [-1.04556383e-03 -4.81297855e-04 4.72847663e-05] [-2.65420472e-03 3.28873399e-03 -1.65800959e-03] [ 1.06305446e-03 -2.89364168e-05 -7.42608548e-04] [-2.10491931e-03 -5.11745151e-04 -4.40388575e-04] [ 5.85789546e-04 1.22476105e-03 -3.75195706e-04] [ 1.88886658e-03 -2.04725394e-03 4.08134450e-04] [ 1.88087381e-03 -1.43558375e-03 -4.34969768e-04] [ 1.28758425e-04 1.72564548e-04 -5.66856658e-04] [-1.88918749e-03 -8.48391317e-04 -1.17144364e-04] [ 1.32908323e-03 -1.14982313e-03 2.31923234e-03] [-7.39371580e-04 -1.49463276e-03 -4.03158816e-04] [-5.38076697e-04 1.36025559e-03 1.27160727e-03] [-2.08764485e-03 7.82821518e-04 4.62001335e-05] [ 4.81254922e-04 -6.28400283e-04 -5.01873920e-04]] Final stress: [-2.56683708e-04 1.83885564e-04 -9.42286060e-06 -2.58757517e-04 3.66463198e-04 -4.54292831e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 4.11805981e-05 -5.04340412e-04 -1.03635724e-05] [-2.65683942e-03 1.57036293e-03 -4.36502747e-04] [-1.00119209e-03 1.39187168e-03 2.15011170e-04] [ 7.69671972e-04 8.74310792e-04 -2.21703712e-04] [ 3.81261937e-04 -9.56465314e-04 -6.24155084e-05] [ 3.21350911e-03 1.87084982e-03 6.56685602e-04] [-8.05919658e-04 5.31506318e-04 -1.22265677e-03] [ 5.99988977e-04 4.46641949e-04 9.25660806e-04] [-1.26044167e-04 2.08377124e-04 -1.01505181e-03] [-9.54593363e-04 -1.15211509e-03 1.55859370e-03] [-1.38342302e-03 2.59947666e-04 -1.13491322e-03] [-1.22881570e-03 4.63833696e-04 7.57889797e-04] [-3.08703847e-03 1.38111602e-03 -1.57246041e-03] [-7.03843555e-04 3.58796189e-04 9.13167919e-04] [ 1.69641464e-03 1.09303703e-03 -3.49770907e-04] [ 1.07953502e-03 -3.63371350e-03 1.76610260e-03] [-2.12551619e-04 1.65457341e-03 -1.37431708e-03] [ 1.44042907e-03 -1.52661313e-03 5.47399987e-04] [-1.92844024e-03 -1.56105617e-03 6.80438296e-04] [ 5.17325613e-04 1.81492186e-03 -1.32580003e-03] [ 2.67655657e-03 -5.75662106e-04 -1.47102554e-03] [-3.33089831e-04 -1.86343273e-03 -1.12035741e-04] [ 9.56923251e-04 5.73735577e-04 9.75914113e-04] [ 1.52657758e-03 -2.37165552e-03 1.29382552e-03] [-6.94620469e-04 1.14669100e-04 6.54997637e-04] [ 1.30337168e-03 2.52561870e-05 -6.37410062e-04] [-1.55968524e-03 5.92672752e-04 5.10864942e-04] [-1.60117595e-03 1.78741141e-03 5.54961177e-04] [-1.32227810e-03 -7.22341798e-04 -9.86347100e-04] [ 8.55912234e-04 -7.96478330e-04 -2.79429230e-05] [ 1.34966211e-03 -8.11899118e-05 -2.58662134e-04] [-2.05912991e-04 -8.73113089e-04 1.31762368e-04] [ 1.19844714e-03 -4.48286072e-04 -3.93313484e-04] [ 1.78830063e-03 -1.48808423e-03 -4.61522764e-04] [ 6.96967419e-04 1.27453219e-03 8.27347054e-04] [-2.28657166e-03 2.66123686e-04 1.03592820e-04]] Final stress: [ 2.04165418e-04 -2.93620505e-04 -1.58111324e-05 2.36507165e-04 -3.61001682e-04 4.78806552e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 4.55465868e-04 1.17300495e-03 1.32698358e-04] [ 4.68881921e-03 -1.33077691e-03 7.71854689e-04] [ 1.11022464e-03 -1.31567068e-03 -4.01485911e-04] [-1.54044074e-03 -1.57523542e-03 3.34783215e-04] [-6.30729442e-04 2.92483398e-04 -1.95805236e-04] [-3.95041224e-03 -1.41133227e-03 -4.90561312e-04] [ 1.64632251e-03 7.25836656e-03 -2.52793212e-04] [ 3.43461167e-03 5.27939597e-04 -1.09643565e-03] [ 1.76570392e-03 6.91412560e-04 2.24388690e-03] [-1.87619277e-03 -1.56393467e-03 -2.14162797e-04] [-7.59738600e-03 -2.17859508e-03 9.67532723e-04] [ 4.09183724e-03 2.69693589e-03 -1.62985027e-03] [ 1.45772505e-03 9.15492287e-04 1.91777377e-04] [-8.63265527e-05 -2.22809632e-03 -2.47679343e-03] [-1.84571999e-03 9.65483410e-04 2.42830342e-03] [ 3.14363982e-03 -5.35373022e-04 -2.00122229e-03] [ 2.23724019e-04 -1.04436481e-03 1.26347536e-03] [-2.44110742e-03 -3.92398244e-04 5.76810472e-04] [-5.14089517e-03 9.13489787e-04 -1.07804605e-03] [-4.99992277e-03 -6.21420435e-03 9.44839769e-04] [-1.38295279e-03 4.98900287e-04 1.06207892e-03] [ 5.50830884e-03 -3.41410086e-03 -2.66092312e-03] [ 1.13095188e-03 2.78208814e-03 -2.07144617e-03] [ 4.59409875e-03 -1.67904130e-03 3.88367130e-03] [ 2.21468056e-03 1.20057101e-03 -7.91766177e-04] [-3.56389035e-04 6.09009454e-04 1.57391083e-03] [ 1.34202519e-04 1.48304957e-03 2.15399344e-04] [ 2.43521138e-03 1.74849739e-03 -1.69205870e-03] [-8.86219291e-04 3.34166860e-03 1.56171859e-03] [ 4.38669454e-05 1.01278303e-03 -1.76670291e-03] [-1.66801864e-03 -1.48048208e-03 -7.33371527e-04] [-1.96436185e-03 6.68262325e-05 1.05184967e-03] [-9.95683214e-04 -2.12587028e-04 2.68517270e-03] [-2.07114258e-03 3.30975909e-04 4.56452331e-04] [-1.31644865e-04 -2.37725041e-03 -4.02306092e-04] [ 1.48615054e-03 4.44465401e-04 -2.39048513e-03]] Final stress: [ 1.72192289e-04 -2.99301771e-04 -6.13713980e-06 -2.29383462e-04 -3.66481387e-04 -4.93850995e-04] Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 6.29611686e-04 -2.47263595e-03 1.82062707e-04] [-4.86234755e-03 6.23207384e-04 -7.82370258e-04] [ 8.07181989e-04 2.55408381e-03 4.05313786e-04] [ 2.89045505e-04 1.33355353e-03 -1.60910695e-04] [-6.69302694e-04 -1.61714322e-03 -1.40904735e-04] [ 5.20466044e-03 1.55899089e-04 6.90828003e-04] [ 2.93516096e-03 -2.26992660e-03 -2.48320469e-04] [-8.09076459e-03 2.15755092e-03 1.32907699e-03] [ 1.86572094e-03 6.10152242e-03 1.29435692e-03] [ 6.59641454e-03 -1.07148002e-03 -1.51540369e-03] [-6.86849507e-03 2.93009230e-03 -1.27643007e-03] [ 5.66610052e-03 -5.47496952e-03 5.99172004e-04] [-1.34416649e-02 1.25986699e-03 -6.17909376e-04] [ 1.36494824e-03 5.75042052e-03 -2.57351082e-04] [ 1.25808873e-02 -2.00637481e-03 -1.43254610e-03] [ 1.43483167e-02 -2.15809609e-03 3.66387867e-03] [-1.18636558e-03 -3.35882507e-03 1.36363875e-03] [-1.34968597e-02 1.24620171e-03 -2.81997642e-03] [-8.50787612e-04 1.46274196e-03 4.95262170e-03] [ 2.39245067e-03 5.27813378e-03 1.39277238e-03] [-8.84642314e-04 -3.88530345e-03 -5.74481168e-03] [-5.16563751e-03 1.08990987e-02 -1.67515207e-04] [ 8.37949641e-04 -1.05149433e-03 -6.16359756e-05] [-1.92496445e-03 -4.11648822e-03 -1.80968611e-04] [ 1.43071077e-03 1.95630096e-03 -9.99027190e-04] [ 1.19563982e-03 -2.26452347e-03 -1.68822154e-03] [-1.46590558e-03 -6.06910996e-06 -2.16551029e-03] [ 9.63771299e-05 -2.04867604e-03 -7.77431853e-04] [ 1.08747539e-03 2.40917864e-04 -9.58995294e-04] [ 8.91663074e-04 -1.09009086e-03 1.13981073e-03] [-3.50075822e-03 -3.55425712e-03 3.43005334e-03] [-7.32462037e-04 3.34237846e-04 -4.51914747e-04] [ 3.16271344e-03 -2.50827517e-03 4.35926167e-04] [-1.93776722e-03 -7.18401582e-04 4.91783098e-04] [ 2.30485204e-03 -2.05907396e-03 -1.04688996e-03] [-6.09155794e-04 -5.51725235e-04 2.12375001e-03]] Final stress: [-1.27238163e-04 -4.21128538e-05 -1.58694994e-05 -4.69984875e-04 2.07282369e-05 -9.11843615e-04] Minimization converged after 42 steps. Minimization converged after 45 steps. Minimization converged after 14 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 13 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 17 steps. Minimization converged after 12 steps. Minimization converged after 55 steps. Minimization converged after 54 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-0.00191654 0.00210008 0.00015988] [-0.00363204 0.00274433 -0.00071981] [ 0.00115698 0.00142184 0.00026587] [ 0.00081874 0.00157722 -0.00030187] [ 0.00195378 0.00189161 -0.0001389 ] [ 0.00491909 0.00090962 0.0007524 ] [-0.0018353 -0.00193378 -0.00181134] [ 0.00363152 0.0015125 -0.0003218 ] [ 0.00225034 -0.00364378 0.00239984] [-0.00207859 -0.00302015 -0.00053857] [ 0.00361788 -0.00175229 -0.00042824] [ 0.00283997 -0.00345081 0.00070039] [-0.00218176 0.0036875 -0.00318973] [ 0.00144795 -0.00067242 0.00058209] [ 0.00182255 0.00133965 0.00203685] [-0.00177545 -0.002725 0.00178759] [-0.00183371 0.0003455 -0.00063484] [-0.00040795 -0.00130308 -0.00040749] [-0.00382011 0.00289333 0.00300254] [ 0.00122029 0.00179424 -0.00059909] [-0.00099359 0.00012549 -0.00266247] [-0.00081211 -0.00150231 -0.00421565] [-0.00205336 0.00449124 0.00132933] [-0.00250693 0.00041412 0.00304312] [ 0.00040803 -0.00046067 -0.00092203] [-0.00211801 -0.0007698 -0.00360567] [ 0.00114151 0.00204749 0.00057643] [ 0.00127562 0.00072316 0.00073572] [-0.00122006 0.00194061 0.0001436 ] [ 0.00043372 -0.00296024 0.00238745] [-0.00209615 -0.00111425 -0.00019324] [ 0.0030591 -0.00293022 0.00136161] [ 0.00162101 -0.00020848 0.00041536] [-0.00384555 0.00157907 -0.00258374] [ 0.00236818 -0.00386053 0.00142406] [-0.00085903 -0.00123077 0.00017035]] Final stress: [ 7.05421898e-05 -8.32383229e-06 1.08881509e-03 1.37392160e-04 4.08545063e-05 3.04588711e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 0.00078055 0.00013794 -0.00013649] [ 0.00387296 -0.0026073 0.00075679] [ 0.00031357 -0.00142169 -0.00027344] [ 0.0011863 -0.00144485 0.00020014] [-0.00052127 0.00032599 0.00017033] [-0.00273944 -0.00373286 -0.00064121] [-0.00279929 -0.00107802 0.00076126] [-0.00891227 -0.00258158 -0.00460124] [-0.00014864 0.00279753 0.00190717] [-0.00242244 0.00757306 0.00115437] [ 0.01264492 0.002763 0.00345981] [-0.00365209 -0.00451539 -0.00243035] [-0.00898388 0.00186578 -0.00033393] [-0.00742963 -0.0085811 0.00202298] [ 0.01499802 0.01569984 0.00070381] [ 0.00011202 -0.00125878 0.00202842] [-0.00043983 -0.00214323 -0.00163049] [-0.00122475 -0.00287823 -0.00247908] [ 0.00186499 0.00010225 0.00246836] [ 0.0050543 0.00247323 0.00132567] [ 0.00769413 -0.00322762 -0.00412427] [ 0.00079654 -0.00419965 0.00139259] [-0.01168136 -0.0007881 0.00041366] [-0.00124683 0.01281733 -0.00144125] [-0.00301875 0.0027019 0.00224279] [ 0.00087673 0.00475735 0.00022102] [-0.00321433 -0.00129155 -0.00533758] [ 0.00103307 0.00069045 -0.00024373] [ 0.00159892 -0.0010935 0.00457533] [ 0.00175974 0.00448612 0.00280778] [ 0.00029517 -0.00537941 0.00112311] [-0.00024959 -0.00128438 -0.00012676] [ 0.00091661 -0.00317839 0.00521858] [ 0.00186228 -0.00299063 -0.00129045] [ 0.00064149 -0.0022146 -0.00694336] [ 0.00038213 -0.00130092 -0.00292032]] Final stress: [-4.26603902e-06 5.03554641e-05 1.09191243e-03 -1.38862445e-04 2.22069432e-05 -1.87230376e-04] Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 4.55138906e-03 6.24356197e-04 -9.08230223e-04] [ 4.12527813e-04 -2.21367965e-03 -1.00908488e-04] [ 3.14492335e-03 7.26972557e-04 3.18887959e-04] [ 1.43007300e-03 -4.31006464e-03 9.33858251e-04] [ 1.98326920e-03 4.61195933e-04 7.43707781e-05] [ 9.85510512e-04 -3.05104633e-03 -2.92444355e-04] [-4.72586959e-04 -3.76509464e-04 1.55666520e-03] [-1.93219066e-03 4.76488184e-03 -2.06700860e-03] [-2.58477936e-03 -1.18372379e-04 1.10493694e-03] [ 4.35410059e-03 -2.11666421e-03 -1.78964723e-03] [-9.27303833e-04 1.59388840e-03 2.42562271e-04] [-3.27273670e-03 -3.84052694e-04 9.66019343e-04] [-3.29606108e-03 3.91293984e-03 4.70273643e-04] [-1.12359269e-02 -2.37899102e-02 1.04784499e-03] [ 1.42927693e-02 2.28621108e-02 -2.05898849e-03] [-2.69397304e-03 2.22685208e-03 -7.52868552e-04] [ 6.34952237e-04 -4.91541705e-03 3.49044304e-03] [ 4.81644718e-04 6.55743038e-04 -2.14757700e-03] [-7.58376208e-04 3.31769384e-03 -1.51637646e-03] [ 5.49096040e-03 3.62243898e-03 3.48707746e-03] [-4.77271861e-03 -6.09727105e-03 -1.86519669e-03] [-5.13330588e-03 -6.10872721e-04 1.43439068e-03] [-3.06044553e-03 -1.02822754e-03 4.96992059e-04] [ 3.85987995e-03 1.99481111e-03 -2.03208384e-03] [ 4.64191496e-03 2.96599479e-04 6.72045681e-04] [-1.44227192e-03 3.41674553e-03 -5.91080671e-04] [ 5.85249179e-04 -2.59097971e-03 -3.38809246e-03] [-7.55926651e-04 -2.76030740e-03 -2.13049411e-03] [-5.89141921e-03 1.84826989e-04 2.11485672e-03] [ 7.80548406e-04 2.28190120e-03 2.00421645e-03] [-1.87837105e-03 2.81568312e-03 2.79544865e-03] [ 2.46195165e-03 1.15332652e-03 3.94057015e-05] [-5.89258274e-04 3.68147985e-03 2.60305297e-04] [-5.15273975e-05 -7.26100726e-04 -1.66690928e-03] [ 2.35882831e-03 -2.71213091e-03 -1.80324267e-03] [-1.70131334e-03 -2.79284059e-03 1.60054799e-03]] Final stress: [-7.98557734e-05 1.55801348e-04 3.77028088e-05 2.50094735e-04 2.20756386e-04 1.47518169e-04] Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 49 steps. Minimization converged after 53 steps. Minimization converged after 53 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.02302262e-03 4.75695134e-03 -1.16521789e-03] [ 6.09537434e-03 -6.24839689e-03 2.23887664e-03] [ 5.67969483e-03 -3.69392926e-03 1.84303162e-05] [-5.01248487e-03 -2.53116172e-03 -2.27632603e-04] [ 1.28880918e-03 4.69650917e-03 1.06367835e-03] [-6.62673621e-03 -6.98670004e-03 -2.33412112e-03] [ 1.65052904e-02 1.50188073e-02 3.41638608e-03] [-2.60601135e-02 6.31572020e-03 8.75127446e-04] [-6.81804931e-03 -1.96140667e-02 -4.05492356e-03] [ 3.77815291e-03 1.25083511e-02 -1.01820051e-03] [-3.52720022e-02 8.45367031e-04 3.11065600e-04] [ 2.89414381e-03 -5.94033154e-03 1.38728671e-03] [-4.05829536e-02 4.04263643e-03 -1.31226818e-03] [-4.60884700e-03 -5.78615310e-03 -3.81961255e-04] [ 4.50448794e-02 1.15772198e-02 1.43546258e-03] [-3.83729127e-03 4.91995659e-03 -3.35957111e-03] [ 5.58729312e-03 7.21891496e-03 3.64244977e-04] [-1.46730774e-03 -5.08738490e-03 2.42153477e-03] [ 2.44428026e-02 -4.21624895e-03 1.85260779e-04] [-1.46383704e-02 -1.14964745e-02 4.30627718e-05] [ 5.14827068e-03 -5.56591070e-03 -2.84264865e-04] [ 1.31941576e-02 2.07085741e-02 -3.23941988e-04] [ 1.82731144e-02 -8.99069463e-03 -6.58335043e-04] [-2.60790877e-03 -2.58561247e-02 8.82519691e-04] [-4.82488239e-03 7.28029564e-03 -4.08661532e-03] [ 3.85902208e-03 3.18781839e-03 3.97724264e-03] [ 2.02750839e-03 1.81468486e-03 1.29386893e-04] [-1.38683690e-03 2.23351109e-03 1.14884956e-03] [ 4.54338677e-03 7.41180287e-03 2.63774753e-03] [-3.14749534e-03 2.62205756e-03 -3.19917492e-03] [ 6.27402421e-03 -3.64489401e-03 -1.52822520e-03] [-7.42195403e-03 1.59289305e-03 -1.13104153e-03] [-1.28490993e-03 -2.86266087e-04 5.94817306e-04] [ 1.59181989e-03 -9.68835773e-04 -9.17465891e-04] [-6.30067858e-03 -2.96618761e-03 1.29550212e-03] [ 6.69410000e-03 1.12768954e-03 1.55647823e-03]] Final stress: [-2.26438017e-05 -3.94347582e-04 -7.22240694e-05 4.72702023e-06 -4.60067808e-04 -2.33212308e-04] Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-5.16690231e-05 -1.18175308e-03 1.34391548e-04] [-4.30221429e-03 1.03476352e-03 -6.25161582e-04] [ 5.28889754e-05 2.02622618e-03 3.10612909e-04] [-1.14796761e-03 1.71892184e-03 -2.87794119e-04] [-3.09547008e-04 -2.08129894e-03 -1.32051052e-04] [ 4.91533714e-03 1.83012249e-03 8.20799409e-04] [ 2.42684588e-03 -2.02673910e-03 -5.61040214e-04] [-1.44704928e-04 2.65175617e-03 -4.15597940e-04] [-1.01885597e-03 1.06148306e-03 2.24052312e-03] [ 1.05854592e-03 -2.59743664e-04 -1.79178654e-03] [-1.96819918e-04 9.59087524e-04 -1.73931029e-04] [ 1.42446235e-03 -1.08762523e-03 7.00722429e-04] [ 7.91502871e-04 -9.90708035e-04 3.50172320e-03] [-3.79110646e-05 2.49420260e-03 -1.16679358e-03] [ 2.43996644e-03 1.31424268e-03 -1.48470996e-03] [ 3.23672320e-03 -6.67000054e-03 8.27689891e-04] [-3.23325242e-03 7.02357309e-03 -1.28920973e-05] [-1.70767355e-03 -2.12953489e-03 -1.71803755e-03] [ 1.73538920e-03 1.04077353e-03 6.54194604e-03] [ 1.21370321e-03 -3.89940543e-04 -1.13628511e-03] [ 3.76153204e-04 6.92784369e-04 -2.33268870e-03] [-1.95858630e-03 1.81340380e-03 -9.21577776e-04] [ 1.25315130e-03 4.66398653e-03 -3.09216193e-04] [ 1.82117812e-04 -7.91013889e-04 -1.70393638e-03] [-4.34059494e-03 -3.18432115e-03 1.91627628e-03] [ 7.82422254e-04 1.60614869e-03 -2.41102471e-03] [-6.44491887e-04 -1.52750084e-03 -1.13422073e-03] [ 3.26356100e-03 1.06201142e-03 -1.09059954e-03] [ 2.09640981e-03 -2.93138909e-03 -4.47714064e-03] [-2.50879509e-03 -7.35301657e-04 3.53213304e-03] [ 9.94689253e-04 2.52983447e-04 2.70737459e-03] [-7.34001516e-05 -1.94979443e-03 -3.46123145e-03] [ 4.52855638e-04 -1.39635797e-03 1.04676781e-03] [-5.75729424e-03 -4.51002300e-03 3.32939824e-03] [-3.73744896e-04 -5.98496582e-05 -8.37386558e-05] [-8.89202186e-04 6.56424761e-04 -1.78902955e-04]] Final stress: [-2.92469134e-05 -1.41550905e-04 -1.03068072e-05 3.08138143e-04 2.70918380e-05 5.76116473e-04] Minimization converged after 53 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 15 steps. Minimization converged after 44 steps. Minimization converged after 49 steps. Minimization converged after 13 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 53 steps. Minimization converged after 51 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 39 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 51 steps. Minimization converged after 58 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 21 steps. Minimization converged after 12 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 51 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 49 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 52 steps. Minimization converged after 54 steps. Minimization converged after 50 steps. Minimization converged after 49 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 11 steps. Minimization converged after 42 steps. Minimization converged after 46 steps. Minimization converged after 12 steps. Minimization converged after 40 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 4.15876349e-03 9.46092314e-04 -8.54837593e-04] [ 1.13721862e-03 -6.85393060e-04 9.84632143e-05] [ 4.54594967e-04 6.02303120e-04 1.80252008e-04] [ 2.01679351e-03 -3.89545441e-03 7.89722469e-04] [ 1.46055275e-03 -2.88134038e-04 -9.46794594e-05] [ 1.02698908e-05 -1.00975210e-03 -1.56801484e-04] [ 7.21861108e-04 2.75966687e-03 -1.54678494e-04] [-2.84003598e-03 9.43565567e-04 -4.47103062e-04] [ 2.36644352e-03 -2.56538609e-03 9.43870532e-04] [ 1.65113858e-03 2.25311855e-03 2.83397713e-04] [-5.86611202e-03 -7.84366958e-04 5.21019106e-04] [ 3.11198738e-04 -3.02297726e-03 -8.59582155e-04] [-2.78245852e-03 3.18096196e-03 -2.84223183e-03] [ 6.93963440e-04 -1.14322225e-03 1.47130545e-03] [-1.27616207e-03 3.79062447e-04 1.96422325e-03] [ 6.60165222e-04 6.24203609e-05 1.16400952e-03] [ 7.96986827e-05 -1.19596527e-03 7.73525053e-04] [-1.88289288e-04 -1.34998616e-04 -2.51178232e-03] [-4.12946166e-03 3.58972828e-03 -2.56236894e-04] [-3.41326775e-03 -2.80913575e-03 1.08496862e-03] [ 4.77517196e-03 2.22477951e-03 2.97608125e-04] [-3.11931001e-03 4.24254700e-03 -4.50340187e-04] [-1.43903453e-03 -7.36564249e-03 1.26515115e-03] [ 4.03774145e-03 3.24493317e-04 -1.85394778e-03] [-1.30275865e-03 1.67930982e-03 -1.08550047e-03] [ 2.70404411e-03 -1.25629026e-03 -2.25562067e-04] [ 9.35656527e-04 -1.38768678e-03 6.51832565e-04] [-1.47956086e-04 4.87823761e-03 -2.75222561e-03] [-1.82940147e-03 2.30991090e-03 8.19814572e-04] [-1.04649843e-03 -9.47270811e-04 1.65259317e-03] [-8.28440379e-04 -5.77888006e-05 1.22271192e-03] [-2.60313812e-03 1.09873003e-03 3.39516757e-05] [-2.50514752e-04 1.70684516e-03 -1.55022903e-03] [-2.80856111e-04 -3.11903876e-03 1.27156916e-03] [ 2.70934160e-03 -1.28124476e-03 -4.93589542e-04] [ 2.45907766e-03 -2.32024344e-04 9.93386836e-05]] Final stress: [ 2.35156736e-04 1.36621295e-04 8.46265744e-06 9.75221545e-05 -6.82385030e-05 4.76450068e-05] Minimization converged after 57 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 48 steps. Minimization converged after 52 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 50 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 55 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 50 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 55 steps. Minimization converged after 52 steps. Minimization converged after 47 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 9 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 11 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 48 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 43 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 47 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 53 steps. Minimization converged after 50 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 9 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 10 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 40 steps. Minimization converged after 10 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 11 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 34 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 33 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 8 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 11 steps. Minimization converged after 34 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 8 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 10 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 30 steps. Minimization converged after 33 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 10 steps. Minimization converged after 6 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 10 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 8 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 34 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 32 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.72932 0.41797 0.07811 0. -0.07959 0. ] [ 0.41797 0.72928 0.07811 -0. 0.07959 -0. ] [ 0.07811 0.07811 1.13898 -0. 0. 0. ] [ 0. -0. -0. 0.12319 -0. 0.07959] [-0.07959 0.07959 0. -0. 0.12319 0. ] [ 0. -0. 0. 0.07959 0. 0.15564]] 95%% Error estimate [ASE units]: [[0.00103 0.0002 0.00022 0. 0.00001 0. ] [0.0002 0.00079 0.00001 0. 0. 0. ] [0.00022 0.00001 0. 0. 0. 0. ] [0. 0. 0. 0. 0. 0.00001] [0.00001 0. 0. 0. 0. 0. ] [0. 0. 0. 0.00001 0. 0. ]] Maximum deviation from material symmetry [ASE units]: 0.079591 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.138978 [ASE units] and requested fractional tolerance 0.010000. Unable to compute elastic constants with method energy-condensed, escalating to method stress-condensed Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 32 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 33 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 32 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 31 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 34 steps. Minimization converged after 38 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 14 steps. Minimization converged after 22 steps. Minimization converged after 14 steps. Minimization converged after 29 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 18 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.72876 0.4193 0.0813 -0.00001 -0.07765 0.00001] [ 0.4193 0.72357 0.08162 0.00001 0.07764 0.00003] [ 0.0813 0.08162 1.13927 0. 0.00004 -0. ] [-0.00001 0.00001 0. 0.12341 -0. 0.07814] [-0.07765 0.07764 0.00004 -0. 0.12317 0.00001] [ 0.00001 0.00003 -0. 0.07814 0.00001 0.15433]] 95%% Error estimate [ASE units]: [[0.0037 0.0119 0.00284 0.00001 0.00446 0.00113] [0.0119 0.0093 0.00248 0.00012 0.00433 0.00145] [0.00284 0.00248 0.00042 0. 0.00021 0.00033] [0.00001 0.00012 0. 0.00216 0. 0.0026 ] [0.00446 0.00433 0.00021 0. 0.0004 0.00008] [0.00113 0.00145 0.00033 0.0026 0.00008 0.0052 ]] Maximum deviation from material symmetry [ASE units]: 0.078137 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.139271 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 43 steps. Minimization converged after 17 steps. Minimization converged after 11 steps. Minimization converged after 49 steps. Minimization converged after 50 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 53 steps. Minimization converged after 53 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 53 steps. Minimization converged after 53 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 51 steps. Minimization converged after 53 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 31 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 32 steps. Minimization converged after 25 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 19 steps. Minimization converged after 25 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 27 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.72848 0.41826 0.07801 -0.00003 -0.07952 0.00001] [ 0.41826 0.74797 0.07799 -0.00003 0.07927 -0.00004] [ 0.07801 0.07799 1.13908 0. 0.00002 0.00001] [-0.00003 -0.00003 0. 0.12319 0. 0.07961] [-0.07952 0.07927 0.00002 0. 0.12319 -0.00001] [ 0.00001 -0.00004 0.00001 0.07961 -0.00001 0.15565]] 95%% Error estimate [ASE units]: [[0.00125 0.00271 0.00145 0.00015 0.00058 0.00022] [0.00271 0.00443 0.00106 0.00016 0.0005 0.00026] [0.00145 0.00106 0.00023 0.00003 0.0001 0.00002] [0.00015 0.00016 0.00003 0.00005 0.00002 0.00011] [0.00058 0.0005 0.0001 0.00002 0.00003 0.00005] [0.00022 0.00026 0.00002 0.00011 0.00005 0.00057]] Maximum deviation from material symmetry [ASE units]: 0.079609 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.139082 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[-0.26883151 0.43404035 -0.00247645] [ 0.54935051 0.52082615 0.03316017] [-0.26871584 -0.12878997 -0.00878581] [ 0.32303318 -0.13774153 0.01103745] [ 0.27181301 0.4481335 0.00377955] [-0.54550745 0.49573626 -0.03408282] [ 0.12802064 -0.20134665 -0.06299371] [-0.12159818 0.08198892 -0.01418345] [-0.05675381 0.25958335 0.01425438] [ 0.00449012 -0.37385577 -0.09174847] [-0.01134489 0.31474349 -0.01753036] [-0.15756031 -0.15392166 0.04276029] [-0.03426585 0.17486836 -0.18318787] [ 0.00586372 -0.16251741 0.0114371 ] [ 0.02214351 0.13979982 0.14271166] [ 0.20388264 0.10048975 -0.25465925] [-0.00709601 0.01246821 -0.00978859] [-0.22047457 0.07781218 0.23301091] [-0.21972884 -0.08284315 -0.12199545] [-0.00984284 -0.10589149 0.04252028] [ 0.21567071 0.03659701 0.07738471] [ 0.21381186 -0.06382721 -0.12663697] [ 0.01529369 -0.02010033 0.02892378] [-0.12754413 0.09051709 0.08920748] [ 0.03150715 -0.28786877 -0.1259057 ] [-0.11748 -0.08958993 0.01073472] [ 0.10071309 -0.23386181 0.19081145] [-0.09721946 -0.20482509 -0.20137966] [ 0.00083069 -0.29894712 0.18071944] [ 0.1371679 -0.02320338 0.0404291 ] [ 0.00395299 -0.04323841 -0.10016769] [-0.21416246 -0.06771066 0.01275462] [ 0.29684613 -0.21188993 0.1827748 ] [-0.29540405 -0.19744331 -0.16102333] [-0.00450218 -0.05668057 0.12877717] [ 0.25364085 -0.0415103 0.0393565 ]] Final stress: [ 4.04489800e-03 4.73166934e-03 1.70785549e-03 3.69056379e-05 -1.02401803e-03 4.74203395e-04] Minimization converged after 49 steps. Minimization converged after 45 steps. Minimization converged after 50 steps. Minimization converged after 17 steps. Minimization converged after 12 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 1.00040093e-02 7.14061392e-03 -2.27617176e-03] [ 9.30611775e-03 -1.21909728e-02 1.83339971e-03] [ 1.47757127e-02 -1.27919641e-02 -2.02351604e-03] [-1.47617178e-02 4.55477986e-03 -1.19583631e-03] [ 2.92569778e-03 4.22444989e-03 -1.15146733e-04] [-1.95241260e-02 -1.34997425e-02 -4.71966241e-03] [-7.70474058e-03 1.87522503e-03 5.02856051e-03] [-3.62999708e-03 -5.22274931e-03 -1.52997661e-03] [-1.93235126e-03 7.32125211e-03 -1.25929829e-03] [ 4.54084097e-03 -4.36860100e-03 -1.98959941e-03] [ 9.37431785e-03 -5.86464021e-03 2.92539188e-03] [ 2.72617027e-03 -1.35174449e-02 9.14820890e-04] [-9.26631208e-03 6.79218270e-03 -8.73626124e-03] [-2.97303413e-03 -1.11024092e-02 6.49586219e-03] [ 1.03644878e-02 7.57946397e-03 3.23308100e-03] [ 2.68356144e-03 2.04783318e-02 -3.90156276e-03] [ 6.08533757e-03 -6.16337281e-03 2.33222162e-03] [-3.96221562e-03 7.98078240e-03 4.34867598e-03] [-4.10939907e-03 -2.65521456e-03 -1.03064327e-02] [-4.06059283e-03 1.17849502e-03 1.14436046e-03] [-6.32297653e-03 2.57971726e-03 7.17408231e-03] [-9.55549638e-03 8.52058405e-03 -2.75464246e-03] [ 1.17916268e-03 -9.23433066e-03 1.96909913e-03] [ 2.45843610e-03 2.18073024e-03 -2.21042479e-05] [-6.39613821e-03 3.45980460e-03 -4.25472505e-03] [-1.51891110e-02 9.04784098e-03 5.00516810e-03] [ 6.26049428e-03 -2.04357240e-03 -3.70597550e-03] [-4.36508223e-03 -2.64671997e-04 1.86718148e-03] [-2.29709655e-03 -3.06591864e-04 5.35878559e-03] [ 1.55411713e-02 6.79532661e-03 -9.10187588e-04] [ 8.98866256e-03 1.84091330e-03 -4.26782698e-03] [-7.78831713e-03 1.60044266e-03 9.50890360e-03] [ 2.24774352e-03 -2.72025720e-05 -3.19760098e-03] [ 3.34185685e-03 -7.52777605e-03 1.38475527e-03] [-4.54553604e-04 -1.20670757e-03 3.00112026e-03] [ 1.14894773e-02 2.83702809e-03 -6.35894298e-03]] Final stress: [-1.46527077e-04 1.92558813e-04 1.51032185e-05 2.45776001e-03 -7.46975328e-05 1.65397150e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 2.51263860e-03 2.43842413e-04 -6.94296225e-05] [-1.50503011e-03 7.51151519e-05 -2.56236156e-04] [-1.48050112e-04 2.95504174e-03 7.08422734e-04] [ 2.53466406e-04 3.25896894e-04 -8.58223372e-05] [ 3.03352151e-03 -3.01082835e-03 -1.04059068e-03] [ 2.78991833e-04 -7.00963716e-04 -9.62547545e-05] [ 8.46925121e-04 -3.26039102e-04 -7.48710984e-04] [-3.37487819e-03 -3.42356796e-04 3.34564303e-04] [ 5.86368489e-04 1.03432052e-03 7.59604182e-04] [ 2.60425108e-04 -1.45340066e-03 1.61675839e-04] [ 8.55929582e-04 -2.25491998e-03 -2.94828518e-04] [-1.33495335e-03 -7.73847568e-05 2.72656991e-04] [ 1.41984182e-03 -7.34533924e-04 8.62618348e-04] [-1.40319536e-03 -2.08446770e-04 1.98563909e-03] [-2.31993669e-03 2.91343588e-04 -7.10926389e-04] [ 1.31999061e-03 3.31786034e-04 -1.01805455e-04] [ 1.02914259e-04 5.03728824e-04 -1.28940084e-03] [ 3.21654678e-04 2.31492298e-05 -3.90094591e-04] [ 1.28211449e-05 3.10414115e-03 1.58650443e-03] [-3.11836219e-03 6.40780247e-04 6.61478302e-04] [-1.32112942e-04 4.15689908e-03 -6.01152059e-05] [ 3.35476169e-04 -1.83256967e-03 -4.37387340e-04] [ 1.97898952e-03 2.76780433e-03 -5.85770615e-04] [ 9.55445513e-04 -8.76570421e-04 -1.33457273e-03] [-1.00900848e-03 6.47159623e-04 8.56816684e-04] [-9.49464621e-04 -1.25195301e-03 3.24124667e-04] [ 1.22352169e-04 1.51031634e-04 -1.38772887e-03] [-6.33356666e-04 8.19387684e-04 1.84226370e-04] [ 3.82913561e-05 -1.91498006e-03 -8.80264612e-04] [-1.94882246e-03 -1.21464037e-03 -8.68154518e-04] [-1.50613031e-04 -4.61405625e-05 1.73554875e-05] [ 1.37471874e-03 -1.06582152e-03 -1.55483494e-03] [ 1.60215342e-03 6.94166305e-04 1.41904546e-03] [-9.56337790e-04 -9.78131523e-04 -7.08512917e-04] [-2.59566273e-04 1.42399185e-03 9.82020874e-04] [ 1.03077222e-03 -1.89990511e-03 1.78468831e-03]] Final stress: [-6.52908721e-05 -3.58447171e-05 3.51186556e-05 -2.45240103e-03 8.68172879e-06 -1.54079887e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[-1.48589067e-03 -2.76757673e-03 5.28882429e-04] [-6.45179617e-03 -4.07097450e-03 -5.32987689e-04] [ 9.13831480e-04 2.40021145e-03 4.45330325e-04] [-5.77991418e-03 -2.42102609e-03 3.47538906e-04] [ 1.10987535e-03 -2.43846327e-03 -4.14778421e-04] [ 5.52908832e-03 -8.58041852e-04 5.87459930e-04] [-3.85433847e-04 -1.93627390e-03 -2.15609122e-03] [-3.57314529e-04 1.43842281e-03 -1.16642697e-04] [ 8.93158006e-04 -7.10846830e-05 2.40599431e-03] [-1.41760543e-04 2.16495374e-03 -2.24802698e-03] [ 3.04194980e-04 1.29375938e-03 3.39172786e-05] [ 2.72551366e-04 1.68953790e-03 2.59699422e-03] [-1.97755828e-04 7.83071740e-04 2.42801946e-03] [-3.33725620e-05 -5.62117952e-04 -2.16291323e-04] [ 1.28173588e-03 2.22693024e-03 -2.11254164e-03] [-6.11390296e-03 1.05617082e-03 1.53390462e-03] [ 1.40248961e-04 -3.12362133e-04 5.21047981e-04] [ 6.51619188e-03 2.74194334e-03 -1.23665089e-03] [-5.07721468e-04 1.25252313e-03 1.12661193e-03] [-2.40580645e-03 1.71431898e-03 1.88886293e-03] [-2.18781272e-03 2.12621055e-03 -1.44859802e-03] [-4.27438898e-04 4.30778593e-05 3.80191669e-03] [-5.86207038e-04 1.95058406e-03 -1.28156108e-03] [ 1.54980429e-03 1.38315055e-03 -3.03074584e-03] [ 9.45821405e-04 6.22047015e-05 1.95769783e-03] [-3.72998107e-03 -1.26788416e-04 -2.86107967e-03] [ 1.99113707e-03 -9.64392528e-04 -2.06039497e-03] [ 7.59988713e-04 -1.18467734e-03 -1.16361276e-04] [ 7.35810055e-04 1.07566557e-03 -9.06497387e-04] [ 4.00903013e-03 1.92007557e-05 9.10234334e-04] [-2.05602308e-04 1.81821195e-03 1.79011463e-03] [ 3.65475979e-04 8.42228028e-04 -2.95853210e-03] [ 3.26689649e-03 -4.83606786e-03 3.47006947e-04] [-3.83760676e-03 -5.02277374e-03 2.32761168e-04] [ 5.40711437e-04 6.01571469e-04 -1.90091676e-03] [ 3.70976623e-03 -1.11132802e-03 2.11440204e-03]] Final stress: [-1.52248278e-03 1.50756525e-03 4.19309982e-05 9.18154149e-06 2.45509040e-03 -6.06031467e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.68017472e-03 1.20858633e-04 3.65866620e-04] [-4.01923331e-03 3.43233339e-03 -7.88954369e-04] [ 2.47091464e-03 1.38325788e-03 -6.45567226e-04] [ 1.84836179e-03 9.30317899e-04 -8.89253434e-05] [ 1.39269795e-03 9.09095331e-04 -3.39582045e-04] [ 4.38821890e-03 5.55372627e-05 1.34011916e-03] [-5.24769485e-03 8.41487713e-04 2.08382121e-03] [-3.41536297e-04 6.29433042e-03 -2.89440843e-03] [ 6.48123208e-04 -4.87443454e-04 7.91777177e-05] [-1.47862846e-03 2.76938267e-03 1.51022818e-03] [-1.40331378e-03 6.74612053e-03 -4.79749042e-04] [-1.52235166e-03 2.15663882e-03 -5.65251069e-04] [ 3.35412211e-03 -6.02179574e-03 -9.56380871e-04] [ 9.84112423e-04 7.94083388e-03 1.65555792e-03] [ 1.19775545e-03 -4.23624642e-03 -4.43484776e-04] [-1.85058192e-03 2.66980633e-04 -6.53618854e-05] [-2.17699985e-03 -3.71309305e-03 1.55521043e-04] [ 1.58325277e-05 5.18985945e-04 -1.17122486e-03] [-2.12224762e-03 2.26801551e-03 -1.20182661e-03] [ 3.02064209e-03 -8.30545739e-04 2.84397606e-03] [ 5.64161637e-04 -1.97445430e-03 -1.45360985e-03] [-8.10610336e-03 8.73231343e-03 5.44550014e-05] [ 6.75438465e-03 -2.81035628e-03 -3.73613241e-04] [-1.02082897e-02 -9.96071750e-03 2.69984662e-04] [-1.60269386e-03 -1.06832102e-03 9.24318006e-04] [ 4.20480312e-04 -8.40568465e-04 1.60151927e-03] [-7.48294939e-04 -2.63240218e-03 -2.62026871e-03] [ 1.00939397e-03 9.41625542e-05 4.62813506e-04] [ 1.15552164e-03 -2.32785258e-03 1.59213746e-03] [ 2.08088494e-03 -3.56764286e-04 -3.65537687e-04] [ 1.16006186e-03 -2.63096863e-03 -4.32067067e-04] [-8.39607332e-04 -1.25428360e-03 2.54169482e-03] [ 1.61119281e-03 -4.37701023e-03 -2.64209812e-03] [ 2.24157912e-03 -1.05843628e-04 -2.57119285e-04] [ 1.14756890e-03 -4.35843510e-04 -2.79423198e-05] [ 5.88174069e-03 6.03858124e-04 3.31782189e-04]] Final stress: [ 1.51562106e-03 -1.58483076e-03 2.76891819e-05 1.19306104e-05 -2.44549042e-03 -3.33850261e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 7.43909236e-03 7.31425967e-04 -1.43639343e-03] [ 9.19963947e-04 -1.60357424e-03 6.48439635e-05] [-2.03749941e-04 1.05514401e-03 1.25856096e-04] [ 2.29947588e-04 -3.23388456e-03 7.21674872e-04] [ 1.16015443e-03 -1.45930546e-03 -1.35001906e-04] [-6.68991706e-04 -6.83429912e-04 -1.65601796e-04] [-5.01368854e-04 4.13786959e-03 -4.66260811e-03] [-2.29715102e-02 1.65874333e-04 8.17494835e-04] [ 2.27846655e-03 -8.09647985e-04 2.18005130e-03] [-1.49452118e-03 -1.14034150e-02 1.34321991e-03] [ 1.85472539e-02 2.74677697e-03 1.00143342e-03] [-3.88515428e-03 3.08973839e-04 -6.04916240e-04] [-3.03829435e-04 2.64708412e-03 2.82545436e-03] [ 3.92265164e-04 -2.38987763e-03 -1.09862197e-03] [-6.40380115e-04 9.91112025e-05 -3.10918212e-03] [-4.41794411e-03 2.80000085e-04 -8.23565809e-06] [-5.29164507e-04 -1.96619861e-03 -4.40839116e-04] [ 1.78350675e-03 -4.51605077e-04 1.36685944e-03] [ 1.26383306e-02 1.36278886e-03 5.23280229e-04] [ 1.30678829e-03 -3.04132924e-03 1.64864965e-03] [ 5.17444559e-03 -5.05332363e-03 -4.37593073e-03] [-1.02114391e-02 -3.00177232e-03 1.01080014e-03] [-2.71877360e-03 2.29394291e-03 -2.04030599e-03] [-2.04410403e-03 9.45707234e-03 3.56589455e-03] [-8.67961720e-04 8.07452247e-04 7.07280705e-04] [-5.60731459e-04 3.13392638e-04 2.72307907e-03] [-1.66105541e-03 1.10571691e-03 1.12760554e-03] [-2.12488020e-03 -3.43472634e-04 -1.01919628e-03] [ 2.19281519e-03 1.52524054e-03 3.12535252e-03] [ 1.70741314e-03 3.92003724e-03 -2.81887140e-03] [ 4.16696329e-04 -1.20110159e-03 5.62444488e-04] [ 8.08553893e-05 3.48817949e-03 -4.52675050e-03] [ 3.35959521e-03 2.64081237e-05 1.71613887e-04] [ 2.41371756e-03 7.29660316e-05 1.47237074e-03] [-3.43504761e-03 1.30841128e-03 -3.76963641e-03] [-2.80070066e-03 -1.21193086e-03 3.12683196e-03]] Final stress: [-1.76937135e-04 -2.05216999e-04 -8.88907459e-05 1.57321831e-03 1.89002507e-05 3.04596425e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-0.01499422 -0.04618182 0.00420128] [-0.0959025 0.02060664 -0.01686628] [ 0.0019316 -0.02711483 -0.00786779] [ 0.01257769 0.03555905 -0.00543998] [-0.0896526 0.03061834 0.01835547] [ 0.0225855 -0.02581709 0.00275859] [ 0.04996966 -0.10097946 -0.01493347] [-0.0978611 0.003815 -0.00612609] [ 0.00277635 -0.0240835 0.04226621] [ 0.09755038 0.08947666 0.0208014 ] [ 0.16131007 -0.13455576 0.00065734] [-0.01332788 0.02678166 -0.04403714] [-0.04453168 0.01830302 0.01457028] [-0.00962897 0.00975341 0.01002627] [ 0.09471953 0.03817118 -0.06773225] [ 0.00475126 -0.0111084 0.01734375] [-0.01242739 -0.06572942 -0.00349086] [ 0.01466547 0.02597414 0.02860327] [ 0.07128514 0.01345552 0.00909549] [-0.01989923 0.16266234 0.02668263] [ 0.00125246 0.06141547 -0.07241281] [-0.11861464 0.0543551 0.05004882] [-0.07867061 -0.05656001 -0.00314551] [-0.05206931 0.06880574 -0.00961175] [ 0.0141907 -0.01165698 0.05719773] [ 0.04245379 -0.0082975 -0.0335137 ] [-0.02673824 -0.01162498 -0.05278406] [ 0.00777667 -0.05844528 0.04080725] [ 0.01844864 -0.04197198 -0.03546704] [ 0.00857275 0.00802397 -0.00441472] [-0.02859117 -0.01697027 -0.02798435] [-0.02651073 -0.0337053 0.02358874] [ 0.03938194 -0.03105444 0.03989828] [ 0.00519471 0.03003257 -0.03410495] [ 0.04126908 0.02354719 -0.00282713] [ 0.01675687 -0.01549998 0.03585705]] Final stress: [ 0.00034363 0.00112992 0.00038917 -0.00151547 0.00073862 -0.00243528] Minimization converged after 44 steps. Minimization converged after 50 steps. Minimization converged after 42 steps. Minimization converged after 50 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.16183748e-02 9.53970405e-02 -4.15745733e-02] [ 3.96660136e-02 3.85696813e-02 -2.65135686e-02] [-3.77523520e-02 -7.90510071e-04 -2.07185702e-02] [ 1.89147318e-01 1.82735314e-02 -1.60949800e-02] [-7.09387648e-02 -1.03632199e-01 4.67768753e-03] [ 2.03721873e-02 -3.32700491e-02 -3.25840749e-02] [ 3.93522245e-02 -6.11765860e-02 3.18549290e-02] [ 2.09805461e-01 9.52574411e-02 -2.93982512e-02] [-1.65804187e-01 8.58271597e-02 1.20165506e-01] [ 6.60869789e-01 5.40454545e-01 -5.93991798e-02] [-7.42167810e-01 2.39013363e-01 1.62781339e-02] [ 1.52939593e-01 -5.74701757e-01 -3.11501872e-03] [-1.42242353e-02 3.01733317e-02 9.78273066e-02] [ 4.79775775e-03 -2.03833744e-02 5.95502549e-02] [ 7.51386498e-02 6.00671971e-02 3.65443416e-02] [-1.47210143e-01 5.24498839e-02 2.31752464e-02] [ 6.79315468e-02 5.68408176e-02 7.10054676e-02] [ 5.31912236e-02 -4.31605615e-02 -4.49742903e-02] [ 8.53105506e-01 -1.92644551e-01 -8.98534027e-02] [-2.04044930e-01 6.99225805e-01 -1.18144768e-01] [-7.98609342e-01 -6.87920921e-01 -3.97611961e-02] [ 9.62288488e-02 2.47931791e-01 3.16434721e-02] [-1.21048069e-01 1.32344232e-01 4.06794550e-03] [-2.34484518e-02 -6.44231033e-01 9.55450281e-02] [-1.65724268e-02 9.27469333e-02 3.11165833e-02] [-6.17461672e-02 -1.19720605e-02 -8.00134488e-03] [ 1.72116612e-02 -1.53462555e-02 1.15049091e-01] [-6.58690021e-02 -7.88193771e-03 1.08985465e-03] [ 8.70371882e-02 -1.77900296e-01 -6.84981939e-03] [ 1.70619526e-02 2.96764767e-02 7.48150208e-02] [ 1.19319182e-01 7.83177189e-02 -3.84299862e-02] [-1.72888939e-01 -5.40860562e-02 -1.06835377e-01] [-3.93552655e-03 3.93543369e-02 -4.40630697e-02] [-6.14242371e-02 2.83689154e-02 -3.53100152e-02] [-2.16361829e-02 4.79537670e-02 -6.83544096e-02] [ 4.52628748e-03 -7.91458182e-02 1.55700279e-02]] Final stress: [ 3.19681403e-02 3.30256920e-02 1.41021512e-02 1.36931033e-03 -1.60077821e-05 5.06327435e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 2.10902646e-03 1.21363399e-03 -3.04885427e-04] [-1.94528221e-03 1.53220449e-03 -4.77481520e-04] [ 3.09257250e-04 -2.09230733e-03 -3.65981651e-04] [-7.41541798e-04 3.51651765e-03 -4.68443527e-04] [ 1.87672207e-03 -7.40182213e-04 -4.14342214e-04] [-1.56171043e-03 -7.02329140e-04 -2.55974576e-04] [ 2.17769950e-03 4.42625873e-03 -7.98713988e-04] [ 5.24690125e-04 2.53906540e-03 4.04727093e-04] [ 2.92690209e-03 -2.96799389e-03 3.37151458e-04] [ 2.85801522e-03 1.71250536e-03 1.29652983e-03] [-3.67779018e-03 -1.02342092e-03 5.31494004e-04] [-3.02071968e-04 -1.48325041e-03 2.31188056e-05] [ 1.50661475e-03 7.89478730e-04 3.34267681e-04] [-3.32416728e-04 1.43386838e-03 -2.37560800e-04] [-2.91177185e-03 -2.09482645e-03 -3.20965417e-04] [ 4.28673609e-03 -1.22663969e-04 -1.05194829e-06] [ 5.84392074e-04 1.66566808e-03 -3.15700221e-04] [-3.79392935e-03 -1.29982425e-03 1.51080366e-03] [-5.63737944e-03 4.14113594e-03 -5.97961088e-04] [-1.82933548e-03 -2.48281737e-03 -8.58692931e-04] [ 1.41062284e-03 2.25631045e-04 -4.14852516e-04] [-2.74049451e-04 7.82767583e-04 8.43163137e-04] [-1.18095210e-03 -3.95995028e-03 3.56250097e-04] [ 2.58699965e-03 -1.67944940e-03 6.03559462e-05] [-3.29322180e-03 -9.86559127e-04 1.70294015e-03] [ 4.30095794e-04 1.17956921e-03 1.56459542e-04] [ 8.73923585e-04 -1.58446687e-03 -3.51874422e-05] [ 2.34513130e-03 -5.15084135e-04 7.27359562e-04] [ 1.19630947e-03 1.88512205e-03 -8.37549327e-04] [-5.63587650e-04 6.12707809e-04 -4.03087669e-04] [ 2.82789443e-03 2.46421568e-04 -1.52678703e-03] [ 9.64174883e-05 -2.39809273e-03 -7.14048996e-04] [-1.29572891e-04 1.71579907e-03 2.78443352e-04] [-1.59548128e-03 -9.01850376e-04 -7.41831920e-04] [-1.30879338e-03 -2.27883112e-03 1.07995279e-03] [ 1.51437771e-04 -3.04455107e-04 4.48083101e-04]] Final stress: [-8.86863680e-05 3.70498622e-06 3.42937981e-06 -1.53472183e-03 5.49699779e-06 -9.96353728e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-0.02887733 0.02557597 0.0026302 ] [-0.00459606 0.03450302 -0.00205861] [-0.00411015 0.01632576 0.00363957] [ 0.01731949 0.01864235 -0.00443411] [ 0.02544418 0.01479754 -0.00224352] [ 0.01478538 0.01635735 0.00140318] [-0.02714021 -0.03368653 0.00057614] [ 0.09772005 -0.03229023 -0.02514168] [ 0.00586032 0.03041894 0.02184846] [-0.02096338 -0.02338756 0.00309608] [-0.05752928 0.00060352 -0.02027135] [ 0.02634441 -0.01358146 0.01310039] [-0.04518381 0.06491592 -0.00385637] [ 0.03217444 -0.04987593 0.00397042] [-0.01653226 -0.00314397 0.01121775] [ 0.00543758 -0.00345866 -0.00574896] [-0.0128595 0.01309103 -0.02642404] [ 0.02017971 0.01989579 0.01720035] [-0.00383779 -0.01482357 0.02093924] [ 0.02885617 0.02289127 -0.02249408] [-0.04602516 0.0036411 0.02109237] [ 0.03557969 -0.01091691 -0.01280252] [-0.00015398 0.0511199 0.01976293] [ 0.02693702 0.00571811 -0.03049488] [-0.02399736 -0.01164738 0.00980439] [-0.02781821 0.00213654 -0.00796536] [-0.01151144 0.00453097 -0.00053294] [ 0.00459848 0.01187025 -0.01189243] [ 0.01450658 -0.05986271 0.01557269] [ 0.03036071 -0.00620977 -0.0071993 ] [-0.01471552 -0.02000766 0.01704599] [-0.00674204 -0.01188272 -0.00991686] [-0.00144943 -0.01748892 -0.00375987] [-0.02425902 -0.04247072 -0.02036812] [ 0.00758877 0.00365489 0.0309957 ] [-0.01539107 -0.00595548 0.00370918]] Final stress: [-8.59709839e-04 6.30692891e-04 3.60664217e-05 -2.71564611e-04 1.57009204e-03 2.44505953e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-0.02630493 0.09789195 -0.0151302 ] [-0.33754944 -0.52021436 -0.44922526] [ 0.10772289 -0.14633557 -0.04747815] [-0.00902122 0.16274251 -0.32715549] [-0.19408137 -0.03839816 -0.02571097] [-0.02274554 -0.12527239 -0.01683246] [-0.5765273 -0.32120221 -0.14832568] [ 0.50535314 -0.29535653 -0.11031829] [ 0.36248608 0.24476587 -0.20702068] [ 0.07943858 0.25317491 0.04458942] [ 1.34214025 0.09644356 -0.28536688] [-0.53591857 -0.05030388 -0.46357234] [ 0.2485276 -0.23123299 0.4126118 ] [-0.15072236 -0.16232758 -0.06747815] [ 0.07400234 -0.03193106 -0.06295766] [ 0.27572157 -0.18879571 -0.1825016 ] [-0.3106326 -0.05013996 -0.34804551] [ 0.03902603 0.04419135 0.03442914] [ 0.48862737 -0.61736498 0.11082033] [ 0.12330807 1.1372315 0.15411972] [-0.63327308 0.4629657 0.0080941 ] [-0.79569261 0.46995657 0.05001124] [ 0.25001161 -1.00446829 0.22194576] [-0.57708911 0.51241935 -0.11364084] [-0.10836164 0.18960327 0.08787508] [-0.29642826 -0.15063891 0.22901749] [-0.0780994 0.1500322 0.04843209] [-0.17285137 -0.1257743 0.32496892] [ 0.263706 -0.22325071 0.28667901] [-0.05686502 -0.01188566 0.11898641] [-0.14747204 0.07659437 0.16782478] [ 0.42609764 -0.01274582 0.47757386] [ 0.02550554 -0.16934759 -0.29718191] [ 0.35230132 0.2147137 0.27922158] [ 0.22132451 0.27420821 0.15392482] [-0.15566469 0.09005165 -0.04318348]] Final stress: [ 0.02979432 0.03894762 0.01410909 -0.00100747 -0.00132268 -0.00322404] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 1.54776466e-03 7.66690849e-05 -1.29336347e-04] [-4.46004196e-03 9.78220168e-04 -7.33733505e-04] [-8.25358506e-04 -4.57986546e-04 -1.53899653e-04] [-8.79951307e-06 4.45042725e-03 -6.88928394e-04] [-8.51610615e-04 -1.25898386e-03 -1.14607313e-04] [ 1.47548494e-03 -1.46628373e-04 3.86964815e-04] [-6.37467758e-03 -2.22981845e-03 -9.02579574e-04] [ 4.37488514e-03 5.03724475e-03 -2.91596169e-03] [ 8.57543942e-04 -7.31712789e-03 2.33193623e-03] [-1.17537717e-03 4.53567136e-03 -2.20560403e-04] [-3.73191696e-03 1.30498057e-03 3.78455051e-03] [-2.85607156e-04 7.01688815e-03 -1.27664144e-03] [-1.75590228e-03 7.34526175e-04 1.73427333e-03] [ 4.07265583e-04 2.22105177e-03 -7.10869598e-04] [ 1.10976054e-03 -7.83539688e-04 1.04943036e-03] [ 9.50031556e-04 -5.00024756e-04 6.70636719e-04] [-2.08042137e-04 -2.62263008e-03 -6.81274510e-04] [-1.05715833e-03 -2.06619570e-03 -1.94833001e-03] [ 3.28935731e-03 -1.79639944e-03 4.35043112e-03] [ 4.07000674e-03 1.39753010e-02 -1.64100756e-03] [-1.25922964e-03 -4.85244117e-03 -2.83838259e-03] [ 1.56423673e-02 -8.64168871e-03 5.95399491e-04] [-1.86297495e-04 1.40377839e-03 3.76582971e-04] [-1.11269468e-02 -5.50459040e-03 -8.24691074e-04] [-7.08298474e-04 2.06106594e-03 4.58050079e-03] [-3.04144668e-04 6.34865690e-04 -5.14461601e-03] [-2.24892627e-03 -2.62460652e-04 1.45855108e-03] [ 1.24619088e-03 -1.74450948e-03 1.44222381e-03] [-3.29433010e-03 4.37976489e-03 -1.20534581e-03] [ 3.53871762e-06 -1.17778642e-03 3.72915115e-03] [-1.48263451e-03 -3.26713358e-03 -1.43571002e-03] [ 1.22178728e-03 1.57113367e-03 3.41074323e-03] [-1.26755071e-04 -3.31187542e-03 8.69912271e-04] [ 2.35357026e-03 -1.91046402e-03 -1.84928052e-03] [ 4.29447164e-03 -4.89122831e-03 -3.00224858e-03] [-1.37197122e-03 4.36192413e-03 -2.35328329e-03]] Final stress: [-2.04307603e-04 -2.19494886e-04 -5.69644293e-05 9.46530210e-04 1.18392621e-05 1.88488964e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 4.67630045e-04 -8.28638521e-04 -5.91038174e-05] [ 2.83285213e-03 -2.97933897e-03 7.76365694e-04] [ 1.05699971e-04 -3.30188937e-03 -6.07904649e-04] [-5.06483360e-05 -4.22587942e-04 -7.76629239e-06] [-2.11318558e-04 -4.05087172e-04 1.17231495e-04] [-3.03782472e-03 -3.01395133e-03 -5.45668467e-04] [-8.60585531e-04 -6.47473030e-04 -2.35182111e-03] [ 6.44318281e-03 2.24826349e-03 2.73725573e-04] [ 1.31740724e-03 1.85651201e-03 2.21130246e-03] [ 9.72459484e-05 1.48035204e-03 1.87279645e-03] [-6.18603179e-03 1.25854089e-03 -4.05509247e-04] [ 3.17086635e-04 -7.97314436e-04 -1.35139484e-03] [-2.02963740e-04 6.13697479e-04 5.82480208e-04] [-2.49383014e-04 2.18413247e-03 -4.80251893e-04] [-7.98595071e-05 9.68542281e-04 -1.85383217e-04] [ 3.06444935e-04 3.87886510e-04 1.40764370e-03] [ 6.95168052e-04 1.58782041e-05 8.15466758e-04] [ 1.25692645e-04 -1.20710706e-03 -1.99517872e-03] [-4.78945526e-03 2.41880863e-03 3.33237550e-03] [ 4.10559818e-04 -8.42869451e-05 6.29536926e-04] [-2.69207823e-03 2.23295709e-03 -4.19310846e-03] [-1.78548905e-03 2.09563644e-03 -5.32852030e-04] [-4.31035042e-04 -2.58199597e-03 -4.33650911e-04] [ 6.90604933e-03 1.04031722e-03 1.03427193e-03] [-7.33733330e-04 -9.06329899e-04 1.78063730e-03] [-6.42596629e-04 -1.11041483e-03 -2.62795529e-03] [ 5.65709174e-04 -8.80559283e-04 -5.78783039e-05] [-4.00592249e-04 9.78129875e-04 -5.12867876e-04] [-5.29586770e-04 -3.87795225e-04 -3.27782915e-03] [ 8.85161866e-04 -2.32319383e-04 4.35398076e-03] [-1.10998337e-03 1.88276718e-04 -6.31001558e-05] [ 9.27286828e-04 7.22395321e-04 9.33083969e-04] [ 1.19993466e-03 5.06985941e-04 -1.02664755e-04] [-1.30931539e-03 -1.56126823e-03 1.36567289e-05] [ 2.53215390e-03 -4.07409189e-04 1.90905045e-03] [-8.32785464e-04 5.58454201e-04 -2.25171673e-03]] Final stress: [-1.06829891e-04 -2.04574608e-04 -4.47899576e-05 -9.53609133e-04 2.56600518e-05 -1.86808241e-03] Minimization converged after 44 steps. Minimization converged after 47 steps. Minimization converged after 43 steps. Minimization converged after 47 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-1.04134455e-02 2.44711052e-03 3.18409480e-03] [-1.29969303e-02 -2.39438206e-02 -3.21097152e-03] [-2.36976767e-02 1.38896693e-01 1.52400236e-02] [-4.27466695e-02 -1.15040664e-01 2.32948580e-02] [-1.62375764e-02 7.87355059e-03 2.23754402e-03] [ 1.39681618e-01 6.79696836e-02 2.77803297e-02] [-9.77646659e-02 -1.90626838e-01 8.91616925e-02] [ 5.43898165e-02 -8.60260849e-02 -6.42681527e-02] [ 8.36156106e-02 -6.94290685e-02 -5.84549340e-02] [ 4.04237397e-02 -2.16331497e-01 -5.80770134e-02] [-1.10705669e-01 1.87873622e-02 2.09854969e-02] [ 5.82275989e-03 -2.50345951e-01 2.86646590e-02] [ 3.96687423e-02 -3.98283689e-02 4.43375373e-02] [ 3.89407463e-02 -3.87433964e-02 -5.67466235e-03] [ 8.52635860e-02 7.03456303e-02 4.71288919e-03] [-8.98029600e-02 -8.58602040e-03 -3.70201104e-02] [ 1.50139266e-01 4.37414541e-01 -2.11715202e-03] [-1.79498640e-01 -3.19124375e-01 -2.60244710e-02] [ 4.81814133e-02 1.27778500e-01 1.04061652e-02] [ 3.04294367e-02 3.33219088e-01 1.99762572e-03] [-9.06920092e-02 1.33890828e-01 3.90317384e-02] [-1.61211862e-01 1.94406037e-01 -1.28238202e-02] [ 6.09942353e-02 1.61383207e-01 -1.13603156e-02] [ 1.76731465e-01 6.18029816e-02 -2.14498447e-02] [ 7.99285287e-02 4.22205854e-02 -3.50896408e-02] [-3.50943865e-02 -3.80192538e-02 6.82184719e-02] [ 7.54552613e-03 1.01308483e-02 -3.97585438e-04] [-1.00231133e-01 -6.62220888e-03 -5.22410114e-03] [ 2.20651313e-02 -6.44525133e-02 3.28597480e-02] [-2.24035693e-03 2.39426185e-02 -4.73499965e-02] [-7.81712932e-02 -1.12158010e-01 5.64946763e-02] [-7.59781078e-02 -3.98829585e-02 -2.45900495e-03] [-6.86815373e-03 -1.99318410e-02 -8.27335749e-02] [-1.82090947e-02 -2.01713466e-02 2.44714027e-02] [-2.16699351e-03 -3.44471100e-02 1.22292988e-02] [ 9.09060015e-02 -1.38797939e-01 -3.15729002e-02]] Final stress: [ 0.00110005 0.00156179 0.00020829 0.00095305 -0.00072409 0.00046075] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 1.16683566e-03 -6.15039289e-04 -5.76065804e-05] [-2.96984502e-03 2.97397964e-03 -6.81598616e-04] [-3.90912636e-05 -2.85694117e-04 -9.34932922e-05] [ 2.16971131e-03 2.64226403e-03 -3.65173202e-04] [-1.74110755e-03 -8.12591470e-04 1.99272511e-04] [ 2.46963841e-03 2.13183522e-04 3.59638029e-04] [ 1.36457259e-03 -1.51955206e-03 8.68508059e-04] [-4.28195649e-03 -1.02313675e-04 -9.31455415e-05] [-2.89213832e-04 -1.74572234e-03 -3.34030328e-05] [ 3.64531697e-04 -8.70366368e-05 1.65116474e-03] [-4.84120781e-03 -3.16983171e-03 -1.90606172e-03] [-1.94637024e-03 -1.50653475e-03 7.84081340e-05] [-5.41665087e-03 -2.55386479e-04 7.98834837e-05] [-1.30297295e-03 -2.39428575e-03 -3.73203415e-04] [ 4.53478051e-03 -2.99352856e-04 -5.21461513e-06] [ 7.64817425e-04 -1.04797328e-03 4.93640915e-04] [-5.17221213e-04 -5.50165363e-04 4.10430037e-04] [ 1.59034927e-03 8.53095442e-04 -4.11891342e-04] [ 4.02595910e-03 7.05418667e-03 -2.68549652e-04] [ 3.09910041e-03 -1.97004476e-03 4.36676313e-04] [-2.73245232e-03 1.66023508e-03 -5.11089004e-04] [ 3.99837629e-03 6.82414537e-04 6.26530786e-04] [ 1.85211847e-03 1.38581322e-04 -3.56491001e-04] [ 1.90882929e-03 -1.04948139e-03 -3.76373443e-04] [-1.24441225e-03 2.34449219e-03 7.03562929e-04] [ 1.14238778e-03 1.81782048e-03 -3.76640099e-04] [-1.02278308e-03 2.92721773e-04 -2.79242220e-04] [ 1.65146681e-03 9.24505614e-04 -1.55198259e-03] [-4.21666285e-05 1.50127380e-03 1.10695483e-03] [ 2.22245858e-04 3.79948174e-04 -3.64865425e-04] [ 1.45749898e-03 -1.00308296e-03 1.09728660e-03] [-1.09315449e-03 -1.05664197e-03 1.47271139e-03] [-2.47903673e-03 -5.21936424e-04 -1.09344293e-03] [ 6.59209470e-04 -2.27370951e-03 7.82940084e-04] [-1.01115897e-03 -1.64125169e-03 -4.44759689e-04] [-1.47162762e-03 4.28926196e-04 -7.23381421e-04]] Final stress: [-5.43094329e-05 -2.93397947e-05 -1.28882264e-05 -9.60070138e-04 -1.95449651e-05 -6.11056707e-04] Minimization converged after 50 steps. Minimization converged after 51 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-2.08851665e-03 -2.13439043e-03 5.22068101e-04] [-2.23382812e-03 1.62664945e-03 -3.28902805e-04] [ 1.26588454e-04 1.56189357e-03 1.98410404e-04] [-4.28354258e-04 1.15392648e-04 -3.35824314e-05] [ 1.16754378e-04 -1.50191915e-03 -1.12058415e-04] [ 4.33939555e-03 3.59570507e-03 8.99165942e-04] [ 1.92052186e-03 1.12577882e-02 -7.86830519e-05] [ 1.20222907e-02 -4.41161474e-03 -7.42523071e-05] [ 8.89281787e-03 -1.38907997e-02 -2.12791655e-03] [-3.06297758e-03 -1.57753041e-02 5.08239060e-04] [-4.86053741e-03 5.74380317e-03 -9.28842459e-04] [-1.38013415e-02 1.87484872e-02 2.24239332e-03] [ 2.95009582e-03 -1.51920527e-03 -1.15215034e-03] [-1.89734597e-03 2.03533373e-03 -1.18127959e-03] [-2.46117143e-03 -9.06825752e-04 -1.14525365e-03] [-1.97700042e-03 2.22675540e-03 1.31508503e-03] [ 3.46861816e-03 -4.24545645e-03 6.04751107e-04] [ 3.31190113e-04 3.40976274e-04 8.45776449e-04] [ 9.14422952e-03 -7.93920480e-03 -1.00118475e-03] [-1.63948917e-02 1.20009115e-02 -2.45953284e-03] [-1.26481543e-02 4.02963682e-03 -1.06800998e-03] [-9.30949533e-03 3.13485636e-03 7.71394830e-04] [ 1.92215037e-02 -1.27285518e-02 1.85881187e-03] [ 1.10085738e-02 -2.42507175e-03 1.98261015e-03] [ 9.37817213e-04 3.97636874e-04 2.37434142e-03] [-2.46563760e-03 -2.47726712e-03 -2.63787494e-04] [-1.66543716e-03 -9.30730201e-05 -1.42966384e-03] [-6.01425600e-04 -3.35035825e-04 3.40214041e-03] [-1.29989797e-03 -4.83381583e-04 -2.10703320e-03] [-2.78171387e-03 -1.82731894e-03 1.96228019e-03] [ 7.59159404e-08 9.34465491e-04 -1.50932952e-03] [ 2.55387001e-03 3.21198546e-03 8.39063436e-04] [ 2.24921217e-04 -1.14652735e-03 1.37020917e-03] [ 7.58058742e-04 -2.32176763e-04 -3.25954182e-03] [ 3.25591172e-04 1.66430340e-03 1.89011816e-03] [ 1.63481260e-03 1.44654388e-03 -3.32585401e-03]] Final stress: [ 1.32170924e-04 -1.57574202e-05 -3.56290728e-05 6.09338389e-04 2.68133511e-05 9.92820131e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-1.76514099e-03 -5.62331541e-05 3.10389516e-04] [-6.43819167e-04 8.06992577e-04 -2.16792712e-04] [ 2.98940025e-04 3.68036468e-03 6.41439735e-04] [-5.14764008e-04 -1.31387831e-03 2.56910722e-04] [-5.68940756e-04 1.35771498e-03 9.40319136e-05] [ 4.18778295e-03 3.19679958e-03 7.78708617e-04] [-1.40526530e-03 -1.31831779e-02 -1.22513806e-03] [-1.54469412e-03 7.52749497e-03 -3.74530230e-04] [-6.56683640e-03 4.34255157e-04 1.15286197e-03] [ 1.50815637e-02 4.96222392e-04 9.58614512e-05] [-1.50940896e-04 7.10698515e-03 5.98907311e-04] [-4.59486891e-03 -8.62433490e-03 -1.45136348e-03] [-7.32128258e-03 -1.05401139e-03 -4.28651588e-04] [ 2.51599438e-03 2.41811726e-03 5.31478191e-04] [ 3.79166730e-03 -1.88717012e-03 3.03264715e-03] [ 1.70568456e-02 -6.21574984e-04 -6.74840101e-04] [-3.18002743e-03 -4.80213808e-03 -1.55343562e-03] [-1.32720249e-02 3.75416404e-03 -1.94297193e-03] [ 4.87545359e-03 6.23178610e-03 1.88500099e-03] [ 1.34926442e-02 9.02675510e-03 2.69830735e-03] [-8.87394240e-03 -8.66009963e-03 1.41754487e-03] [-7.39943822e-03 1.41748218e-03 -2.10855215e-03] [-5.56317215e-03 -8.39807582e-03 -2.64355715e-03] [ 2.75108163e-03 2.10695543e-03 -4.73142111e-04] [ 2.55326275e-03 -8.58904581e-04 -4.75982663e-04] [ 2.67470463e-03 -2.72132944e-03 -2.21332357e-03] [ 1.64166157e-03 1.25337442e-04 -1.13754748e-03] [-3.34930149e-03 4.78765133e-04 -3.83640924e-04] [-1.19725032e-03 -4.39498863e-03 5.56069869e-04] [ 1.31821992e-04 -1.96541137e-03 7.51799193e-04] [-1.96038343e-03 -1.79498468e-04 -1.42504621e-03] [-2.52636320e-03 2.87844681e-03 2.95157333e-03] [-2.70818786e-03 -2.35498723e-04 3.00804930e-03] [ 3.38141827e-03 -1.04837668e-04 -5.91454974e-04] [ 1.73667522e-03 4.69386633e-03 1.29690500e-03] [-1.06487326e-03 1.32265787e-03 -2.73851552e-03]] Final stress: [-7.02616172e-05 -4.13319112e-05 -3.87756221e-05 -6.04335287e-04 4.67250175e-06 -1.05611402e-03] Minimization converged after 42 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 47 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 62 steps. Final forces: [[ 6.89518876e-03 1.91253524e-03 -8.40930030e-04] [ 3.26454515e-03 -2.83939167e-03 5.91704300e-04] [-3.38824896e-05 1.51239017e-03 4.24826546e-04] [ 2.21786269e-03 6.90516362e-04 -1.91756459e-04] [ 4.38383952e-03 -4.91135979e-03 -1.23845792e-03] [-2.91610716e-03 -4.82059047e-03 -8.46174745e-04] [ 2.89759166e-03 2.46067946e-03 -1.42963700e-03] [ 1.01572256e-02 -4.50188667e-03 -2.92094683e-03] [ 1.15453400e-03 4.08143271e-03 5.33001855e-03] [-5.14126962e-03 4.28759420e-03 1.76996776e-03] [ 6.13436398e-03 6.20621936e-04 -5.32626596e-04] [-2.03823891e-03 2.42472798e-03 -7.95241929e-04] [ 5.09765170e-03 -3.44499605e-03 1.07222841e-03] [-2.18323658e-03 -5.33022922e-03 1.37798856e-03] [-8.56407588e-04 6.83738006e-05 -1.35225252e-03] [-2.68247927e-03 2.57991325e-03 6.33675771e-04] [ 1.11191459e-03 8.98737884e-03 7.95689142e-07] [-2.37015606e-03 -3.11070102e-03 -8.20487171e-04] [-1.29334865e-02 6.72006020e-04 -4.37215656e-03] [ 2.90267186e-03 1.83298259e-03 8.80160497e-04] [-1.84703887e-04 -4.72239645e-03 4.73403406e-03] [-7.64203512e-03 7.74161977e-03 6.74515340e-03] [ 1.02160707e-02 -2.97640123e-03 -8.19271172e-04] [-7.88253310e-03 -7.13963271e-03 -8.29588856e-03] [-1.99282323e-03 5.06855932e-03 1.07251656e-03] [ 1.04939868e-03 3.02431335e-03 -2.99035262e-03] [ 1.60437204e-03 -3.01950486e-03 -7.00113788e-04] [-9.00757388e-04 -3.23876176e-03 -2.43699352e-03] [ 7.89789242e-04 -2.93391475e-03 2.61091271e-03] [ 7.97392798e-04 -2.83805401e-04 1.04840302e-03] [-4.79253198e-04 -2.41833151e-03 5.07103984e-03] [-1.19934728e-03 -8.03748021e-04 -7.11318949e-04] [-3.46771297e-03 4.90624523e-03 -1.55552305e-03] [-6.48349420e-05 1.85392533e-03 -1.02135354e-03] [-2.16930755e-03 8.21895838e-04 -2.03391773e-03] [-3.53584011e-03 9.47940170e-04 2.54197498e-03]] Final stress: [-9.64918692e-05 7.19768189e-05 -5.63387463e-06 -6.03579137e-04 -9.98657022e-05 -4.18806092e-04] Minimization converged after 47 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 3.85220327e-04 -5.51321291e-04 -7.59818347e-05] [ 2.01506977e-03 -2.15155542e-03 4.48244361e-04] [ 2.24750144e-04 -2.30266277e-03 -2.96259841e-04] [-2.75497062e-04 -1.48010751e-03 2.04544590e-04] [-2.00308874e-04 -7.41774972e-04 6.53732109e-07] [-3.85582956e-03 -3.38953197e-03 -8.91474174e-04] [ 4.65781859e-04 -5.59689540e-04 -4.06294456e-04] [-1.13902584e-03 3.00853938e-03 -5.49075368e-06] [-2.06575504e-04 -2.07205047e-03 1.79645248e-03] [ 2.17751221e-03 -1.73797711e-03 1.58980832e-05] [-3.68510789e-03 3.04941052e-03 1.53668197e-04] [-1.31444669e-03 -1.59638392e-03 -1.05222119e-03] [-2.52308285e-03 2.60578548e-03 4.23622906e-04] [ 4.76566215e-04 2.55334835e-03 -1.24189246e-03] [ 3.76814203e-03 1.45481666e-03 -2.37313034e-04] [ 5.91420491e-03 -1.37574673e-03 1.67881806e-03] [-7.71986625e-04 -8.87303025e-04 1.11855502e-03] [-6.53655062e-03 -1.79890255e-04 -1.39909841e-03] [-1.46272955e-04 2.11793514e-03 3.04633863e-03] [-1.25741193e-03 2.02596804e-03 -8.79215346e-04] [ 1.36802632e-03 3.57478702e-03 -2.24943435e-03] [ 9.76795441e-04 1.78720371e-03 -1.77548739e-03] [ 7.60065622e-04 -9.00198600e-04 7.35486613e-04] [ 3.47089626e-03 6.38449417e-04 8.77578112e-04] [ 2.94727017e-03 1.46193295e-04 -6.98874597e-04] [-6.41334038e-04 -4.01338652e-04 -2.16179332e-03] [ 1.89788996e-03 1.55061569e-03 4.20393217e-04] [ 7.47906996e-04 -4.04122433e-04 4.60127767e-04] [-2.92753917e-03 1.73788639e-03 -6.22858484e-04] [-1.04962619e-03 -2.57847024e-03 3.09077473e-04] [-3.85420048e-03 -6.69885398e-04 1.19817146e-03] [ 2.52877469e-04 -1.75994181e-03 5.83643107e-04] [ 1.70048171e-03 -4.29924529e-04 -1.03256293e-03] [-4.16266091e-03 1.28477832e-03 3.80037032e-04] [ 3.61316895e-03 -2.25904849e-03 1.33327806e-04] [ 1.38483083e-03 8.93207716e-04 1.04161392e-03]] Final stress: [-4.49243595e-05 -8.50241773e-05 -1.68293224e-06 3.66109939e-04 1.33301370e-05 7.22111181e-04] Minimization converged after 56 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 46 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-4.43899036e-03 -1.23133765e-03 9.80218473e-04] [-1.31210730e-03 4.47664941e-04 -4.88212878e-05] [-1.49203056e-03 -4.80455397e-04 -7.81201582e-05] [-1.32807840e-03 3.96171430e-03 -8.84228672e-04] [-1.49274169e-03 6.64369301e-04 9.87578209e-05] [ 2.28936593e-04 1.74979330e-03 1.89977744e-04] [-6.50045122e-03 -1.57442982e-02 -1.21945804e-03] [ 1.19219097e-02 -4.37547953e-04 -2.83429747e-04] [-6.92303387e-03 -5.57223557e-04 -9.37797339e-04] [-2.91641080e-03 -1.85314640e-02 4.33567189e-04] [ 1.05086127e-02 5.93963757e-03 7.32320659e-04] [-1.50595490e-03 2.57545310e-03 3.15387529e-04] [ 1.10317027e-04 -1.00889739e-03 9.43900569e-05] [ 1.64077824e-03 2.75960738e-03 5.12191603e-04] [-2.60046334e-03 -3.12178817e-03 8.79950069e-04] [ 6.95199675e-04 -9.89403370e-04 -5.54815549e-05] [-1.96442832e-03 -9.01936465e-04 -1.76849139e-03] [ 3.38633480e-03 2.63637288e-03 1.20395534e-04] [ 3.98356942e-04 9.61345179e-04 -1.38762226e-03] [ 8.13900248e-03 1.19589467e-02 -4.86194824e-04] [-4.66834666e-03 6.93805017e-03 1.22238604e-03] [-9.37042520e-03 -5.38224262e-03 1.45178948e-03] [ 1.37353457e-03 3.39712513e-03 -5.47846842e-04] [ 2.01629845e-03 7.15407467e-03 -5.03258990e-04] [ 2.27795532e-03 1.45077486e-04 -1.16158855e-03] [-9.09702210e-04 -3.36817416e-03 -7.81255600e-04] [ 5.53875354e-03 5.64650797e-04 7.49035590e-04] [-6.03409714e-03 -7.71412115e-04 2.36646295e-03] [-1.34398284e-03 6.15342629e-04 1.79839780e-03] [-9.33656103e-04 -2.27908221e-03 1.74201889e-03] [-9.64646642e-04 -3.22051199e-04 1.33573216e-04] [ 1.40246149e-03 2.96917485e-03 7.03130881e-04] [-4.20034731e-03 -1.55649545e-03 9.04127597e-04] [ 6.98959738e-03 2.51720298e-05 -8.66488500e-04] [ 2.08734952e-03 -7.08151152e-04 -1.99082516e-03] [ 2.18449645e-03 1.92838859e-03 -2.42717021e-03]] Final stress: [-1.51400314e-05 2.58021826e-05 -5.06293143e-05 3.77498322e-04 -2.38065793e-05 2.55150930e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-4.20360527e-04 -1.79235677e-03 4.70583062e-05] [ 1.44997058e-03 7.02034819e-04 2.32845809e-04] [ 1.34259794e-03 -3.85156693e-03 -8.02140023e-04] [ 1.15791796e-03 6.57779218e-04 -1.93891940e-04] [-2.73301244e-03 3.03757326e-03 8.32040975e-04] [-1.92081183e-03 3.40677693e-04 -8.97434596e-05] [-1.86415777e-03 8.81037805e-04 4.11897949e-04] [ 1.95692833e-03 -5.51485408e-03 -5.64580571e-04] [ 7.03326116e-03 2.34413673e-03 1.66090610e-04] [-5.94174103e-03 4.05932296e-03 3.48832040e-04] [ 1.52892444e-03 -3.74779726e-03 -3.65170040e-04] [ 1.70077352e-03 8.40109967e-04 -1.59110196e-05] [ 2.19721262e-04 -2.07019232e-03 8.54531309e-04] [-1.89726927e-03 2.90976644e-03 -2.73014506e-04] [ 2.76731531e-03 1.97894253e-03 -4.37958880e-04] [-1.55626148e-03 3.92116276e-03 -1.44342763e-03] [ 2.93151528e-03 -4.70399153e-03 8.77664292e-04] [ 8.75531960e-04 8.45879222e-06 4.08998752e-04] [ 1.34252893e-03 -7.84757435e-04 -1.59027324e-03] [-3.28820960e-03 2.29842693e-03 1.14909109e-04] [-5.73582445e-03 6.83817200e-04 1.56933896e-03] [-2.40372924e-03 3.26889506e-03 1.36171464e-04] [ 3.66131584e-03 -3.83444534e-03 1.39363887e-03] [ 1.08597413e-03 -1.10201277e-03 -1.61933702e-03] [ 3.89137625e-04 -2.06147375e-03 9.42688408e-04] [-1.12899605e-04 -1.50173751e-03 9.03844183e-05] [ 4.26827897e-04 6.23793923e-04 7.40080510e-04] [-1.79284348e-03 -2.29541905e-04 -7.62856993e-04] [ 2.38593728e-04 -3.32599506e-04 -5.25644150e-04] [-2.11538097e-03 6.14420075e-04 -4.59562079e-04] [ 1.37845734e-04 6.35863865e-04 1.59356633e-03] [-8.53198088e-04 1.16446911e-03 -7.03676666e-04] [ 1.52319885e-04 -2.17221557e-05 1.83918453e-04] [ 7.31164730e-04 -5.80824256e-04 1.10794452e-03] [ 4.73388617e-04 5.25181944e-04 -4.22865701e-04] [ 1.03214491e-03 6.34002435e-04 -1.78254717e-03]] Final stress: [ 1.37844785e-05 -5.73408532e-06 -1.85286399e-05 -3.75226230e-04 -2.32931926e-05 -2.64988045e-04] Minimization converged after 48 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-5.08559307e-03 1.14023998e-02 -3.04473043e-04] [ 8.34329281e-03 -1.27667938e-03 1.23238136e-03] [ 2.01260215e-03 -4.08297360e-03 -5.43049170e-04] [ 2.42344723e-03 -3.15719943e-03 4.36331578e-04] [ 4.62130376e-03 1.16462573e-02 3.74329132e-04] [-7.79559202e-03 -5.79320476e-03 -1.62291289e-03] [ 1.83121261e-03 5.34842100e-03 4.27505427e-03] [-5.44126202e-04 -1.04602294e-02 5.37945267e-04] [-1.60252236e-02 2.06867264e-02 -5.77790435e-03] [ 6.17535635e-03 3.16018033e-03 -4.43794200e-04] [ 5.06616741e-03 6.28099142e-03 -2.40277383e-03] [ 7.83717954e-03 2.00062642e-04 4.00964178e-03] [ 1.30247287e-03 3.63713300e-03 -2.76580622e-03] [ 1.32393753e-03 5.32601442e-03 1.35543879e-03] [-7.83814731e-04 2.98267248e-03 3.00744595e-03] [ 1.00995354e-02 -4.41661149e-03 -3.56559515e-04] [-4.12514359e-03 7.70289891e-06 2.69396368e-04] [-7.18480651e-03 1.39144867e-03 -7.69319632e-04] [-2.30093592e-03 -1.44575599e-02 2.60349127e-04] [-5.44040735e-03 3.75040037e-03 8.95560762e-04] [ 1.93685466e-02 1.23293308e-02 3.27912850e-05] [ 2.18926854e-03 -4.20554574e-03 -5.66796946e-03] [ 5.97639648e-03 1.05963114e-02 2.61656505e-04] [-2.43262574e-02 -2.52880357e-02 3.96198902e-03] [ 2.74328783e-03 -7.36834680e-03 -4.06821493e-03] [-4.98027038e-03 -1.31383769e-02 4.88885769e-03] [ 4.46112758e-03 3.18569892e-03 -5.62554459e-03] [-4.36345543e-03 1.82863984e-03 5.52400544e-03] [ 1.24302001e-03 -5.71978439e-03 3.35064527e-03] [ 1.23702486e-03 -8.06207927e-03 -3.22852876e-03] [-5.30722718e-03 -2.82657614e-03 -2.19753347e-03] [ 5.40185316e-04 5.42047373e-03 -1.99734316e-04] [ 3.84302727e-04 4.35597522e-03 2.55901647e-03] [-3.20171332e-03 2.67284980e-03 -7.18248797e-03] [ 1.37126130e-03 -6.99629610e-03 5.32184349e-03] [ 9.13637650e-04 1.03980855e-03 6.01926792e-04]] Final stress: [-2.51004349e-04 -1.67982429e-04 -5.23511418e-05 2.40040711e-04 7.46394435e-05 2.96068088e-04] Minimization converged after 55 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 16 steps. Minimization converged after 11 steps. Minimization converged after 53 steps. Minimization converged after 51 steps. Minimization converged after 44 steps. Minimization converged after 48 steps. Minimization converged after 54 steps. Minimization converged after 53 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 47 steps. Minimization converged after 50 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 43 steps. Minimization converged after 39 steps. Minimization converged after 42 steps. Minimization converged after 37 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.73036 0.41917 0.07836 -0.00001 -0.0786 -0.00002] [ 0.41917 0.7288 0.07816 -0.00001 0.07858 0.00001] [ 0.07836 0.07816 1.13899 -0. 0.00001 0.00001] [-0.00001 -0.00001 -0. 0.1232 -0. 0.07956] [-0.0786 0.07858 0.00001 -0. 0.12319 0. ] [-0.00002 0.00001 0.00001 0.07956 0. 0.15561]] 95%% Error estimate [ASE units]: [[0.00205 0.00235 0.00198 0.0001 0.00008 0.00022] [0.00235 0.00238 0.00035 0.00005 0.00009 0.00034] [0.00198 0.00035 0.00021 0.00001 0.00005 0.00001] [0.0001 0.00005 0.00001 0.00002 0.00001 0.00023] [0.00008 0.00009 0.00005 0.00001 0. 0.00007] [0.00022 0.00034 0.00001 0.00023 0.00007 0.001 ]] Maximum deviation from material symmetry [ASE units]: 0.079560 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.138988 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.1,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 8.13442223e-04 -1.18327988e-03 -8.40763283e-05] [ 3.12813496e-04 -1.29563666e-03 2.73112839e-04] [ 6.89654767e-04 -6.71571701e-05 -3.97653267e-05] [ 1.20945986e-03 8.66280040e-05 -1.41617628e-05] [-3.79295047e-03 -5.50681514e-05 6.04987628e-04] [-1.32543309e-03 -1.96776239e-03 -4.12283934e-04] [ 1.06235989e-03 -2.19494182e-03 3.44495458e-03] [-3.58435001e-03 -1.53353069e-03 -7.11339508e-05] [-4.51413143e-03 2.18973973e-03 7.00376824e-04] [-2.70819207e-03 -2.15487252e-04 -2.40753978e-03] [ 3.66372874e-03 1.26341609e-03 -3.87564309e-04] [ 6.84530534e-04 1.07980362e-03 -1.37454995e-03] [ 1.58850759e-03 -1.54595595e-05 8.41577640e-04] [ 1.84815766e-04 8.85987675e-04 -1.94618447e-04] [-1.91988453e-03 -1.56205598e-03 -2.58700749e-03] [-2.16707026e-03 2.16373198e-04 4.22951008e-04] [ 1.93799407e-04 1.66928657e-03 -5.07389897e-04] [ 2.16505562e-03 6.68660013e-04 3.92282197e-04] [ 2.00510685e-03 -1.77678505e-03 3.00594854e-03] [ 2.45706203e-03 8.47300773e-04 1.48478500e-03] [ 4.07325650e-03 -1.15896414e-04 -1.36190252e-03] [-4.52383850e-03 5.28357439e-03 1.47555507e-03] [ 1.43087128e-03 7.71174042e-04 4.67724092e-04] [-5.56738004e-04 1.77743759e-03 -1.41171087e-03] [-2.18005892e-03 8.98939551e-05 -7.64412456e-04] [ 3.27356747e-04 6.05855811e-04 -1.00529014e-03] [ 1.13884679e-03 -2.42484918e-03 -1.94364476e-03] [-2.12396529e-03 -6.72638064e-04 -1.57259124e-03] [ 1.70950249e-03 7.57265613e-04 -5.80928342e-05] [ 1.43966248e-03 5.27275557e-04 -2.44158117e-03] [ 1.17759255e-03 -1.39141324e-03 4.10863258e-04] [-3.64884078e-04 1.61789277e-04 1.07672850e-03] [-1.68751410e-03 7.33914852e-04 1.42200910e-03] [ 3.50886371e-03 -1.55173314e-03 8.95420802e-04] [-3.37942739e-05 -1.66532385e-03 3.21835611e-04] [-3.53484292e-04 7.36417247e-05 1.39820447e-03]] Final stress: [ 4.13214784e-02 1.92777919e-02 6.41996230e-03 -9.58087759e-07 -6.15128010e-03 -2.04172075e-06] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-4.61267909e-02 1.59637694e-01 -2.91383318e-02] [ 2.05327325e-01 4.22419294e-02 2.42706601e-02] [ 3.34830328e-01 -6.75152003e-02 -1.19619166e-01] [-4.88570065e-02 -1.51841966e-01 1.47070709e-01] [ 1.19597400e-01 1.69156760e-01 1.90317623e-01] [-4.41174470e-02 1.05696066e-01 1.56157634e-01] [ 3.13822370e-02 4.09591254e-01 9.06060556e-03] [-2.03564416e-01 1.68844362e-02 -7.80511618e-02] [ 4.56488219e-02 -1.85934165e-01 2.59618854e-01] [ 1.62436938e-01 -1.06758881e-02 2.05147938e-02] [ 1.93888549e-01 7.13757228e-03 -2.57129772e-01] [ 1.96981883e-02 2.81555747e-01 -3.84507748e-01] [-9.91644988e-01 -3.12724730e-01 -2.25251097e-01] [ 3.97848505e-02 -1.00858247e-01 -2.08761367e-01] [ 7.50953211e-01 3.19736538e-01 7.93838146e-02] [ 1.12838586e-01 -5.00306265e-02 -1.78213836e-02] [ 8.70762004e-02 1.20930318e-01 2.53410697e-02] [-1.54099581e-01 -6.88840231e-02 1.32614464e-01] [ 7.41910398e-01 -6.80087985e-01 1.01703875e-01] [-1.57188516e-01 3.05974149e-01 -1.35062048e-01] [-3.80706584e-01 2.40974652e-01 6.64835243e-04] [-1.66202860e+00 9.23948357e-02 -4.15662403e-02] [ 3.26820310e-01 -9.95829874e-01 8.33289985e-02] [ 7.38153177e-01 8.56958183e-01 1.41461373e-01] [ 7.48339521e-02 -6.26011071e-02 4.10883430e-02] [ 1.91998559e-01 -5.53780141e-02 -1.31096949e-01] [ 1.40960153e-01 6.90882278e-02 -1.98781406e-01] [-8.46695436e-02 5.55330702e-03 -1.20544715e-01] [-1.31007108e-01 -4.94793195e-02 -2.08669996e-02] [-1.22992688e-01 -6.18267781e-02 1.88735245e-01] [-1.38656966e-01 -6.12664059e-02 1.87262046e-01] [-1.56590622e-01 4.35565085e-03 -5.60587903e-02] [ 1.45927436e-02 2.15925272e-02 1.30224467e-01] [ 7.25444701e-02 3.86368548e-02 -1.15212253e-02] [-1.14776284e-01 -2.52399102e-01 1.48757464e-01] [ 3.17507403e-02 -1.00763271e-01 -3.17984748e-02]] Final stress: [ 0.01092741 0.03686859 0.01178693 -0.00127384 0.00307731 -0.00427606] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-2.79891343e-03 5.64018679e-03 2.34077211e-04] [ 3.09887510e-03 3.08684285e-03 5.60011159e-04] [-1.30267660e-03 -6.50867003e-03 -1.27871409e-03] [ 1.17124779e-03 -1.60501308e-02 3.73974993e-03] [ 3.26159290e-03 7.23948494e-03 2.19567525e-04] [-2.88581409e-03 3.43322835e-03 -4.67740817e-05] [ 3.90458741e-03 -8.41671154e-03 1.62787571e-04] [ 7.75124064e-03 3.10398377e-03 -4.20186571e-03] [-5.98769408e-03 2.13493601e-03 -8.97238213e-03] [ 8.22943413e-04 6.58808911e-03 -5.22120440e-04] [ 1.04626557e-02 -9.66344383e-03 -3.15403998e-03] [ 6.61396137e-03 -1.09515111e-03 -2.22749459e-03] [ 3.36240952e-03 3.55534381e-03 -2.94208472e-03] [-3.87710887e-04 -8.60355618e-03 -1.98945733e-04] [ 1.13940684e-03 5.41178885e-04 -2.28401503e-03] [ 3.90074975e-03 -7.79639511e-04 -1.35614009e-03] [-1.21532866e-03 -4.67413323e-03 4.60736543e-04] [-1.45455231e-03 4.63086934e-04 1.02519431e-04] [ 1.08621173e-02 -1.11819738e-02 -4.83275436e-03] [-5.80687127e-03 5.39892511e-03 3.05256037e-04] [-9.87563821e-03 6.94615686e-03 4.02596187e-03] [-1.68065735e-02 3.97470573e-03 -6.01658038e-03] [ 3.64074294e-03 -6.12739313e-03 2.91869711e-04] [-9.20485077e-04 -6.26336015e-03 -1.89922757e-04] [-2.81856896e-03 9.31225042e-03 -3.39458208e-03] [-7.84306412e-03 -9.42537537e-03 -1.32087462e-03] [ 5.04481925e-03 5.63938630e-03 -4.63446021e-03] [-5.19086514e-03 3.31962284e-03 1.03165262e-02] [ 3.17210200e-03 8.78478709e-03 7.41564578e-03] [ 2.02784387e-03 -5.02604237e-03 3.88891087e-03] [-8.34580163e-04 -1.13138088e-03 2.53488531e-03] [ 5.88173400e-03 8.56525238e-03 1.05080510e-02] [-9.65736312e-03 -4.07388607e-03 6.05646090e-03] [ 2.60086268e-03 5.76275050e-03 -1.24984404e-03] [-2.11416091e-04 -3.33358511e-03 2.57898172e-03] [-2.72177677e-03 8.86423436e-03 -4.57840368e-03]] Final stress: [ 1.91704404e-02 4.19179303e-02 6.36911910e-03 -1.89786528e-05 5.97134618e-03 -8.91715494e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.06811741 0.30024337 0.03842261] [ 0.01624456 -0.09771854 0.0068049 ] [-0.0268435 0.0263495 -0.05639023] [ 0.01096848 0.02413762 0.02237894] [-0.04951739 -0.03566706 0.12474429] [ 0.05547891 -0.00719757 0.04675201] [ 0.01738185 -0.2937065 -0.0910684 ] [ 1.14998496 -1.13226896 -0.07779191] [ 0.0952043 0.73094027 -0.01929861] [ 0.10445681 -0.90086142 0.13986756] [ 0.57015507 0.4041955 0.0059198 ] [-0.08093274 -0.09968243 -0.07487979] [-0.0645804 0.13535088 -0.01212431] [-0.04256658 -0.54203125 0.08608376] [ 0.05970325 0.42035309 0.15145073] [ 0.04398009 -0.03673172 0.06104781] [-0.04072158 -0.04114686 -0.14440756] [-0.01234211 -0.06213704 0.10310334] [-0.92462585 -0.00200406 0.07944153] [ 0.46622108 0.45007528 0.15211308] [-0.67406215 0.28594939 0.13111862] [-1.02369041 0.21401068 0.01180539] [ 0.30788838 -0.31170846 0.13122469] [-0.2687246 0.77267037 0.02576946] [ 0.26586131 -0.04152735 -0.22152521] [-0.05177698 -0.0068122 -0.06824919] [ 0.05734054 -0.1261337 -0.12981585] [-0.08531359 0.04292801 -0.16537756] [-0.00921988 -0.08630464 0.01586907] [-0.0271647 0.02159564 -0.17926727] [ 0.01407486 -0.06196913 0.01680473] [ 0.05253876 -0.06489459 -0.00590396] [ 0.01873198 0.03672376 -0.01746812] [ 0.00391405 0.03206384 -0.00604524] [-0.10635425 0.01830647 -0.08244056] [ 0.11019004 0.03460983 0.00133149]] Final stress: [ 0.03061136 0.00982961 0.01586423 -0.00174888 -0.00594267 0.00048205] Minimization converged after 21 steps. Minimization converged after 18 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-7.21918498e-02 6.66258696e-02 -5.54791178e-02] [-7.51318457e-01 -6.67679723e-02 4.92765982e-01] [-1.24779027e-01 6.97409614e-02 -1.03735102e-01] [-8.15002513e-02 -1.57710095e-02 9.07816112e-02] [-4.39586189e-02 2.43313406e-01 -1.54248201e-01] [ 4.35133821e-02 -7.11161381e-02 -2.96049846e-02] [ 9.54656225e-02 1.09962534e-01 1.70659862e-03] [ 3.15738104e-01 3.20364652e-02 -3.52156964e-03] [-2.11596358e-02 1.95836359e-01 -2.54945112e-02] [-1.15094093e-01 -1.80346898e-01 -1.43042246e-02] [-1.59523956e-03 -1.09562702e-01 -2.54192249e-02] [-4.84059550e-02 1.35499947e-01 -8.76942901e-02] [-4.20805876e-02 -3.24933506e-02 3.03800693e-02] [ 1.04090402e-01 -2.77193075e-01 1.77320395e-01] [ 1.12021431e-02 8.15988645e-02 -3.58812021e-02] [ 2.51246728e-01 -1.36605227e-01 3.81309970e-02] [-6.25765961e-02 -2.72059115e-02 -1.11407968e-02] [ 6.86681137e-01 4.12776530e-02 -4.09163316e-01] [-1.79804583e-01 -1.16641023e-01 3.84034104e-02] [-9.32353646e-02 -5.97469579e-02 -5.53299066e-02] [-2.45054995e-02 1.28149540e-02 8.32024238e-02] [ 1.53878413e-02 -5.89923671e-02 2.91335693e-02] [ 6.87723985e-02 -7.13528838e-02 3.92154770e-02] [ 1.22274908e-01 1.31921420e-01 -5.07862534e-03] [-1.45651138e-02 5.51722215e-03 -3.34398052e-02] [-2.40074443e-02 -5.33994350e-02 8.21893814e-03] [-6.12391781e-02 1.19588471e-01 -5.78438981e-04] [ 1.00967076e-01 2.80549307e-02 -4.04867346e-02] [ 1.07724137e-02 -6.02334281e-03 -3.20308112e-02] [-1.27004733e-01 -4.15502372e-02 -1.18439964e-02] [-4.19463077e-02 6.70115168e-02 2.51172221e-02] [ 9.29630772e-03 2.88320675e-02 -1.84886129e-02] [ 4.65101381e-02 2.08517186e-02 -7.71072007e-03] [-8.29868563e-04 -3.28930844e-02 -2.37208658e-03] [ 1.02754969e-02 -5.06977541e-02 7.02177894e-02] [ 3.96043043e-02 1.78750064e-02 3.84517947e-02]] Final stress: [0.02361837 0.02811415 0.01168456 0.02778 0.00126063 0.01030225] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.31627865e-03 1.09063542e-01 6.90981234e-03] [ 3.35542312e-02 4.64378365e-02 2.73198917e-03] [-1.40912581e-01 2.54122556e-02 3.37445254e-02] [-5.21171480e-02 -4.96458436e-02 -2.90429386e-02] [ 3.19037219e-02 -1.08705351e-02 2.36546208e-02] [ 9.98312741e-02 -9.52030343e-02 -1.80528437e-01] [-3.70594427e-02 -1.71881276e-01 -5.69319626e-02] [ 3.32861884e-01 -5.65953938e-02 -3.73678748e-03] [ 1.18553786e-02 -2.75602285e-01 8.50108697e-03] [ 5.13792217e-03 4.84510412e-01 3.36564414e-02] [ 4.96661447e-01 2.25894724e-01 -1.60881055e-01] [ 1.60857721e-01 -2.00257769e-01 -7.16096367e-05] [-2.36890395e-01 7.64972133e-02 1.53019536e-01] [-2.42040071e-02 -6.40311320e-02 -7.76004780e-03] [ 6.52219229e-02 1.23337912e-01 3.55690335e-02] [ 5.35767344e-02 1.50095006e-02 4.05261588e-03] [ 2.02370192e-02 4.42757197e-02 -3.36875223e-02] [-9.60500512e-02 -3.38072348e-03 -5.63417617e-03] [-5.33248659e-02 1.90172064e-03 -8.86959750e-03] [ 3.84492428e-02 3.43777598e-01 7.64156934e-02] [-1.48142654e-01 6.88458008e-02 -1.00478809e-02] [-7.67326238e-01 -4.78826992e-02 1.52922320e-01] [ 5.43730764e-02 -2.20860746e-01 4.71153727e-02] [ 1.10214938e-01 -1.64901916e-01 -1.60185468e-02] [-7.45837174e-03 6.00711894e-02 7.55483765e-02] [ 7.01651255e-03 5.37426470e-02 -4.79906545e-02] [-2.41778006e-02 2.34873497e-02 1.68340828e-02] [-6.48413115e-02 -7.66932321e-02 -4.15512403e-02] [ 2.33430279e-02 -4.39954923e-02 2.49037967e-02] [ 3.25063591e-02 -6.40767444e-03 -2.18505006e-04] [-1.50235413e-02 -8.15007652e-02 2.85263108e-02] [-5.26401830e-03 3.30142330e-02 -8.44899743e-03] [ 9.66541770e-02 -3.80153403e-02 -3.47223403e-02] [ 5.40848327e-02 -5.48468048e-02 -6.00248963e-02] [-7.61775681e-02 -7.23004729e-02 -4.53818613e-02] [ 1.83122931e-02 -4.06519783e-04 2.74434423e-02]] Final stress: [ 0.03070729 0.02987539 0.01243455 -0.02938745 -0.00082729 -0.01104022] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 0.00177054 0.00201851 -0.0007109 ] [-0.00124582 0.00184909 0.0019968 ] [ 0.00820581 0.01112179 0.00929289] [-0.00938896 -0.06747394 0.03285291] [ 0.00090074 -0.00154241 0.00020426] [-0.00595726 0.0041609 0.00018108] [ 0.02907116 0.00753557 -0.03144434] [-0.04618271 0.03748603 0.00176593] [ 0.00067147 0.04556074 0.01895213] [-0.06299134 0.01221239 0.00738808] [ 0.0283666 -0.04619444 0.00410108] [ 0.07502401 -0.01396077 -0.01925792] [-0.00838692 -0.0118145 0.00225358] [-0.00119485 -0.00234314 0.00076842] [ 0.01604873 -0.00422681 -0.01336272] [-0.0184481 0.01513677 -0.01717275] [-0.00125461 -0.00041019 -0.00155563] [ 0.02321843 0.02257664 0.0092033 ] [ 0.01484097 0.0102907 -0.00730194] [ 0.00892272 -0.04175714 -0.00147712] [ 0.00229626 -0.00954575 0.00740078] [-0.03644643 0.04539255 0.01113854] [ 0.00541734 -0.07495456 -0.00346107] [ 0.00061992 0.01407308 -0.00424659] [ 0.00116739 0.00084596 -0.01550287] [ 0.00619086 0.01150135 -0.0026426 ] [-0.01404949 0.00753964 0.00158322] [ 0.00986984 0.0115232 -0.00298965] [-0.000887 0.00153059 0.01487647] [-0.01534715 0.00376608 0.00431834] [-0.00102727 0.00380981 0.01075654] [-0.00597314 0.006381 -0.01009602] [ 0.01988056 -0.0051547 0.00931292] [-0.02784788 -0.00154272 -0.011802 ] [ 0.00166236 0.00624272 -0.01939783] [ 0.00248325 -0.00163401 0.01407466]] Final stress: [-7.62523005e-03 1.92935975e-02 6.07976087e-03 5.75587426e-06 2.42669596e-02 8.16802730e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 7.87635636e-02 -1.16414386e-01 1.29446891e-02] [-2.20820016e-01 5.55778348e-02 -1.16968794e-01] [ 4.74301600e-02 -9.35574572e-03 1.42325175e-03] [-6.17739331e-02 -3.79007988e-04 4.90896721e-03] [ 3.31535502e-02 -1.41502959e-01 -1.54032374e-02] [ 1.40803519e-01 -2.51928104e-02 5.00305577e-02] [-3.67589996e-01 -6.23345326e-02 -1.86972441e-02] [ 9.20061294e-02 -2.59529921e-01 -1.05615567e-01] [ 2.52608061e-01 1.11491845e-01 1.30713047e-01] [ 2.71855539e-02 2.26278669e-01 -1.31307348e-01] [-1.00858163e-01 -1.72012440e-01 -1.83195520e-02] [ 9.95337331e-02 3.34224051e-02 2.01951785e-01] [-9.17097287e-02 6.60080454e-02 -1.34290948e-02] [-2.94080067e-02 1.01892664e-03 -4.94772935e-03] [-1.52286337e-02 5.30212642e-02 7.75405753e-02] [ 4.94648890e-02 3.27290574e-02 -7.85643640e-02] [ 1.35066244e-01 2.15286145e-01 -8.36409119e-02] [-1.81050132e-01 -2.90750273e-01 4.63448280e-02] [ 2.49586551e-01 -3.20927531e-01 -7.17599207e-03] [-2.60856417e-02 3.07216510e-01 -1.15994177e-03] [-7.63203217e-03 2.61558956e-02 3.46776360e-02] [-1.71133102e-01 3.37772889e-01 -1.67172320e-01] [ 7.21514809e-02 -5.45256325e-01 -4.36594699e-02] [ 1.02694930e-01 4.37386133e-02 1.76933305e-01] [ 3.71219464e-02 1.06191585e-01 5.98731529e-02] [-3.83800536e-02 -2.55384401e-03 1.10752815e-02] [-8.74015266e-02 2.52014487e-02 9.28495859e-02] [-5.99159819e-02 2.92018705e-02 -1.39310606e-01] [-1.15681593e-01 1.27466623e-01 1.36533983e-01] [ 5.69369304e-02 -1.07744142e-02 -4.04890198e-02] [-2.96541374e-03 8.33129946e-02 -1.53219286e-02] [ 6.31354481e-02 -6.88035434e-02 -6.45802477e-02] [ 1.97797030e-01 2.35310104e-01 -1.05444746e-02] [ 9.50984467e-03 1.36082816e-01 -3.98407374e-02] [-5.48870603e-02 6.30985265e-02 2.93950840e-02] [-1.12428552e-01 -2.89796338e-01 4.89528510e-02]] Final stress: [ 0.02282478 -0.00613286 0.00700685 -0.00020388 -0.02317668 -0.00207605] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-2.61118100e-03 -6.81510057e-04 1.38593140e-03] [-8.98582566e-04 -9.23324424e-04 -5.66528951e-04] [-2.64220306e-03 1.54956993e-03 1.05355152e-03] [ 1.78298046e-03 5.06346940e-04 2.22032223e-04] [-6.40829210e-04 -1.84695262e-03 3.94445301e-04] [ 7.26808930e-04 -9.33114269e-05 5.45064880e-04] [-1.38572556e-03 7.78003450e-04 -1.05559253e-03] [ 1.76356159e-04 -3.58101877e-04 7.77120207e-04] [-2.25319130e-04 4.60174668e-03 -3.47018145e-04] [ 8.49924449e-04 -4.47081955e-03 -1.42153847e-03] [-3.54977984e-03 6.98330645e-03 -5.70578399e-04] [ 4.65357457e-03 -2.87487557e-03 -1.43374428e-03] [ 2.10005220e-03 -5.31219452e-03 -7.41553958e-04] [ 7.49069218e-04 3.14290119e-03 -3.86376046e-03] [-1.24399058e-03 7.51440035e-04 -4.12525307e-04] [ 2.20375795e-03 -2.60313813e-03 -1.35130735e-04] [ 5.58622838e-03 -1.91170249e-03 -3.51397567e-03] [-1.21903072e-03 -1.11175881e-03 1.35361698e-03] [-2.40448887e-03 1.10984716e-03 -1.26792658e-03] [ 1.00662257e-03 -1.00233317e-02 -3.12887832e-04] [ 4.81900933e-03 2.73600851e-03 1.24935026e-03] [-1.58944782e-03 -1.11658470e-03 5.48377693e-05] [-4.36172007e-03 4.33004230e-03 5.14880225e-04] [ 7.83615661e-03 7.99188719e-04 1.23551389e-03] [ 3.66633751e-03 1.14193318e-03 -1.88192538e-03] [ 4.28484481e-04 9.23664470e-04 -7.60941939e-04] [-5.99289815e-03 2.41645784e-03 2.22913318e-03] [-1.83440839e-03 2.73690866e-03 -8.78468149e-04] [-7.57574916e-04 -8.42550601e-04 3.06208537e-03] [-1.70356559e-03 -1.71306778e-03 2.43754380e-03] [ 1.59750320e-03 -1.77650042e-03 -1.73504691e-04] [-2.20376350e-03 8.90577980e-04 -1.08553647e-06] [-1.44991391e-03 2.34452420e-03 -2.01522699e-03] [-1.79985713e-03 -8.44859681e-04 1.89062060e-03] [-8.64230133e-04 -7.65673355e-04 1.05395363e-03] [ 1.19564415e-03 1.52778998e-03 1.89423277e-03]] Final stress: [0.01386281 0.00848605 0.00115349 0.01311271 0.00066035 0.02221835] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-0.03577246 -0.01745254 0.08371522] [-0.0265175 -0.09636792 -0.05114519] [-0.06475973 0.04316496 -0.07232632] [-0.06605787 -0.06676863 0.01436869] [-0.01711448 0.19166836 0.01949746] [ 0.0245758 0.09802122 0.00595241] [ 0.32592482 0.17242848 -0.31592956] [-0.67779336 -0.60313491 -0.07269602] [ 0.35163383 -0.32869817 -0.07897538] [-0.15542389 0.06331089 -0.14521987] [-1.39127868 0.77682418 -0.29556323] [ 0.17200399 -0.40547745 -0.06422572] [ 0.10709019 -0.13727768 0.04989957] [ 0.28089789 0.10388116 -0.09026303] [-0.10701856 -0.0478111 0.00496542] [ 0.09479477 0.07798026 0.05202081] [-0.06633571 0.04992909 0.07410188] [-0.02744477 0.10893396 0.1436007 ] [ 0.39324573 0.4729507 -0.03739838] [-0.30121305 -0.62602746 0.21262746] [-0.08906289 0.7151438 0.12599201] [ 1.16928558 -0.32759741 0.32848182] [ 0.1175199 -0.31137897 0.11810728] [ 0.11603666 -0.15690841 -0.01664248] [-0.04343727 0.02090227 0.01416809] [-0.08144381 -0.08609677 -0.21924864] [-0.009734 0.0349233 0.05028771] [ 0.10825215 0.18402698 -0.1162241 ] [-0.05723861 -0.09432407 0.03706404] [-0.017651 0.02341571 0.11345889] [ 0.01374057 0.15470319 -0.05280894] [ 0.06988682 0.15253917 -0.10521793] [ 0.04078154 -0.11327639 0.09833534] [-0.15042852 -0.03798854 0.10770492] [-0.02807309 -0.06804817 0.00588369] [ 0.028129 0.07988692 0.0736514 ]] Final stress: [ 0.0262059 0.02335935 0.0122824 -0.00984596 -0.00191147 -0.01732856] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[ 3.90855328e-03 1.01719316e-02 -1.07863462e-03] [ 9.50113484e-03 2.84491893e-03 5.45840064e-04] [-2.06688262e-03 -7.57951017e-04 -6.96733239e-05] [-7.55183819e-04 -9.00570019e-04 1.59508180e-04] [ 8.57412107e-03 4.04406309e-03 -1.17677984e-03] [-9.40364452e-03 1.86121241e-03 -8.21183780e-04] [ 1.56248032e-03 -4.29665737e-03 4.37658214e-03] [ 1.14893127e-04 3.27016469e-03 1.01986406e-03] [-1.73697647e-03 -5.17503791e-03 -1.00543386e-03] [-8.64067837e-03 -6.95556615e-03 3.87643518e-04] [-8.25829799e-04 -6.96600087e-04 -2.09196212e-03] [ 8.92442440e-03 -5.54997182e-03 -9.69601154e-04] [ 5.87093451e-03 3.29625804e-04 -3.31729605e-03] [-1.71041903e-03 -9.18008908e-03 2.14133925e-04] [-5.60868584e-03 8.41616931e-04 4.18326602e-03] [ 4.35447588e-03 -1.28907357e-03 -2.38947698e-03] [-1.08289421e-03 -7.06902304e-03 1.24962186e-03] [-4.70165335e-03 7.33410713e-04 5.72999957e-03] [ 7.35301028e-04 -6.11870681e-03 -8.31940175e-03] [ 5.69755513e-04 -2.60483337e-03 -2.26859990e-03] [-7.38831424e-04 -2.19910774e-03 8.02857529e-03] [-1.42428947e-03 -3.34708287e-04 -1.22367998e-02] [ 1.09600649e-03 -3.49021464e-03 -1.24604684e-03] [ 1.52706761e-03 8.29597817e-04 9.27226204e-03] [ 1.62991301e-03 2.64486424e-03 -6.98027344e-04] [-1.52363552e-03 8.99057287e-05 1.82461788e-03] [ 2.12910009e-03 4.77243047e-03 -2.21989870e-03] [-2.05756372e-03 3.59830909e-03 3.85529462e-04] [-2.88466290e-03 7.56401178e-04 4.38505689e-05] [-1.71739639e-03 -2.48976116e-03 -4.66116337e-03] [ 4.14157191e-03 4.39215894e-03 -1.41805894e-03] [ 1.35691257e-03 1.53933573e-03 3.13447037e-03] [-2.64981565e-03 4.50704902e-03 4.64856462e-04] [ 1.30920674e-03 5.94215368e-03 5.66068312e-04] [-6.84605265e-03 3.50732595e-03 5.96416045e-03] [-9.30756655e-04 2.43139606e-03 -1.56281179e-03]] Final stress: [ 2.81393517e-02 1.48511497e-02 4.17743747e-03 -8.51914021e-06 -4.11974501e-03 -1.18530913e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 1.22060163e-02 -6.55188943e-03 4.00924266e-04] [-9.70517916e-03 6.77669215e-03 -1.87239283e-04] [ 1.00005182e-02 4.74405456e-02 1.17071969e-02] [ 9.54463847e-04 2.56808544e-02 -6.29629999e-03] [-4.61755498e-05 -3.08764750e-04 1.60204575e-04] [ 2.04334172e-02 1.82025883e-03 1.62642357e-03] [-9.50007220e-03 3.29679234e-03 -1.74295288e-02] [-6.30371790e-03 -6.71150273e-03 5.72007308e-04] [ 2.16360248e-02 -2.62614762e-02 1.53995662e-02] [-5.01539297e-03 -3.64571273e-02 8.53719894e-03] [-1.88391145e-02 -1.55402854e-03 -4.71268219e-03] [-2.00788459e-02 1.90216019e-02 -1.11739877e-02] [ 1.20990309e-02 -2.74502304e-02 -1.94716151e-02] [-3.20356304e-02 -2.83036299e-03 -1.00291971e-03] [ 1.58224702e-02 2.53713040e-02 1.64600003e-02] [-6.84615268e-03 -2.54947468e-04 1.51305039e-02] [ 1.03806652e-02 1.96324305e-03 4.87889577e-03] [-2.87858670e-03 -1.42802016e-02 -1.80965536e-02] [-3.13466731e-02 2.64703084e-02 2.27853737e-03] [-1.02640093e-02 6.25257042e-03 3.62490492e-03] [ 2.49480175e-02 1.15001204e-02 -5.74330237e-03] [ 3.73025991e-02 -2.58425018e-02 -6.74587003e-03] [ 6.84018561e-03 -1.04968344e-02 4.57067856e-03] [-1.75244323e-03 4.35567834e-03 6.58442255e-03] [ 2.47719365e-02 4.20545893e-03 -1.34497283e-03] [ 2.56311064e-02 -5.51624394e-03 -7.40020110e-05] [ 8.34272201e-03 -1.53566394e-02 -1.57761904e-03] [-1.19129119e-02 -2.01802436e-02 -4.90030667e-03] [-2.70514365e-02 7.49079697e-03 -3.47049586e-04] [-2.51111072e-02 -9.18770388e-03 4.16037175e-03] [-2.10236244e-02 -3.91806568e-03 5.67384048e-03] [-2.34079418e-02 -3.08502221e-03 6.60687625e-03] [-1.74507678e-02 1.67437531e-02 -7.67921518e-03] [ 1.18269218e-02 1.36119960e-02 -1.54377282e-03] [ 1.87982396e-02 -3.87234965e-03 4.30626142e-03] [ 1.85754480e-02 -1.88583887e-03 -4.35187819e-03]] Final stress: [-3.98454451e-02 -2.84041394e-02 -6.00345664e-03 2.64913816e-05 4.78228222e-03 -1.20981060e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[-3.63810042e-03 4.01629935e-03 3.29867931e-04] [ 8.09277187e-04 7.20105080e-03 -5.51135334e-05] [ 1.68768984e-02 -1.46615412e-02 -2.35313038e-03] [-1.14946592e-02 1.57998902e-02 -3.77493213e-03] [ 2.84394629e-03 8.95030735e-03 -2.68368049e-04] [-2.43949654e-03 1.18243575e-03 -9.55482251e-06] [ 2.67916062e-02 -4.28924437e-02 -1.49532953e-02] [-4.86199980e-03 8.02041349e-04 9.66035746e-03] [-6.22049946e-02 2.01006366e-02 1.01296125e-02] [ 3.65067449e-02 3.63706348e-02 -1.03190588e-02] [-1.58753985e-02 -3.13186689e-03 2.03241007e-03] [-1.63988447e-02 -9.98722955e-03 8.62365114e-03] [ 2.75603751e-03 7.14697570e-03 -1.14573576e-02] [-1.08608918e-03 -3.39978409e-04 -2.38965338e-03] [-5.21572393e-03 -5.97411736e-03 3.37143941e-04] [ 3.12290023e-04 1.91073189e-03 2.03634219e-03] [ 6.66465881e-03 -1.39734648e-02 1.09588593e-02] [-3.60064649e-04 -5.91822954e-04 3.12756748e-03] [-8.83861814e-03 -2.31018219e-02 -1.54824734e-02] [ 1.14730264e-02 -9.12475761e-03 1.00535464e-03] [ 1.69443651e-02 3.25501129e-02 -3.34503290e-03] [ 2.21539230e-02 3.25852431e-03 -1.07795301e-02] [-8.10023300e-03 -2.56667496e-02 4.97913629e-03] [-2.63635480e-02 -4.95309679e-02 1.98603159e-02] [ 7.73035815e-03 9.69193899e-03 -1.61480696e-02] [-2.02933775e-03 -1.87961339e-03 -4.21400841e-03] [ 4.46769970e-03 -5.91984759e-03 1.14078195e-02] [-1.57826585e-03 8.17352935e-03 4.60758657e-03] [ 6.64294215e-03 2.36920740e-03 3.53416146e-03] [-3.19422369e-03 9.82281218e-03 1.06979365e-03] [ 6.33555273e-03 -4.65207827e-03 7.55477513e-03] [ 1.98424043e-02 3.79448567e-03 4.94597906e-03] [ 7.12554742e-03 2.17746786e-02 2.06483090e-03] [-2.27642978e-03 9.82182121e-03 -3.70879034e-03] [-1.10460461e-02 6.24240590e-03 -1.08274064e-02] [-9.27520436e-03 4.47780910e-04 1.82021000e-03]] Final stress: [ 1.37801614e-02 2.79527175e-02 4.36704379e-03 9.11651359e-06 4.03661346e-03 -1.03676638e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 0.06176396 -0.01296304 0.0059262 ] [-0.06471979 0.05574735 -0.01870926] [-0.01220819 0.03950566 0.00333015] [-0.01582414 0.04553536 -0.0013311 ] [-0.04454693 0.01452329 0.00444151] [ 0.08240983 0.02071335 0.02322765] [ 0.33799773 0.5192014 -0.01541137] [ 0.14647853 -0.04986866 -0.00764359] [-0.12975488 0.28240622 0.03053492] [-0.140391 -0.2861475 0.01625165] [-0.21054642 0.10645966 -0.00189383] [ 0.16272121 -0.49903903 -0.01750776] [-0.15750337 0.13929444 -0.01957442] [ 0.05495756 -0.25169328 -0.00381981] [ 0.10547028 0.04946044 0.03165992] [ 0.06862282 -0.0536411 0.04016471] [ 0.06430288 0.25062726 -0.01335718] [-0.13341946 -0.17763913 -0.0376705 ] [ 0.06739859 -0.15520263 0.01620675] [-0.16800256 -0.51451092 -0.03536253] [-0.20350636 -0.12640329 -0.00931358] [ 0.07142252 0.0496512 0.03098106] [-0.09041117 0.53553863 -0.03094579] [ 0.25887345 0.09263294 0.0083939 ] [-0.09688476 -0.08025704 0.04743862] [ 0.01402024 -0.01934187 0.03053851] [-0.00233474 0.04094119 0.03290148] [-0.01907009 0.01771973 -0.01278314] [ 0.07343823 -0.04812507 -0.04347778] [-0.01931524 -0.03035491 -0.03126622] [ 0.06030389 0.06853583 -0.03885961] [-0.02180005 0.00826547 -0.05117684] [-0.0126073 -0.03841441 -0.03285044] [ 0.01513449 -0.0732234 0.05059703] [-0.09530423 0.08811415 0.01214965] [-0.00716553 -0.00804828 0.03821104]] Final stress: [-2.92834200e-02 -4.48692051e-02 -6.87985073e-03 3.72892055e-05 -5.31309812e-03 1.27618694e-05] Minimization converged after 20 steps. Minimization converged after 24 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.11165703 -0.05553193 0.01133131] [-0.02790912 -0.0758707 -0.0167575 ] [ 0.21375094 -0.09388078 0.09091123] [ 0.03441326 0.01743742 -0.01792179] [ 0.09448336 -0.20544752 0.14969594] [ 0.12855579 -0.08542183 0.07086627] [-0.00917954 0.03238412 0.03552588] [-0.35091846 -0.19049791 -0.02115452] [-0.57272142 0.47091322 0.06455845] [-0.52373168 -0.37086249 -0.00291934] [-0.50924538 0.15454839 0.07464882] [ 0.01622865 -0.2861001 -0.03026436] [-0.27619704 0.02542614 -0.16683943] [-0.0050417 -0.02304397 0.0320762 ] [ 0.02695274 -0.01849879 -0.02355881] [-0.06645981 0.01856223 -0.08807267] [-0.08149689 0.20086043 -0.11482018] [-0.00731882 -0.21482914 0.22649148] [ 0.75301034 -0.16211793 -0.0798093 ] [ 0.30692359 0.08351782 0.06622874] [-0.13040126 -0.14995247 -0.05181745] [ 0.06945884 0.45183906 -0.11346423] [ 0.38400478 0.09164802 0.07911649] [ 0.72376825 0.02329774 -0.04291769] [-0.05632272 0.24491322 -0.13286555] [-0.00903561 0.00427185 -0.00560715] [-0.04953095 -0.04358153 -0.02627052] [ 0.00164432 0.03155612 -0.01186271] [-0.0219273 0.08731744 -0.02673074] [-0.02885669 -0.07022182 0.09600205] [ 0.0107079 -0.09554214 -0.02078533] [-0.02028988 0.03263142 -0.01760738] [-0.04855958 0.03149368 0.02802713] [-0.03148426 0.07945257 -0.00550773] [-0.02645756 0.09108102 -0.02584361] [-0.0224741 -0.03175084 0.01791797]] Final stress: [ 0.03086294 0.03414829 0.01631138 0.01520493 -0.00132917 0.00589728] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-3.32902020e-02 1.57064306e-01 2.09833174e-01] [-9.32246229e-03 2.84632638e-02 -6.28715626e-02] [-7.08485907e-01 -3.72468306e-02 1.73087231e-01] [-1.36097778e-01 -2.06807734e-01 5.42676301e-02] [ 2.51893190e-01 2.19191250e-01 2.35323137e-01] [-1.64587259e-01 1.48349714e-01 -9.60272387e-02] [ 4.04200944e-01 1.52316191e+00 4.16305107e-02] [ 1.71533753e-01 -3.07384859e-02 1.51672553e-01] [ 1.95932902e+00 -1.90713408e+00 -1.97442095e-01] [ 6.11408151e-02 -3.28821524e-01 -4.42502229e-02] [-8.68975088e-01 1.86806452e-01 -2.13304096e-01] [ 6.15921779e-01 -1.21390761e+00 -1.68728304e-02] [-4.83152612e-02 -1.44737839e-01 1.87965720e-01] [-4.34166819e-02 -1.79584028e-01 -3.96706831e-01] [ 1.37195160e-01 1.25445908e-01 -3.52668023e-02] [ 2.56397122e-01 1.34882376e-01 -2.03962262e-01] [-1.18115590e-02 2.71435375e-01 -3.07649252e-02] [-2.86877201e-01 -2.10716770e-01 -6.54154030e-03] [-9.71525227e-01 1.54218120e+00 8.63439812e-02] [-5.42565082e-01 -3.34986770e-01 2.13967431e-01] [-1.05202388e+00 -9.45013569e-01 3.81026281e-02] [ 1.92274751e+00 -2.60190511e-01 4.26675865e-02] [-3.47593282e-01 8.37147757e-02 -4.48208175e-02] [-7.03490222e-01 1.29946967e+00 1.58191731e-01] [-4.11562295e-02 -2.28674295e-01 9.43825965e-02] [ 1.94973966e-01 -3.01919072e-02 3.77738643e-02] [-1.75521804e-02 -1.08313749e-01 1.57521242e-01] [ 1.69198002e-01 2.07916127e-01 -4.35182948e-02] [-1.07187038e-01 -4.52047877e-02 -1.20571186e-01] [ 1.36930184e-01 8.69574123e-02 -1.20600444e-01] [-1.88292776e-01 2.30263651e-01 1.42597964e-01] [ 4.96294487e-02 -1.24092139e-01 -1.35913086e-01] [-8.24062620e-02 2.34907996e-02 -2.03314399e-01] [-9.29728748e-02 1.35278110e-02 -1.11475374e-01] [ 1.25909799e-01 -1.66305115e-01 1.18417435e-01] [ 9.43768963e-04 2.20345737e-01 -5.95224082e-02]] Final stress: [ 0.01797698 0.02207736 0.01346104 -0.01479047 0.00084215 0.00669891] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 0.00371939 -0.00411504 -0.00058035] [ 0.00508671 -0.0229485 -0.00470681] [-0.02588376 -0.08295446 -0.03113599] [-0.07487524 -0.08118402 0.02399528] [ 0.00108063 0.00036743 -0.00042484] [-0.01422047 -0.0086041 0.00360773] [-0.14256692 -0.14852941 -0.00499596] [ 0.09787425 -0.01014912 -0.00421875] [ 0.10819143 -0.16083943 -0.0009205 ] [ 0.08256476 0.12251104 -0.02984102] [-0.09718265 -0.03591507 0.03966222] [-0.09035577 0.1207887 0.00475282] [-0.00469106 0.02192915 -0.01628471] [ 0.00680045 0.00392815 0.01045358] [ 0.00106465 0.00587743 -0.00523642] [ 0.03422898 0.03475093 0.01283771] [ 0.00132838 -0.03873643 0.00207065] [-0.0433789 0.02496653 -0.01995642] [ 0.07368414 0.00178532 0.0121265 ] [-0.06273314 0.21850453 0.00919829] [-0.10544159 0.10526367 -0.02321172] [ 0.00816181 -0.00947522 -0.00582559] [-0.04472359 -0.17291729 0.00711714] [ 0.07509618 0.02877096 -0.00372038] [ 0.00490592 0.00610725 0.01614387] [ 0.02164697 -0.00844311 -0.02205249] [ 0.03475661 -0.00111689 0.01465294] [-0.01383419 0.01076453 0.00203109] [-0.00335884 0.00341984 -0.01311789] [ 0.04800149 -0.00852234 0.02386081] [-0.03387209 0.0183826 -0.03590769] [ 0.01665612 0.03384253 -0.0113121 ] [ 0.01376053 -0.02384001 -0.01054158] [ 0.01391541 -0.01469601 0.04585307] [ 0.05067603 0.03653861 -0.01249176] [ 0.05391738 0.03448725 0.02811927]] Final stress: [-5.03908869e-03 1.07736810e-02 2.10764849e-03 -4.94682187e-05 1.53118101e-02 -2.24275043e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-0.03869572 -0.03060305 0.00527407] [ 0.00415915 0.0009056 0.00080052] [ 0.00147211 0.00384688 -0.00065343] [ 0.00194665 -0.00437982 -0.00166074] [-0.02016557 -0.00097342 0.00135011] [ 0.00256813 0.00326952 0.00099817] [-0.04903504 -0.05644228 -0.00375812] [ 0.03984717 0.05841293 -0.00897727] [ 0.07234156 -0.1561667 0.01381649] [ 0.01792581 0.12646124 -0.00025242] [ 0.03276086 -0.04887421 -0.00149807] [-0.03606831 0.08160502 0.0075298 ] [ 0.02342556 -0.02270221 -0.00504283] [ 0.00683479 0.04769522 -0.00707552] [-0.00834671 -0.01003702 0.01044397] [-0.01319502 0.00415559 0.00384042] [ 0.01220371 0.01109411 0.00176781] [-0.00674649 -0.0111562 -0.0105826 ] [-0.06170731 0.06083405 -0.00697653] [-0.0093914 0.09531555 0.00864162] [ 0.0220059 0.01400362 -0.00426423] [-0.00863275 0.03048304 -0.00668198] [ 0.02993188 -0.18444798 -0.00273656] [-0.0092991 -0.0145647 0.00732178] [-0.01017915 0.00214655 0.00337393] [-0.005173 -0.02648904 -0.00636428] [ 0.00383476 0.01159557 -0.00396703] [-0.00410877 0.027271 -0.00483399] [ 0.01947187 -0.00177972 0.00348448] [ 0.01122636 -0.02291231 0.01256127] [ 0.01559353 -0.0091492 -0.00332524] [ 0.01590705 0.00054935 0.00117396] [-0.00813257 -0.00406863 0.00443507] [-0.02114108 0.00451343 0.00344781] [-0.00914774 -0.00306495 0.00233147] [-0.01429112 0.02365317 -0.0139419 ]] Final stress: [ 1.14891864e-02 -8.59770997e-03 1.77613209e-03 9.00908626e-05 -1.49662567e-02 -1.01215521e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 9.95873557e-03 1.94931482e-03 -1.29344816e-02] [-6.78901798e-03 3.20026591e-03 -2.16845624e-03] [ 5.67236052e-03 -1.82668070e-03 -7.75355375e-03] [ 6.00807537e-03 1.49146613e-04 6.95460372e-03] [ 4.25991184e-05 -9.75621413e-03 -1.51323553e-02] [ 1.02643608e-02 -9.80309352e-03 -2.17849143e-03] [-3.24854046e-02 4.85321702e-02 1.41134303e-02] [-1.65094805e-02 -1.75120889e-02 7.50113436e-03] [ 5.99228432e-02 -1.19052368e-02 1.43632115e-02] [ 2.78266798e-02 3.20734940e-02 -1.47312365e-02] [-4.59787204e-02 3.12890911e-02 5.21558286e-03] [-2.40052982e-02 4.16981574e-02 3.82691143e-02] [-8.09934474e-03 6.38790614e-03 -4.40495664e-03] [-2.23230171e-04 -7.51779284e-03 9.09560008e-03] [ 7.01649234e-03 5.84992336e-03 -5.57621931e-04] [-4.95506404e-04 1.13239505e-02 -4.55637466e-04] [ 4.84049162e-03 -6.22925643e-03 -6.99445244e-03] [ 3.64415066e-04 -1.04856811e-03 -1.14376925e-02] [ 8.46276034e-02 -5.87846820e-03 -1.37818348e-02] [-8.83863332e-02 4.49577345e-02 -9.00488572e-03] [-7.70940497e-03 -8.03450528e-02 2.97365169e-03] [ 1.75850467e-02 4.13887823e-02 -6.58311971e-03] [ 1.12208726e-02 -1.26912701e-01 3.20841113e-03] [ 8.91786849e-03 -3.85551405e-02 1.23445729e-02] [-5.96717781e-04 -8.38893129e-03 -5.17440772e-03] [-5.87510217e-03 1.41243091e-03 1.19959262e-02] [-3.96411452e-03 1.48269151e-02 1.43400202e-04] [ 2.74722191e-03 8.70459786e-03 6.94746469e-03] [-1.11219592e-02 1.34721514e-02 1.55091328e-02] [-1.91157442e-04 -5.89006578e-03 -3.94342603e-03] [-4.71886271e-03 1.23296701e-03 -2.15909214e-03] [ 3.04034077e-03 -6.85789674e-03 -9.04784522e-03] [ 1.11241033e-02 1.47068787e-03 -4.22750311e-03] [-1.51661908e-02 5.50700751e-03 -9.59097748e-03] [ 7.38746458e-03 2.06096312e-02 -4.77049919e-03] [-6.25172941e-03 2.39086262e-03 -1.60270977e-03]] Final stress: [2.92233486e-02 3.02653998e-02 1.55077004e-02 5.32981172e-03 8.08989813e-05 1.23495167e-02] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 7.56264150e-04 7.23337995e-04 7.64976954e-04] [-1.64001717e-03 -1.91423565e-03 9.18941007e-04] [-1.14448369e-03 1.89655512e-03 1.11106046e-03] [ 2.73170508e-03 -1.10295423e-03 -6.75185598e-04] [-3.30195215e-03 -2.74501736e-03 -2.72346800e-03] [-4.17340877e-04 -6.07214350e-05 1.21848996e-03] [-4.82609249e-03 -3.00577847e-03 1.12686473e-03] [ 1.28295499e-02 -7.54270878e-03 5.88721762e-05] [ 4.31903536e-03 -8.08129591e-03 -5.83311666e-04] [-1.41096496e-03 -1.06612857e-02 -1.93645543e-03] [-1.67943381e-03 -1.05212966e-03 1.70085381e-03] [-1.38463771e-02 5.98880130e-03 5.46003137e-04] [-5.84916077e-04 -9.99308989e-04 -8.91816175e-04] [ 1.85642767e-03 -5.38446850e-04 -1.19364792e-03] [-1.26403479e-03 -2.60640775e-03 -1.04956927e-03] [-1.79909560e-03 -1.23893490e-03 2.73595930e-04] [ 1.43026572e-05 -1.40134586e-03 2.35183357e-03] [-7.13136020e-04 1.68163881e-04 1.16146376e-04] [-6.51114249e-03 -1.81143968e-03 1.60796603e-03] [-2.34944532e-03 1.63652798e-02 1.00325370e-03] [-4.91223557e-03 9.42966276e-03 2.74436930e-03] [ 6.58378458e-03 -9.82591566e-04 3.12630216e-04] [ 8.41795481e-03 5.46492435e-04 -2.68453640e-03] [ 5.58304210e-04 3.02222086e-03 2.66028456e-03] [-4.37305125e-04 2.63752388e-03 -4.54359187e-04] [ 9.47255309e-04 1.14198550e-03 6.96792499e-04] [ 5.65085619e-04 5.07787065e-03 -1.33931116e-03] [ 2.45072474e-03 -1.45648499e-04 -3.58127687e-04] [ 1.71982508e-03 -3.19945918e-03 2.05817201e-05] [-8.22831436e-05 4.68861453e-04 -3.66200810e-03] [-1.43893381e-04 -8.49239320e-04 -2.32709432e-03] [ 3.54680746e-03 1.92171502e-03 -8.24426145e-05] [ 1.80442219e-03 -3.25188059e-03 2.10737728e-03] [ 4.14693613e-04 5.88872797e-04 -1.88333817e-04] [ 3.22531208e-04 1.66055972e-03 -1.88917642e-03] [-2.77452384e-03 1.55292724e-03 6.97950365e-04]] Final stress: [ 2.85238824e-02 2.94641109e-02 1.56361464e-02 -5.26625082e-03 8.50731122e-05 -1.25702504e-02] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 0.07332872 0.01727101 -0.0133917 ] [ 0.003569 -0.03674522 0.0022529 ] [-0.00020381 0.01990814 0.00463543] [-0.00710367 0.00092704 0.00248501] [ 0.04655285 -0.05550072 -0.0101061 ] [ 0.04306823 0.01777311 0.00543694] [ 0.03629344 0.07870094 -0.00541359] [ 0.05947697 0.02053816 -0.01669942] [-0.01945541 -0.04127374 0.00375008] [ 0.07291592 -0.01562722 -0.03041491] [-0.07217401 0.01129207 0.04320892] [ 0.0659101 0.02108707 0.01538095] [ 0.02501851 -0.00461015 0.01635275] [-0.00643553 0.04620889 0.00804821] [-0.02097148 0.00542625 -0.01586413] [-0.02823035 -0.00655284 -0.00870428] [-0.01669438 0.02811084 0.00064592] [ 0.04003765 -0.00237565 -0.01308922] [-0.00947339 0.09030442 0.05384006] [-0.00653344 -0.05827857 -0.02064537] [-0.15570017 -0.04758342 -0.05190514] [ 0.05556129 -0.04041591 -0.00247998] [-0.07057254 0.06071036 0.04489815] [ 0.02272591 0.00944197 -0.00173721] [-0.00566042 -0.03599809 0.08462984] [ 0.02808498 0.04926531 -0.02838444] [ 0.00706266 0.01420495 -0.0086503 ] [ 0.0136459 -0.05411904 0.02278046] [ 0.02142636 -0.08627238 -0.02385461] [ 0.05699711 -0.02386226 0.01784743] [-0.00090505 0.00744477 -0.04894608] [-0.04036966 -0.06466585 0.00988587] [-0.06038814 -0.04999893 0.04812389] [-0.0414175 0.02354375 -0.05322066] [-0.04042626 0.03878948 -0.0108343 ] [-0.06896041 0.06293144 -0.01986139]] Final stress: [ 0.01936285 0.0102368 0.00255673 -0.00051482 -0.00180499 0.00051387] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-0.01174701 0.00029912 0.00282418] [-0.00717374 -0.04371764 0.00147229] [-0.01189683 -0.00063191 0.00161562] [ 0.00181031 -0.04469623 0.01086248] [-0.03287835 -0.00523205 0.00383481] [-0.00158976 -0.00327787 0.00134821] [ 0.05695036 0.09379934 0.00204047] [-0.01201681 0.01485306 -0.00164991] [-0.12253086 0.06873666 0.00052717] [-0.09347611 -0.10333316 0.00113076] [-0.02162247 0.00248662 -0.00612976] [ 0.04847891 -0.01355447 -0.02573662] [-0.03171655 0.03737824 -0.00600223] [ 0.0065862 -0.03931016 -0.01832555] [ 0.02626363 0.00187101 -0.02679223] [ 0.0210913 -0.00906929 0.00506711] [-0.00543344 0.00769362 -0.00754141] [-0.01825517 0.00477306 -0.0081014 ] [-0.05441548 -0.05587037 0.01366001] [ 0.02126723 -0.05832923 0.00187648] [ 0.11586851 -0.05035827 -0.00854087] [ 0.04596347 0.07582809 -0.0154137 ] [ 0.0300198 -0.03804933 -0.01023488] [-0.01159561 0.11437707 0.00100916] [ 0.01450656 -0.01691171 0.00253165] [ 0.01772423 0.04081004 0.00695714] [-0.01851003 -0.01715641 0.01568257] [ 0.02706768 0.00757126 -0.01183203] [-0.00278618 -0.02062072 -0.00471146] [-0.01116856 0.02912893 -0.01706038] [ 0.00973185 0.02218836 0.01926908] [-0.01688795 -0.02156358 0.008867 ] [ 0.01596615 0.00706659 -0.01293072] [-0.00921873 0.03708104 0.05142519] [ 0.0148017 0.01680282 0.00639415] [ 0.02082176 -0.04106254 0.02260761]] Final stress: [-2.78428346e-02 -1.60753029e-02 -3.11195135e-03 -8.11541455e-06 3.05104685e-03 -4.18565140e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-1.84911132e-03 2.03067391e-03 1.14851967e-04] [ 1.66949421e-03 1.43342679e-03 1.77565003e-04] [-1.45307797e-04 -4.43103373e-03 -7.98161371e-04] [ 1.77634884e-03 -4.28334610e-03 8.07771551e-04] [ 1.53905220e-03 1.99745328e-03 7.83350268e-06] [-1.60003012e-03 1.57839641e-03 -1.38265454e-04] [ 7.91395792e-03 1.08147115e-02 7.43202142e-04] [ 2.39658222e-03 -2.01940735e-04 -1.59054142e-03] [-8.68888164e-03 1.01299216e-02 -1.95830291e-03] [-6.73748123e-03 -1.06374949e-02 -4.07180263e-04] [-1.40823023e-03 1.17355608e-04 -3.33427592e-05] [ 9.11113810e-03 -1.24081872e-02 9.20834209e-04] [ 1.05294068e-03 1.73926575e-03 -2.41741344e-03] [-7.01546478e-04 -4.33939216e-03 -1.02822484e-03] [-1.64017222e-03 -8.45601103e-04 -9.43747847e-04] [ 3.06445485e-04 -7.39106373e-04 1.79031202e-03] [-9.43484112e-04 9.21100447e-04 -1.68781922e-03] [ 8.31270865e-04 6.16748743e-04 -5.41975497e-04] [ 6.29412091e-03 -1.05245627e-02 -2.42943152e-03] [-6.79789276e-04 -1.78440013e-03 -6.58043561e-04] [-6.28881152e-03 -9.09871462e-03 2.85730580e-03] [-6.76652030e-03 8.29287261e-03 -3.13056284e-03] [-1.20024080e-03 4.44975511e-04 5.24805281e-04] [ 7.06863256e-03 8.13979713e-03 2.01507731e-03] [ 3.37739503e-05 -1.52889683e-03 3.58144111e-03] [-1.71201390e-03 -5.02797008e-04 2.79326366e-03] [ 1.24927372e-03 5.99895830e-04 -2.08269132e-03] [-1.60243284e-03 6.96648636e-04 1.72834911e-03] [-1.18067353e-04 -3.03212253e-03 -4.63624927e-04] [ 2.26516445e-03 5.16328807e-04 -2.16575567e-03] [ 2.35797599e-03 2.97002020e-03 -2.54068828e-03] [ 1.93372686e-04 1.68056660e-03 1.14941650e-03] [ 3.76470394e-05 2.54438981e-03 1.55563818e-03] [-3.31965173e-04 2.77796277e-03 1.70756787e-05] [-1.12497775e-03 4.33269054e-03 4.26132839e-03] [-2.55812776e-03 -1.76063242e-05 -3.02982555e-05]] Final stress: [ 9.75270945e-03 1.92904102e-02 2.61837197e-03 -7.66941652e-06 2.69971547e-03 1.38876652e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 3.64603450e-03 4.22286399e-03 -1.38685566e-03] [-9.62790743e-03 -6.83452537e-04 -1.61532085e-03] [-2.36730699e-03 3.98834215e-03 1.88210717e-04] [-1.81646176e-03 2.40362178e-03 -4.06808562e-04] [ 5.05115132e-03 -3.56313944e-03 -8.77017530e-04] [ 5.92347338e-03 1.58803456e-02 2.19909500e-03] [ 1.73841316e-02 3.57914279e-02 4.54807033e-03] [ 2.00639776e-03 -9.58795085e-03 1.54754333e-03] [-2.53446322e-02 2.81402105e-02 -6.75006240e-03] [-5.46075515e-03 -1.52721992e-02 -5.62390650e-03] [-2.96335490e-02 5.45689152e-03 3.90237136e-04] [ 1.20598336e-02 -1.81749474e-02 4.01823246e-03] [ 1.18312182e-03 -2.65819784e-03 4.74817912e-03] [-5.43741258e-04 4.79704457e-03 1.28565112e-03] [-3.29965207e-03 -2.70493470e-03 -3.10845882e-03] [-2.80176405e-04 3.76517208e-03 -8.54332915e-03] [-1.40281187e-03 -7.67859447e-03 -1.36611651e-03] [ 8.20030461e-05 1.92755149e-03 3.94489002e-03] [ 1.17727069e-02 -1.43192694e-02 2.37968372e-03] [-2.00606691e-03 -3.36355783e-02 2.10665825e-03] [-1.08677616e-02 -1.55579581e-02 -8.08313082e-05] [-2.50018922e-02 2.49270325e-02 -6.44277292e-03] [ 4.50575795e-04 -1.60421153e-02 -1.03842229e-03] [ 3.97699984e-02 1.84585379e-02 -1.09375455e-04] [ 2.46569428e-03 3.10160776e-03 5.34252987e-04] [-8.35767858e-03 3.36693167e-03 5.98417310e-03] [-1.74681847e-04 -2.53781684e-03 3.15432441e-03] [ 8.15656296e-03 8.10519376e-03 -2.99782720e-04] [-4.98891049e-04 -2.08007048e-03 -4.52644158e-04] [ 7.62780303e-03 3.45037434e-03 -5.57419045e-03] [-1.45133998e-03 -2.66745409e-03 -1.15325416e-03] [ 1.03140982e-02 -4.41963889e-03 -2.44565352e-03] [ 4.15501828e-03 -7.96722795e-03 -4.33470093e-04] [-1.63804445e-03 -2.99403309e-03 2.78722422e-03] [ 9.92922923e-04 -2.85827892e-04 4.03992874e-03] [-3.26817707e-03 -4.95274269e-03 3.85191838e-03]] Final stress: [-1.65982852e-02 -2.65147223e-02 -3.56472661e-03 -4.09960133e-06 -3.21874182e-03 -5.23182430e-05] Minimization converged after 21 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-1.88861590e-01 -1.85819001e-01 7.67203641e-02] [ 6.17907269e-02 -2.76859458e-02 8.43023131e-03] [-8.26500729e-03 1.36797295e-01 7.27908999e-03] [ 7.26017840e-02 -1.22276045e-01 3.54407437e-02] [-8.01579046e-02 4.68022537e-02 -3.44566911e-04] [ 2.27231323e-01 8.68192757e-02 5.08531548e-02] [ 2.00408476e-01 2.55014575e-01 2.04422096e-02] [-3.81372705e-01 -8.10462892e-03 -4.85640512e-02] [ 1.96197599e-02 -3.88842141e-01 1.99526100e-02] [-9.09244232e-03 2.17123269e-02 2.23966504e-02] [ 3.40230212e-01 -1.41237067e-01 -1.11629171e-03] [-7.91384446e-03 2.40024318e-01 -5.75993565e-02] [-4.21171501e-01 -4.30885650e-02 -7.24001404e-03] [-1.70540586e-02 5.65561628e-02 -5.69064386e-02] [ 3.35387548e-01 3.88325560e-02 7.19145835e-03] [ 1.10466502e+00 -7.18980102e-02 4.06651692e-02] [ 7.85350268e-02 -7.49182950e-02 2.35254453e-02] [-1.11416244e+00 -3.31969825e-02 -6.23089587e-02] [-3.03964649e-01 2.19343655e-01 3.09760329e-02] [-1.50737860e-01 2.91560916e-01 -5.01896595e-02] [ 1.15985470e-01 -3.02745428e-01 -6.07176806e-02] [ 4.86313593e-03 -3.46243983e-01 -2.97373500e-02] [-7.18778928e-02 6.42010668e-02 5.56197934e-02] [ 2.45611533e-01 1.23921638e-01 7.43881054e-02] [ 7.39940794e-02 -1.25535640e-01 -4.91188351e-02] [ 1.80088151e-01 3.11302033e-02 4.91787961e-02] [-2.62057087e-02 -1.41423646e-01 -1.05617924e-01] [-5.12413921e-02 -1.15368277e-01 -5.33596722e-02] [-9.25631897e-02 1.04780388e-02 9.32187903e-02] [ 6.39274434e-03 2.39534493e-02 5.94193574e-02] [-5.47364001e-02 1.46668825e-01 1.86850002e-02] [-2.27878752e-01 4.25162354e-02 -9.82105334e-03] [-6.14804321e-02 1.50939664e-01 1.77805370e-02] [ 9.38607106e-02 1.17702579e-01 7.58954051e-02] [ 1.09310517e-01 8.58651442e-02 -4.10594324e-02] [-1.83845017e-03 -6.24565206e-02 -1.54357659e-01]] Final stress: [-4.09862389e-03 2.68613150e-03 2.21381955e-03 9.50083736e-03 3.02002080e-05 9.25050802e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-3.75222896e-02 -2.17925072e-02 -3.55214285e-02] [ 1.77373759e-02 -6.33877100e-03 6.08586786e-03] [-3.15432456e-02 -1.07720341e-02 6.66315201e-03] [-2.21871031e-02 1.21058976e-02 2.18130100e-02] [-8.56229427e-03 5.55949594e-02 5.50498979e-02] [-1.49352999e-02 -9.86567342e-03 -4.35344873e-03] [ 2.08218612e-01 1.49381447e-01 5.64156141e-02] [ 2.33679203e-01 -7.47320894e-02 8.62857122e-03] [-4.80800732e-02 3.75338912e-01 4.93618643e-02] [-6.76156869e-02 1.64530099e-01 7.32637372e-02] [ 3.54230686e-02 -1.02056677e-01 -3.93426759e-02] [-1.26199933e-01 1.96447124e-01 4.96188672e-02] [ 2.02742772e-02 -1.78119292e-02 1.21887777e-03] [ 1.66407943e-02 2.61298078e-03 2.20014937e-02] [ 1.42011271e-02 1.38859709e-02 -6.75107601e-03] [ 1.82388216e-02 9.56776006e-03 -2.88802249e-02] [ 2.19044053e-03 2.63593904e-02 1.85561771e-02] [-2.21392842e-03 5.13306232e-03 -4.01686254e-03] [-6.29664323e-03 3.37554440e-02 1.65587258e-02] [-1.21711210e-01 -4.75079427e-01 -1.16843401e-01] [-2.91858004e-01 3.39699622e-02 3.00541783e-02] [ 2.49643313e-01 -2.29717394e-01 -3.18775396e-02] [-4.94803865e-02 8.82777813e-02 -2.76739871e-02] [ 1.18501226e-02 -1.51783271e-01 -6.01010780e-02] [ 1.56136688e-02 2.80296328e-02 9.47180094e-03] [ 7.25388913e-03 -2.53848897e-02 2.47685069e-04] [ 3.22058421e-02 -2.53430524e-02 -2.39578218e-02] [-4.75001333e-05 -2.75394426e-02 1.01074590e-02] [ 2.14882516e-02 1.77686423e-02 -1.68327557e-03] [ 3.85124748e-03 -1.68757498e-02 2.73246493e-04] [-8.66340659e-03 -4.23315270e-03 -8.28771615e-03] [-1.82724309e-02 -9.12146999e-04 -1.02029609e-02] [-9.81872537e-03 1.05275377e-02 -2.73535131e-02] [-5.70460961e-02 7.73738708e-03 1.81762332e-02] [-2.26458784e-03 -1.92819559e-02 -6.53212713e-03] [ 1.58087887e-02 -1.15038266e-02 -2.01873224e-02]] Final stress: [ 0.02722874 0.02642172 0.01669549 -0.00953954 -0.00017936 -0.00318174] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 0.07596358 -0.05741823 -0.03153694] [ 0.01015169 -0.0224277 0.00212604] [ 0.05457365 -0.14529596 -0.0396742 ] [-0.05358416 -0.16211583 0.04625708] [-0.03560528 -0.03806854 0.02775025] [-0.03635209 0.03917824 -0.01305619] [-0.06927281 -0.00976907 0.01590656] [-0.01245406 0.06253567 0.02906238] [ 0.04290285 -0.01563057 -0.06918203] [ 0.18661916 -0.03533661 0.05750238] [-0.0784147 -0.0551962 0.00696753] [-0.13627096 0.12293632 -0.00167255] [ 0.05336226 -0.00199676 0.0020994 ] [ 0.00423045 0.19933274 0.0176083 ] [-0.02391598 0.04873996 0.0296969 ] [ 0.01371171 0.06088288 -0.07128221] [ 0.01085961 0.16089471 0.02795497] [ 0.04259414 0.05152967 -0.00426028] [-0.08780014 -0.05706879 0.00691647] [-0.02912104 -0.06169977 0.01108737] [ 0.06440839 -0.06305714 -0.00443527] [ 0.15857517 -0.05898744 0.04075444] [ 0.04509068 -0.08147359 0.00091826] [-0.11049579 -0.03171482 -0.04926599] [-0.09763162 -0.05691812 -0.02063416] [-0.16035143 0.01024628 0.0603972 ] [ 0.02079952 0.11386491 -0.06011243] [-0.00624033 0.04749623 0.07982654] [ 0.13744496 -0.05532913 0.01442637] [ 0.08135864 0.00170639 -0.0140131 ] [-0.06039445 0.01254534 -0.02931032] [ 0.01760489 0.07994975 0.02749837] [-0.01495936 0.02660951 -0.04721935] [-0.02389497 -0.04993005 -0.00923245] [ 0.06547067 -0.02515086 0.03854028] [-0.04896285 0.04613658 -0.0784096 ]] Final stress: [-0.00558536 0.00528437 0.00028475 0.00013765 0.00972073 -0.00046637] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-2.24206051e-02 -9.06842338e-02 1.04710910e-02] [ 2.07905493e-01 1.75198654e-02 3.60388460e-02] [-1.36415037e-02 -2.51509533e-02 1.30324426e-02] [ 9.23407672e-02 -2.63019105e-03 1.81029650e-04] [-1.72239510e-01 -2.30160648e-02 7.76734033e-03] [-3.38319313e-02 -4.94555913e-03 -2.08941847e-02] [ 2.66193667e-01 5.55704459e-01 1.91644111e-02] [-2.03253066e-01 -1.36473673e-01 -2.12563751e-02] [ 5.74041877e-02 -1.48282314e-01 3.45922869e-03] [-7.07988046e-01 -4.22805755e-01 -1.75892960e-02] [-2.55684433e-01 -1.92896337e-01 -1.15984838e-02] [ 7.44749689e-01 -5.25931612e-01 1.61612013e-02] [ 5.42757057e-02 -2.91247895e-02 1.32829902e-02] [-1.22185864e-01 -5.35622805e-02 -3.43498398e-02] [ 7.67723858e-03 1.73608316e-01 -1.26195267e-02] [-7.72744610e-02 8.08849631e-02 -8.65939140e-03] [ 2.04523093e-02 -4.34093584e-02 1.68057180e-02] [-1.68001271e-01 -7.25284044e-02 -3.09539773e-02] [-5.90341150e-02 1.03025166e-01 -3.19702207e-02] [-1.46560253e-01 -2.25222118e-01 9.41466086e-02] [ 2.14385208e-01 -2.42866679e-01 -2.98702043e-02] [-2.00233695e-01 5.30632669e-01 1.46978717e-02] [-3.05435271e-02 3.72959565e-01 6.59242270e-03] [ 5.14305484e-01 5.14339761e-01 2.71503080e-02] [-4.54485550e-02 -1.54383732e-02 -3.00774850e-02] [ 1.31499088e-01 -6.15632794e-02 1.12772340e-02] [ 3.48389313e-02 -4.20085833e-03 -3.48648584e-02] [-7.62282311e-02 5.21044414e-02 5.78747797e-03] [ 1.18724027e-02 -5.08436677e-03 -4.48068987e-02] [-7.21847396e-02 -7.94947507e-02 6.71244816e-02] [-1.01228180e-01 -1.49059298e-01 -1.28822536e-02] [-7.64196291e-03 4.89545828e-02 7.21389483e-02] [-6.47295853e-02 9.02887907e-03 -1.47829116e-02] [ 6.83133819e-02 1.65054790e-01 1.06956051e-03] [ 7.79758182e-02 -1.30074370e-01 -3.15072001e-02] [ 7.61641636e-02 6.06281620e-02 -4.76661050e-02]] Final stress: [ 5.66925175e-03 -5.92349251e-03 1.55955479e-06 6.87235380e-04 -9.64551440e-03 -6.87409070e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.02685944 -0.03505176 0.0151075 ] [ 0.00524361 0.00596881 -0.00845351] [ 0.04632769 0.00421641 -0.00838949] [-0.00341375 0.05466683 0.00243648] [-0.01316101 -0.00823508 0.00600984] [-0.00805186 0.01236443 -0.05394633] [ 0.05170185 0.03576747 -0.00622216] [-0.30459145 -0.15798351 0.01421305] [-0.24751575 0.14964995 -0.01114354] [-0.05671114 -0.0261841 -0.04421993] [-0.04909479 -0.04105086 0.13620352] [ 0.04715238 0.3509376 0.0005004 ] [-0.05098166 0.08589415 0.00261555] [ 0.0436058 -0.076649 0.03820431] [-0.02724279 0.04515433 0.05273784] [-0.0248378 -0.01219004 -0.02143186] [ 0.08481026 -0.05931911 -0.06796767] [-0.02013883 -0.0111323 0.01823545] [ 0.18650566 -0.15697162 0.0216969 ] [ 0.18782039 0.10906258 0.01481168] [ 0.16702022 -0.0342108 0.01401942] [-0.02046472 -0.08252969 -0.00303355] [-0.05287375 -0.33032185 -0.02641037] [ 0.02993616 0.1083927 0.00768317] [-0.01248338 0.00133891 0.03349775] [ 0.00287085 0.06842991 -0.04934282] [-0.05079479 -0.01324169 0.04963881] [ 0.01491359 0.03050679 -0.04197448] [-0.01479998 -0.01499488 0.0309982 ] [-0.03835023 0.0375161 -0.01741873] [ 0.0266153 -0.00266545 -0.03901963] [ 0.00164792 0.02387257 0.02854202] [ 0.03414534 -0.05061882 -0.00062912] [ 0.00492364 -0.03455567 -0.02230969] [ 0.02965972 0.00921676 -0.01948504] [ 0.00374787 0.01494991 -0.04575399]] Final stress: [ 0.0283762 0.02969447 0.01540563 0.00354303 -0.00016477 0.00736936] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-5.18977554e-02 2.17422673e-02 -2.55656584e-02] [-1.63878759e-02 9.25836091e-03 2.45560336e-02] [ 1.21162127e-01 -7.36058928e-03 -3.44238025e-02] [ 1.57727852e-02 4.51606308e-02 -2.07718922e-02] [ 3.46252614e-02 2.50269157e-02 1.85197398e-02] [-6.42376267e-02 -6.63742093e-02 3.04621576e-04] [ 1.48501129e-01 -3.04747257e-01 1.01320072e-02] [ 1.06735793e-01 8.20886738e-02 1.23978629e-01] [ 7.13975127e-02 2.47929435e-02 9.77116662e-03] [ 2.95932559e-02 -1.53174951e-01 2.09454261e-01] [-5.68700546e-01 4.41624210e-01 -7.78834045e-02] [-3.93513130e-02 -2.24093664e-01 -4.76217348e-02] [-7.35296674e-02 -7.97656798e-02 1.16309600e-01] [-7.26669471e-03 1.69020260e-02 -7.68096390e-02] [ 3.80805802e-02 6.79324252e-02 2.36226318e-02] [-4.02435366e-02 -3.63339126e-02 6.05682963e-02] [ 4.64926388e-02 6.47099083e-02 5.39618113e-02] [-6.14660936e-02 -4.80920767e-02 -1.07545829e-01] [ 3.33802892e-01 -1.71501624e-01 -2.43161309e-02] [-3.52362586e-01 1.51671263e-01 -4.87064851e-02] [-3.05808968e-01 4.50664252e-01 1.00055798e-01] [ 2.22682554e-01 -1.01663574e-01 5.89273643e-02] [-5.44464949e-01 -1.98655023e-01 -2.31656392e-02] [ 9.04638307e-01 3.27428968e-01 -6.93731632e-02] [-8.08759635e-02 2.10338947e-02 -8.00448849e-02] [ 5.98841809e-02 -5.41655319e-02 3.66388182e-02] [ 2.30341092e-02 -7.44745559e-02 -1.73422830e-02] [-3.85343290e-02 -4.12576265e-02 6.72542405e-02] [ 4.84981914e-02 4.50518667e-03 -6.32996399e-02] [-3.15333468e-02 -5.35186570e-03 -5.04258658e-02] [-2.90002745e-02 -5.36664461e-02 2.39820598e-02] [ 6.09214458e-02 4.08731386e-02 -3.56705136e-02] [ 1.05777583e-02 -2.27228543e-02 -3.23775671e-02] [-3.57140521e-02 -6.71183257e-02 -1.99910018e-03] [ 1.13436178e-01 -9.28817780e-03 6.28297781e-02] [-4.84611223e-02 -7.56071200e-02 -1.63523624e-01]] Final stress: [ 3.44786046e-02 2.80196638e-02 1.44154645e-02 -3.61859370e-03 5.40797345e-05 -6.25798498e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[ 5.20671270e-03 3.86549937e-04 -6.61702322e-04] [-1.98373631e-03 1.81822106e-03 -4.70846018e-04] [ 2.59111532e-04 -7.49866595e-05 -1.50147794e-04] [ 1.28802642e-03 1.03342041e-03 -3.56174257e-05] [-1.51500928e-03 -1.15016652e-03 -1.50311972e-05] [-2.94294328e-04 -4.88226348e-03 -4.58597673e-04] [-5.48084879e-03 -2.61807207e-03 3.34327884e-03] [ 6.88889908e-03 -2.00361054e-03 -2.14744211e-03] [ 3.80347797e-03 -3.37323191e-03 8.94079660e-05] [ 5.73624358e-03 3.95685482e-03 4.30382588e-04] [ 2.05663742e-03 4.67998851e-03 9.91414238e-04] [-5.02039699e-03 3.37050649e-03 -3.59159652e-03] [-3.25813879e-04 4.74343608e-04 4.32685657e-04] [ 7.68727162e-05 7.93287176e-05 6.90309507e-04] [ 2.77156676e-03 -1.94714474e-05 -1.27899071e-03] [ 6.25811648e-04 -1.86085267e-03 2.93313514e-03] [-2.75664281e-04 3.87380032e-04 3.06660423e-04] [ 7.62364406e-04 -1.72318048e-03 -2.73153400e-03] [-1.55256205e-03 1.62170538e-03 1.85238249e-03] [ 1.67027973e-03 1.03651218e-02 1.25188774e-03] [-5.04082978e-04 1.55784138e-03 -9.54692737e-04] [-9.41874800e-04 2.48802692e-03 2.20734656e-03] [ 2.35737257e-04 -8.68145923e-03 -2.56369718e-03] [ 2.88379173e-04 2.38388430e-03 -2.00587890e-03] [-1.63666388e-03 2.74812053e-03 6.77077839e-03] [-4.37836600e-03 -1.57991861e-03 6.29866456e-03] [ 8.85355358e-05 -7.70712767e-04 1.30794859e-03] [-2.57796868e-03 -2.21382177e-03 -5.42475326e-03] [-1.43830717e-03 2.71959965e-03 -4.46479284e-03] [-5.17307668e-04 -2.74022658e-04 -7.73221942e-03] [-2.20278116e-03 -2.95109029e-03 -5.52379629e-03] [ 1.20176693e-03 -6.08468374e-04 -3.62711812e-03] [-3.28221639e-03 1.47211846e-03 -3.79757181e-03] [ 7.51374933e-04 -2.32250009e-03 8.77545276e-03] [ 9.88182213e-04 -3.83013770e-03 3.34281682e-03] [-7.72085395e-04 -6.05044691e-04 6.61147407e-03]] Final stress: [ 1.29960628e-02 6.99728497e-03 1.39385456e-03 3.76972221e-06 -1.73493659e-03 -4.06260315e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 5.71122103e-03 2.39389247e-03 -6.72690330e-04] [-2.96664099e-03 2.37964170e-03 -3.33694503e-04] [-1.58509468e-03 3.84280867e-03 7.32038559e-04] [-6.47119195e-04 -1.12414039e-03 6.94249748e-05] [ 3.49514396e-03 -1.10679044e-03 -3.47310711e-04] [-1.34049387e-03 -9.00330009e-04 7.36814549e-05] [ 2.64576052e-04 5.77799725e-03 -8.03577637e-04] [-4.92302240e-03 1.24397991e-03 3.41705524e-03] [-1.03303685e-02 8.42861376e-03 -1.45570152e-03] [-2.97984190e-03 -5.65121591e-03 1.40931993e-03] [ 3.72274555e-03 -2.64749010e-03 -4.23872243e-03] [ 7.70629690e-03 -1.05090810e-02 2.49418223e-03] [-3.89408810e-03 1.79940242e-04 -1.39959518e-03] [-1.76893647e-03 2.61161079e-03 -2.46277083e-03] [ 9.72226199e-04 -2.55644793e-03 2.19905353e-03] [ 2.05606958e-03 1.25698221e-03 -2.97847458e-04] [ 1.31289122e-03 -2.90868708e-03 6.47575981e-03] [-2.24099943e-03 1.87052205e-04 -3.08559797e-03] [ 2.32231580e-04 -1.21048746e-03 -2.58815365e-03] [-2.09900772e-03 -1.33556136e-02 4.31520827e-03] [-2.59990345e-03 1.77546340e-03 -3.58043352e-03] [-2.78592966e-03 2.58807549e-03 -9.70399788e-04] [ 4.28873736e-04 1.39738007e-02 2.64341849e-03] [ 9.29690592e-05 -2.29670101e-03 2.96590049e-04] [ 1.01007011e-03 -3.61569231e-03 1.77828312e-03] [ 6.55410396e-03 6.24595114e-04 2.41382670e-03] [ 3.20502584e-03 -1.30667388e-03 -1.45671292e-03] [ 6.58584016e-04 -4.20381370e-03 -5.89516403e-04] [ 1.91017019e-03 -2.30346767e-03 -5.20817463e-03] [ 4.58917468e-04 4.26518797e-04 1.34512497e-03] [-8.40885525e-04 5.60188281e-03 -9.51281785e-05] [-9.66600256e-04 -2.28804497e-03 -9.80560331e-04] [-2.28456188e-03 -3.36713273e-04 -2.50869829e-03] [-8.77814338e-05 5.12341119e-03 -3.53460470e-03] [-1.80346534e-03 9.66471490e-05 7.15988822e-03] [ 6.35262430e-03 -1.91523199e-04 -2.12964588e-04]] Final stress: [-1.70726874e-02 -1.06822194e-02 -2.11392557e-03 2.62133999e-05 1.99584564e-03 -3.11375753e-05] Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-3.31240840e-03 -3.97938728e-03 6.27355040e-04] [-2.12535375e-03 -9.68721534e-03 4.50339544e-04] [-2.77549654e-03 1.51755006e-03 2.46303303e-04] [-3.70600988e-03 -1.20336917e-03 2.17771651e-04] [-6.93272832e-03 2.22847372e-03 8.93382063e-04] [-7.39730799e-04 7.66364737e-03 6.03699366e-04] [ 8.02934054e-03 -8.73399525e-03 -8.76206569e-04] [-3.07328296e-03 -5.48522329e-03 2.02757226e-03] [ 1.04756461e-02 4.04629210e-03 -2.71766376e-03] [ 1.84447503e-03 -4.16542014e-03 -2.61928049e-03] [ 6.09272360e-03 5.11833806e-03 1.30910713e-03] [-1.33817538e-03 5.75151055e-03 -4.18149044e-05] [-2.22849324e-04 1.80987184e-03 7.27137061e-04] [ 4.71571905e-04 -7.96394961e-04 -1.59185583e-03] [-1.87164260e-04 1.98742480e-03 -2.76082892e-03] [ 1.94237524e-03 -3.77648116e-03 -1.49431026e-03] [-8.42516310e-04 -8.20943300e-04 8.73236623e-05] [-1.00549366e-03 7.55272003e-04 2.07087098e-03] [-1.21862141e-02 -6.28990942e-04 -2.07713845e-03] [-9.16533292e-03 1.01356488e-03 -4.65528660e-04] [ 1.02756416e-03 5.45040402e-03 -1.60410480e-03] [ 1.04885059e-03 -3.45289822e-03 4.85959512e-04] [-2.09752319e-03 -3.54905856e-03 1.64649079e-03] [-8.44903079e-03 1.34012810e-03 9.99501102e-04] [ 5.59423842e-03 2.61397556e-04 -7.67602852e-04] [ 3.39718048e-03 3.44978635e-03 1.78375277e-03] [-2.82315046e-03 -9.98381988e-04 3.73326641e-03] [ 6.52874527e-03 5.97918798e-03 7.51581502e-04] [-1.58582785e-03 4.74894009e-03 -1.49005720e-03] [ 3.13033363e-03 4.01850517e-03 -3.81855987e-04] [-1.35404271e-04 -4.37577944e-04 -1.10773671e-03] [ 1.59313974e-03 -3.62824278e-03 -1.58393690e-03] [ 7.20903774e-03 -6.39004484e-03 -1.87169563e-04] [-6.91728085e-04 4.24825575e-03 2.99340980e-03] [ 4.61618342e-03 -5.71310143e-04 -1.07418009e-03] [ 3.94015421e-04 -3.08361508e-03 1.18644799e-03]] Final stress: [-1.04618106e-02 -1.71565909e-02 -2.07493222e-03 4.55372580e-06 -2.02135345e-03 1.43997630e-05] Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.45181892e-02 -5.26185079e-02 5.30048654e-02] [ 1.02527487e-01 -7.07078092e-02 -6.88649828e-02] [ 1.58901802e-02 -1.33547450e-02 -2.27518685e-02] [ 2.75074291e-01 4.86909945e-02 -2.36345629e-01] [-1.75188260e-02 -2.96306926e-02 1.84924602e-02] [ 9.44588475e-02 3.53969423e-02 -4.97072278e-02] [-5.07405133e-01 -5.50268801e-01 -1.48045897e-03] [ 6.88015097e-01 -2.01744875e-01 -7.25745149e-02] [-2.98769626e-01 6.06421436e-01 3.42772959e-03] [ 1.20496222e-01 8.34670587e-01 -6.74882118e-02] [ 4.17575686e-01 7.42663832e-02 5.14564372e-05] [-3.14334540e-01 -1.18406904e-01 2.41445069e-01] [-7.75373347e-03 2.16792110e-02 -5.02217284e-02] [ 1.59732845e-02 9.10998981e-02 3.29429776e-02] [-1.20201331e-01 -2.65670768e-02 4.25825844e-02] [-1.10602925e-02 -7.95172467e-03 -6.63108686e-02] [ 4.33826850e-02 6.12739021e-02 -1.97802575e-02] [-6.79297273e-02 -5.61445308e-02 3.56520396e-02] [-2.66292263e-03 -3.71581904e-01 5.87662981e-02] [ 5.02608808e-01 2.15432983e-01 -3.04613147e-02] [-5.03175967e-01 2.84471926e-01 7.32761170e-02] [-7.74018381e-01 2.21867982e-01 3.43105952e-02] [ 2.43204650e-01 -8.96323321e-01 8.53367721e-02] [ 8.40861230e-02 -1.80894916e-01 -1.80339588e-02] [ 2.03429223e-02 -2.68820960e-02 1.19903865e-02] [-8.06603129e-02 6.80196174e-02 -7.21924253e-02] [ 9.06366541e-03 7.18923229e-02 3.45077812e-02] [ 1.90165589e-02 -3.02353788e-03 -1.82158290e-02] [-1.97111588e-02 -6.03389702e-02 -1.52998275e-02] [-8.56090854e-02 4.58102617e-02 -2.19898388e-03] [ 2.41859172e-03 -1.03274071e-02 4.77141037e-02] [ 8.04993706e-02 -1.17009047e-02 1.97742554e-02] [ 4.59640334e-02 4.15733004e-02 -4.78645062e-03] [-1.00390641e-02 -2.37848307e-02 2.04683613e-02] [-3.57436664e-02 -2.51616050e-03 1.91529037e-02] [ 3.14770750e-02 -7.79803099e-03 -1.61822186e-02]] Final stress: [ 0.0343222 0.03204539 0.01443752 0.00459459 -0.00115553 0.00195455] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 1.71573133e-02 6.59953531e-03 -3.09568161e-04] [-2.47549976e-02 1.26846681e-02 -4.03156661e-03] [-1.71580697e-03 2.31465767e-02 6.74461668e-03] [ 3.08988766e-03 2.66119432e-02 -3.04386724e-03] [ 6.17042274e-02 -3.89841092e-02 -2.05096015e-02] [-1.61003740e-02 -1.15980734e-02 -2.87326604e-03] [-2.33987765e-02 -3.54846301e-02 6.68266213e-03] [ 1.07650121e-01 -1.47833558e-02 1.48051455e-03] [-1.28217392e-02 6.37599777e-02 -5.63181526e-03] [ 4.08678868e-02 2.24401673e-02 1.81695358e-03] [-5.86460000e-02 -2.32151367e-02 1.22009802e-02] [ 3.01464153e-02 -9.79431558e-02 -1.05576559e-03] [-4.17847956e-02 1.62694377e-02 -1.69585540e-02] [ 1.18633422e-02 2.82546658e-02 -6.04226086e-03] [ 5.85672022e-02 -2.16596978e-02 2.58506535e-02] [ 7.23608692e-02 -1.31424685e-02 8.57330186e-03] [-2.98508189e-02 -2.76044862e-02 1.12427314e-02] [-8.10082500e-02 1.46257585e-02 -1.50577223e-02] [ 1.48816180e-02 -2.97624565e-02 -1.06612405e-02] [ 4.85485446e-02 1.67039146e-02 -5.45471233e-03] [-3.90451536e-02 3.43881513e-02 -6.00682704e-03] [-3.56075475e-02 5.97495100e-02 7.88273023e-03] [-6.38994748e-02 3.03037841e-02 7.19295537e-03] [-3.25993716e-02 -2.19325708e-02 -4.01844386e-03] [-1.80816392e-02 -3.12717624e-03 -2.56574032e-03] [ 7.57276291e-03 1.84444389e-02 -1.00148357e-02] [-9.38831848e-03 -4.20917681e-02 2.21485807e-02] [ 6.69600385e-02 -1.23742951e-02 6.53808660e-03] [ 6.38855656e-03 3.53409205e-02 -1.52681340e-03] [-1.22058996e-02 1.38244230e-02 3.02866455e-03] [ 9.42922817e-03 1.14483346e-02 6.99272734e-03] [-1.01129866e-02 -2.79220862e-02 1.44500606e-02] [-4.51923858e-03 3.24169661e-02 -2.56222833e-02] [-4.54847662e-02 1.34018839e-03 -5.72972544e-03] [-1.22659258e-02 -3.61547597e-02 4.29256326e-03] [ 1.61038674e-02 -1.05731352e-02 -4.17320350e-06]] Final stress: [ 0.00028303 0.00064317 0.0005819 -0.00598046 -0.00026337 -0.00442412] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-0.05457351 -0.03183016 -0.0127602 ] [ 0.00771821 -0.07053076 0.05707272] [ 0.02483722 -0.01788 0.07756949] [ 0.03367013 -0.01072861 -0.03820806] [-0.07656588 -0.47889065 -0.23362327] [ 0.03581195 0.03933724 0.01100288] [-0.63114227 -0.5298886 -0.14679608] [-0.48241451 0.28750966 -0.00287649] [-0.06440998 -0.15344146 -0.0205089 ] [-0.046368 0.14007895 -0.07226601] [ 0.12022638 0.51895023 0.29854364] [-0.38620832 0.17914521 -0.06480402] [-0.01016103 -0.02221091 -0.03551342] [-0.02389786 0.03506477 -0.03594712] [ 0.05488142 -0.01704942 -0.00904536] [-0.03463675 0.05912222 0.03371236] [-0.07355959 -0.06225945 0.01122798] [-0.01704005 -0.02555154 -0.04723402] [ 0.72030825 -0.69182835 0.04294421] [ 0.32518337 1.13043316 0.10346357] [ 0.01736632 0.07631004 -0.02836259] [-0.43409014 0.10023027 0.0856574 ] [ 0.35948087 -0.97917193 0.18531414] [ 0.53599243 0.66247575 0.07431012] [ 0.02801982 0.01734453 -0.11206163] [ 0.05980676 -0.08643852 0.03623544] [ 0.06824134 -0.06917271 -0.05147011] [ 0.07958775 -0.0270891 -0.0700187 ] [ 0.04679941 -0.05177449 -0.05933861] [-0.03176175 0.07025001 0.0580132 ] [-0.0438551 0.04027234 -0.03112017] [-0.05765488 -0.01602468 -0.03464418] [-0.04004417 0.01202294 -0.0088306 ] [ 0.06207979 -0.06452891 -0.00842264] [-0.13363421 -0.03337504 0.03697184] [ 0.06200661 0.07111797 0.01181318]] Final stress: [0.03348064 0.04011144 0.01493302 0.00108355 0.00631557 0.00036552] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 6.38277185e-03 8.29069511e-03 -1.47341791e-03] [ 4.42109520e-03 -2.29873748e-03 5.52896435e-04] [-3.92106450e-04 -3.15452627e-03 7.16626616e-05] [-4.70287696e-03 -3.12042113e-03 1.22569679e-03] [-5.01739282e-03 2.26926473e-03 8.51891366e-04] [-1.44722848e-03 -2.28207636e-03 -7.42816679e-04] [ 3.19650623e-03 -1.88505947e-03 7.25395968e-04] [ 6.69940722e-03 -3.86495683e-03 -9.30406866e-04] [-8.18846089e-04 3.60470399e-03 -7.76358291e-04] [ 6.78064166e-03 9.65958311e-03 -2.32060805e-03] [-2.24123928e-04 -1.66551483e-03 2.39689305e-03] [-3.94368627e-03 1.24299012e-02 -2.39885672e-04] [-4.11905735e-03 7.96496037e-04 8.56995145e-04] [-4.77598412e-03 -4.23940334e-03 -1.49122628e-03] [-5.06330279e-03 9.08270214e-04 1.96562312e-03] [ 4.33654909e-03 -5.07796628e-03 1.29500806e-03] [-4.27097594e-03 -3.15914469e-04 -3.76641496e-03] [ 1.88273429e-03 2.56517623e-03 3.52817335e-03] [ 7.86533786e-04 -1.96070313e-03 2.81384481e-03] [ 1.79023712e-03 4.22662076e-03 -7.54465376e-03] [-2.35564316e-03 2.90559770e-03 3.07265135e-03] [ 7.15340010e-03 -4.63474744e-03 -2.76416423e-03] [ 4.58280637e-03 -1.61606626e-02 -7.16880781e-04] [ 1.03837625e-03 -2.96005631e-03 2.53161248e-03] [-6.06456081e-03 1.58992885e-03 -1.49521669e-03] [ 2.97992773e-03 -1.25855331e-03 -1.20298012e-03] [ 2.69752369e-03 -3.41484145e-03 8.55100241e-04] [-1.52537332e-03 2.37872781e-03 1.52410472e-03] [ 8.31863821e-04 4.74959259e-03 6.50236167e-04] [-1.78256036e-03 -2.70600431e-03 3.37443812e-04] [-1.01109906e-03 2.19737484e-03 -4.12442379e-03] [-9.48938352e-03 7.56315145e-04 -1.22543061e-03] [ 2.15805693e-03 4.05089560e-03 4.10015242e-03] [-1.48000977e-03 -4.02004654e-05 5.28051234e-03] [-1.23345896e-03 1.95211358e-03 -2.57078689e-03] [ 1.99923884e-03 -4.29091199e-03 -1.25022272e-03]] Final stress: [ 3.86874536e-03 -3.74302191e-03 2.73979043e-04 -3.27549888e-05 -5.93278297e-03 -2.08582634e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.02161291 -0.03540095 -0.00300164] [-0.00352791 -0.00131986 0.00893893] [ 0.00096576 -0.00802276 0.00786943] [ 0.01421311 0.02158168 0.00576201] [ 0.01100923 0.02829588 0.00787335] [ 0.00388114 -0.01724855 0.01320305] [ 0.0187125 0.31277074 -0.0185402 ] [ 0.17110677 0.04423973 0.0304575 ] [ 0.03574133 -0.09150461 -0.04230852] [-0.04324708 -0.07398283 -0.02673923] [-0.14666534 0.06716634 0.00786817] [ 0.00037216 -0.34753543 0.02421313] [-0.01429006 0.00674355 0.00900918] [ 0.0148846 0.01686948 -0.01161501] [ 0.0007422 -0.00626454 -0.0270287 ] [ 0.00968402 -0.0061589 0.02461225] [-0.02957915 0.01728113 0.01867482] [ 0.01100553 -0.01784463 -0.01810955] [-0.11476964 0.05821489 0.02197717] [ 0.002986 -0.19698641 0.0557339 ] [-0.15451397 -0.17795316 -0.03099027] [ 0.0318336 0.33132224 -0.0604913 ] [-0.02434593 0.01646908 0.01390542] [ 0.09766635 -0.02094785 -0.00397787] [ 0.00143016 -0.01692784 0.0100009 ] [ 0.00079082 -0.00442678 -0.00530746] [-0.02066368 0.0004563 -0.02530576] [ 0.01631325 0.0252813 0.020379 ] [ 0.00474447 0.00460392 -0.01354736] [ 0.01393307 0.02690145 0.00339982] [-0.00617399 -0.00477407 0.03131436] [ 0.02249465 0.01086488 0.00774254] [ 0.03512115 -0.01245563 -0.01169928] [ 0.01034353 0.01139596 0.0049114 ] [-0.00225052 0.01659377 -0.02999765] [ 0.00843895 0.02270248 0.00081347]] Final stress: [ 2.87839436e-02 2.90595733e-02 1.64938790e-02 2.21428493e-03 -4.28340089e-05 5.24622004e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-0.00085759 0.00660569 -0.00069831] [ 0.10051801 -0.0790605 0.02530182] [-0.02101746 -0.02391899 -0.00413549] [-0.00684477 -0.04241808 0.00584287] [ 0.02669249 -0.00138123 -0.00520358] [-0.00801526 0.00636194 -0.00013883] [ 0.01950624 0.00898048 -0.03051715] [-0.00638751 -0.00553194 0.03483866] [-0.10254746 0.08238415 0.03042763] [-0.06281147 -0.07551083 0.02728849] [ 0.032951 -0.01128361 -0.02891776] [ 0.03172489 0.05809763 -0.02537464] [-0.0338812 0.02665585 -0.01499397] [ 0.00754491 0.07686309 0.03102202] [-0.05233748 -0.0172832 -0.03355873] [ 0.04388797 -0.02355044 0.01726406] [ 0.08124742 0.09087082 -0.02183376] [-0.06969194 -0.12060909 0.0203534 ] [-0.04506025 0.0192293 0.00962032] [ 0.02664888 -0.04385362 -0.0357108 ] [ 0.04764893 0.06857196 -0.00793039] [-0.0562082 -0.06631515 0.00047786] [ 0.03058876 0.05072593 0.03537037] [ 0.03529813 -0.03190018 -0.00441117] [-0.02206057 -0.02239778 0.03756255] [ 0.00562722 0.01179716 -0.02745369] [-0.03470184 -0.0084385 -0.04265163] [-0.00125685 0.00295648 0.0022318 ] [-0.01030529 0.00711099 -0.02793282] [ 0.06269186 -0.00634369 0.0242812 ] [ 0.00640901 0.01744268 -0.0374821 ] [-0.00403732 0.01585762 0.00505987] [ 0.02548268 -0.0048298 0.04550514] [-0.01261804 0.02228925 -0.01485368] [ 0.01967559 -0.00738159 0.02578491] [-0.0535035 0.01920718 -0.01443444]] Final stress: [-8.78088194e-04 -1.48642167e-03 3.04378633e-05 -3.94469873e-03 4.93174073e-04 -7.22649341e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 1.71702688e-03 -2.68094917e-04 -2.60658904e-04] [-7.88706836e-04 3.24861924e-05 -1.74823409e-04] [-4.52593293e-05 1.86822202e-03 3.21045224e-04] [-2.60938218e-05 -1.19110692e-04 4.22247601e-05] [-1.42054453e-03 -3.05177249e-04 1.67934499e-04] [ 5.31074031e-03 3.04793733e-03 1.01123079e-03] [ 4.15630952e-03 2.40062928e-03 -1.96919294e-03] [ 5.69886737e-04 2.10965403e-03 -1.86913126e-04] [-3.74767919e-03 1.92024631e-03 1.47496628e-03] [-5.18787791e-04 -1.11613215e-03 -6.95627413e-04] [-9.96439816e-04 8.95102758e-04 2.00145598e-04] [ 5.68877090e-04 2.17392954e-04 3.22176815e-04] [-1.21799518e-03 -7.66811076e-04 1.11466786e-04] [ 8.59266807e-05 3.39646653e-03 2.05226702e-04] [ 6.31437119e-04 -3.91528605e-04 -5.71434182e-04] [-2.11192683e-03 7.43053724e-04 4.92623646e-05] [-4.54069990e-05 5.00209719e-04 -7.65597412e-06] [ 1.70609814e-03 1.25374097e-03 -4.11122168e-04] [ 5.17869555e-04 -2.86643167e-03 2.35497110e-03] [-2.51796576e-03 -1.96767587e-03 -8.89075549e-05] [ 4.43061380e-05 3.73382923e-04 -2.51419427e-03] [-1.53818840e-04 1.13356835e-03 3.60953802e-03] [-5.32107289e-04 2.77037265e-03 3.32048031e-04] [ 3.49546477e-04 1.74876026e-03 -3.50044379e-03] [-1.70278816e-03 1.20263831e-05 -7.19636383e-06] [ 1.54009477e-03 -1.51634345e-03 -2.54683834e-03] [ 1.17887721e-03 -1.13524607e-03 7.69780587e-04] [-1.96623465e-03 -6.73124477e-04 -6.69144035e-04] [ 1.58789281e-03 1.67866163e-04 3.18452080e-04] [-1.43953915e-03 -1.63013718e-03 2.89086489e-03] [-1.06510996e-03 -2.83847966e-03 1.78575271e-03] [-2.37164485e-03 8.25305936e-04 -2.36971621e-04] [-4.93488246e-04 -4.05643290e-03 1.54047859e-03] [-1.30154426e-04 -3.63861555e-03 -1.61333459e-03] [ 1.25446154e-03 -2.91040480e-03 -2.13660957e-03] [ 2.07234070e-03 7.83321824e-04 8.35024262e-05]] Final stress: [ 8.98891730e-03 4.36000076e-03 7.46037689e-04 -7.58569390e-07 -1.13963601e-03 -1.24866859e-05] Minimization converged after 51 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 2.23785447e-03 -3.39683158e-03 -8.54420415e-04] [ 7.82366870e-03 -3.71473402e-03 1.31809667e-03] [ 5.64137997e-03 -2.23994815e-02 -3.18125967e-03] [-7.74606658e-03 -2.04927612e-02 2.96863639e-03] [ 1.69958839e-05 3.78638333e-03 9.77795217e-04] [-1.05397626e-02 -5.86673092e-03 -1.88292200e-03] [-2.10612163e-02 -1.63993968e-02 -1.38795935e-02] [ 2.53535639e-02 -1.02557433e-02 -5.95531031e-03] [ 1.18240331e-02 -2.55801612e-02 2.19848631e-02] [-1.22916295e-02 -3.94086365e-02 -1.43682792e-02] [-6.90593058e-03 1.82599145e-02 6.98663918e-03] [ 7.62998174e-03 -6.13847806e-03 6.10541581e-03] [ 9.06903389e-04 1.74570423e-03 -1.13540987e-03] [-4.42865434e-03 6.35160684e-03 -1.37677454e-02] [-1.23966116e-02 -2.02695120e-03 1.22643609e-02] [-1.03737537e-03 1.73451344e-02 -1.33484363e-02] [ 7.10998175e-03 -3.16299270e-03 1.91184617e-02] [-1.47310716e-03 1.04145021e-02 -5.19577654e-04] [-3.84371850e-02 1.41716465e-02 -1.40951348e-02] [-3.71307717e-03 3.17323898e-02 2.55060822e-02] [-2.76937951e-02 -4.26592041e-03 -1.72914924e-02] [ 1.08680363e-02 -1.21312701e-02 6.73389638e-03] [ 2.99433200e-04 1.19585548e-02 -1.81645908e-03] [ 1.60684160e-02 1.51759202e-02 5.79222820e-04] [-2.96113883e-04 -2.46177687e-02 9.28642748e-03] [ 1.64829108e-03 -6.77875151e-03 -9.10780860e-03] [ 1.30326032e-02 -3.09125551e-03 -3.31998377e-03] [-2.05493562e-03 5.25744819e-03 -2.87848580e-02] [ 2.16153812e-03 1.59480130e-02 1.00766362e-02] [-4.29338103e-03 5.98970100e-03 2.15706169e-02] [ 2.78863623e-03 2.97263122e-02 -3.04454099e-04] [ 3.04959414e-02 1.00592838e-02 -1.82886169e-02] [-6.02359840e-03 -3.99318357e-03 1.94534907e-02] [-3.89643159e-03 1.11618545e-02 -5.90876424e-03] [ 7.43981903e-03 -1.41344185e-02 -8.18150446e-03] [ 1.09417944e-02 1.87710978e-02 1.10613892e-02]] Final stress: [ 0.00443968 0.00901842 0.00071449 0.00016743 0.00109725 -0.00011691] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[ 3.19296010e-03 7.44280599e-03 -7.73489159e-04] [-5.98016999e-04 4.55613958e-03 -4.30086532e-04] [-9.22685951e-06 4.09626745e-04 1.04915593e-04] [ 4.19884596e-03 3.60150503e-04 -1.18555688e-04] [ 5.94955442e-03 -3.27693613e-04 -6.25972746e-04] [ 4.70049040e-04 -4.01263199e-03 -1.82683110e-04] [ 5.54945618e-03 -3.81484199e-03 2.81027184e-03] [-3.02448372e-03 7.68325679e-03 -4.37103422e-03] [-5.05730928e-03 4.09360194e-03 7.46776540e-04] [-5.87478019e-03 -4.14562050e-03 1.52393799e-03] [ 9.02632375e-03 -9.61106159e-03 -3.25008867e-03] [ 1.62598565e-02 -6.94015684e-03 2.44096234e-03] [ 1.88056141e-03 2.15344750e-04 2.65630984e-03] [ 2.10092786e-03 5.51894498e-03 7.25258114e-04] [-5.15624070e-03 -5.15671355e-03 -1.65567276e-03] [-5.71644269e-03 5.98860643e-03 -3.14166811e-03] [-3.88382009e-03 -1.16463356e-02 -1.30361052e-03] [ 6.63189990e-03 6.85892530e-03 2.11806543e-03] [-5.71113983e-03 -1.96147989e-03 2.15465385e-03] [-1.82308098e-04 -7.82063577e-03 9.76827874e-04] [ 1.30123535e-02 3.69348619e-03 -2.96407624e-03] [-9.21330464e-04 9.92958852e-03 -2.27815474e-03] [-1.58937674e-03 6.49605962e-03 1.50988726e-04] [-1.45697433e-02 3.91674368e-03 8.01358882e-04] [-6.20401272e-03 1.04771235e-03 3.44592079e-03] [ 3.96064716e-03 -2.24099275e-03 5.21243825e-04] [-3.92832577e-03 1.70340555e-03 3.03676697e-03] [ 4.88942818e-04 -7.84745101e-04 -6.77796058e-03] [ 3.75201551e-03 -3.59856438e-03 4.09074888e-03] [-6.55577142e-03 -2.57314146e-03 -4.94456109e-04] [ 1.17694846e-03 -1.55231168e-03 1.94852674e-03] [-8.20637467e-03 1.62838183e-03 -3.42323666e-04] [ 1.02247223e-04 6.94773786e-04 -7.10348791e-03] [-3.77370711e-03 -3.17776666e-03 2.41725378e-03] [-4.32541430e-03 -4.49096718e-03 3.37056099e-03] [ 7.53423507e-03 1.61810598e-03 -2.28028258e-04]] Final stress: [-6.67652133e-03 -1.09755814e-02 -1.32671985e-03 2.92746217e-07 -1.26630220e-03 -8.36887161e-06] Minimization converged after 17 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 1.35185717e-02 7.73769865e-03 -3.74924482e-03] [-2.20647030e-03 2.09273152e-03 -7.21398455e-04] [-7.17583811e-04 -5.92465837e-04 -1.35126696e-04] [ 1.45883908e-03 -2.72503311e-03 9.68950208e-04] [ 3.41769853e-03 -2.81103687e-03 -2.72419661e-04] [-4.16694064e-03 -4.33893836e-03 -9.69264449e-04] [-3.41644751e-03 -7.32426741e-03 7.34197253e-03] [-2.69525768e-03 2.61826150e-03 -2.75362208e-03] [-4.45383561e-03 4.15465179e-03 -5.93790562e-03] [ 2.35070973e-03 -7.72637285e-03 -1.73224999e-03] [-1.05494367e-03 -1.41666081e-03 5.24083477e-04] [-8.88881598e-04 9.60595796e-03 5.15662422e-03] [-4.15107907e-05 -1.17323649e-03 3.21278167e-04] [-1.49972061e-03 -7.25118442e-03 3.75324718e-04] [ 4.68177256e-03 3.36744762e-03 1.50808069e-03] [ 8.94864927e-04 2.41021648e-03 2.36457018e-03] [-2.35269460e-03 5.77867382e-03 -6.16793272e-04] [-5.23928569e-03 -3.45336604e-03 -1.74825322e-03] [-1.63753632e-03 2.85852091e-03 5.58426479e-06] [ 2.30347906e-03 7.12072574e-04 -1.22652554e-03] [ 3.58546147e-03 8.01170047e-03 -2.05242274e-03] [ 5.91670839e-03 -7.42117630e-03 4.09128898e-04] [ 2.29992691e-03 -5.23268763e-04 8.49092963e-04] [ 1.08339438e-03 2.12127975e-03 9.56649293e-04] [-4.55568060e-03 5.50796343e-04 4.34245413e-03] [-1.04146026e-03 5.89105268e-03 6.68053299e-04] [-5.70599770e-03 1.08152746e-03 -1.98778772e-03] [-1.53332476e-03 -8.28947662e-03 3.25823975e-03] [ 2.29649364e-03 -3.76907156e-03 9.49135643e-04] [ 4.36007355e-03 6.81460749e-03 1.80149185e-03] [ 1.39934807e-03 6.08253993e-04 -9.39022476e-04] [-1.41362814e-03 -7.19411990e-03 3.52869986e-04] [ 4.54905182e-03 5.63349853e-04 -1.81585692e-03] [ 7.79997337e-04 6.33539605e-03 -3.45503509e-03] [-6.06008308e-03 6.14980092e-04 2.58251036e-03] [-4.21510774e-03 -7.91950166e-03 -4.62316587e-03]] Final stress: [-8.40274538e-05 7.48385541e-05 1.63295034e-04 3.73778316e-03 3.11692826e-06 2.45729384e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-1.11619329e-02 -1.55486004e-03 1.09406613e-04] [-5.78834127e-02 4.84757649e-02 -1.42190084e-02] [-1.58562791e-03 1.01863065e-02 3.08781066e-03] [ 1.08855633e-02 3.49771390e-02 -3.88111790e-03] [ 8.44050368e-03 -2.56695630e-03 -1.97534085e-03] [ 2.76334748e-02 1.22675362e-02 2.17489256e-03] [ 3.95482337e-02 1.45702204e-02 2.27858567e-02] [-1.71928564e-02 1.73862424e-02 -1.40488582e-02] [ 1.24294037e-02 -6.56300385e-02 -1.26552319e-02] [-3.53249480e-02 -1.06642549e-02 -2.56931951e-03] [ 1.89726649e-02 -5.58759555e-02 6.59149809e-04] [-1.32472662e-02 4.50771112e-02 1.29870661e-02] [-1.31649877e-01 6.10671698e-03 1.51090083e-02] [-3.49279300e-02 1.64346180e-02 -1.91432536e-03] [ 1.83573732e-01 6.99021222e-02 -6.42126134e-03] [-1.45274767e-02 -9.26757900e-03 -1.39275515e-02] [ 1.61556728e-02 -3.48972660e-02 -3.70820234e-03] [-2.35848028e-02 -5.95902304e-02 1.46131666e-02] [-1.21989675e-01 1.08079215e-01 -2.89526603e-02] [-4.73625148e-02 -9.09641898e-02 4.15563224e-04] [ 1.30520505e-01 9.92423012e-02 2.54322069e-02] [ 8.05776591e-02 -6.13107100e-02 2.93218276e-02] [ 8.54038243e-02 5.86619052e-02 -3.12518448e-04] [-8.44340332e-02 -1.02576715e-01 -2.89486530e-02] [-1.31871123e-02 5.51847677e-03 8.57942001e-04] [ 7.86770037e-03 -1.36669906e-02 8.52471103e-03] [-9.36372681e-03 1.59360089e-02 2.08532776e-03] [-3.70654496e-03 -6.88690093e-03 -5.93152978e-03] [ 6.62336129e-03 4.79738638e-04 1.94723194e-02] [-8.34123730e-03 -1.46652028e-02 -1.47297165e-02] [ 7.83869060e-03 -6.99620516e-03 1.05008029e-02] [-7.86138095e-03 1.11649948e-02 -5.17576725e-04] [-3.28333836e-04 -1.91472177e-02 -1.36827623e-02] [ 9.07566743e-03 -1.13390557e-02 4.38761410e-03] [-1.42641259e-02 -1.65422411e-02 -6.38063341e-03] [ 6.37815863e-03 9.67615127e-03 2.25159549e-03]] Final stress: [-0.00246266 -0.00220515 -0.0001634 -0.00378254 -0.00052555 -0.0027328 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 2.11734089e-03 -3.78492486e-05 -1.43305603e-04] [-2.56334599e-03 2.77709887e-03 -2.30937977e-04] [-4.04467607e-04 1.33891108e-03 4.91748138e-04] [ 1.59154480e-03 4.08953293e-03 -8.59238609e-04] [ 3.00757718e-03 -3.32322604e-03 -8.24232086e-04] [-2.94301641e-04 -6.92502329e-04 -2.21960382e-04] [ 6.07155767e-03 -3.73952742e-03 -8.97590841e-04] [-3.00826286e-04 4.96748581e-03 7.33616715e-06] [-1.87916841e-04 -6.29352761e-03 -2.11072424e-03] [-2.56776759e-03 -3.68148596e-03 4.32597842e-03] [ 3.37113167e-03 2.95446171e-03 -1.53693943e-03] [-3.73807358e-03 -7.59780135e-04 1.90400376e-03] [ 1.77054445e-03 -2.55670038e-04 -1.63960764e-04] [-1.38456811e-03 1.02493819e-03 -1.09948309e-03] [-3.43098999e-03 -2.28321957e-03 -1.92440751e-04] [-5.88660060e-04 -2.53638674e-04 1.46877671e-03] [-3.61948960e-04 2.92754112e-03 6.78229683e-04] [ 2.33522201e-03 6.96909100e-04 7.56199744e-05] [-3.54586502e-03 1.29779139e-03 -4.36411156e-05] [-1.78647975e-03 3.76351517e-03 -3.63357006e-03] [-6.45489162e-04 -3.07734198e-04 -2.56134581e-03] [ 3.21934552e-03 -8.31351561e-04 1.16677409e-03] [ 4.14723729e-03 4.50628961e-03 3.50031736e-03] [-1.08178502e-04 4.05540798e-04 1.07250811e-03] [-2.75378102e-03 -1.63819753e-03 1.34611672e-03] [ 2.06671703e-03 -2.65917593e-03 3.28177406e-03] [ 2.34826667e-04 -4.50118277e-05 2.78619135e-03] [-1.37217305e-03 -3.59703126e-03 1.71646996e-03] [ 8.71339622e-04 5.55415361e-04 -6.37298101e-04] [ 2.24565281e-03 -2.25185588e-03 3.13259564e-05] [-1.83642447e-03 1.97961814e-04 6.52885242e-04] [-3.39520669e-03 6.20215896e-04 -2.26948701e-03] [-1.86904669e-03 9.26617377e-04 -6.07437537e-03] [ 1.71414103e-03 2.74712409e-03 -9.50169613e-04] [ 1.11980256e-03 -3.85084939e-03 1.97123420e-03] [-2.74847018e-03 7.04284298e-04 -2.02658904e-03]] Final stress: [-2.37236384e-03 2.31961482e-03 8.09462790e-05 -6.60506206e-06 3.75198482e-03 -1.23209254e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[-3.62685407e-03 -3.98526492e-04 4.43763474e-04] [-2.09527166e-03 2.15828120e-03 -1.05520631e-03] [ 6.62766022e-04 7.08471890e-04 -1.41584887e-04] [ 1.89849878e-03 2.88601431e-04 7.18376208e-05] [ 4.63264765e-04 2.62923289e-03 9.09783474e-05] [ 5.55195017e-03 2.27647000e-03 1.71472913e-03] [ 2.14708649e-03 -1.31543048e-03 -2.03506939e-03] [-5.58596706e-04 -1.46031933e-03 -1.99565955e-04] [-3.34554930e-03 -1.08333569e-03 2.56731023e-03] [-4.42352650e-03 3.31480776e-03 4.80714168e-04] [-1.66008411e-03 2.15633042e-03 2.35153449e-04] [-6.39511510e-04 -8.35451015e-04 -6.63476078e-04] [-9.17532340e-04 -5.21689192e-05 -7.95260767e-04] [ 1.86346950e-03 -2.17510715e-03 1.23652407e-03] [-2.35874868e-03 -2.82812000e-03 -2.27938150e-04] [ 7.55512938e-04 -8.57716398e-04 -1.39191371e-04] [-7.48123299e-04 -1.23443133e-03 9.91646460e-04] [-1.27626323e-03 8.55132405e-04 -8.66175430e-04] [-8.96523227e-04 -1.76954084e-03 -1.14799649e-03] [-2.44614952e-03 -1.77359740e-03 1.38120553e-03] [ 1.06622118e-03 8.05789056e-04 8.96941335e-04] [ 3.50530965e-03 -1.03522716e-03 -1.27712432e-04] [-1.65907862e-03 2.28297142e-03 1.25911301e-03] [ 6.21733185e-04 1.73313447e-03 -9.69858969e-04] [ 6.82336482e-04 -3.07845612e-03 -3.15668125e-04] [-2.30961716e-03 -8.77389270e-04 4.91245993e-04] [-1.02109166e-03 2.18766650e-03 -8.09348129e-05] [ 2.26011784e-03 4.85633350e-03 -1.69818685e-03] [ 2.36694078e-04 -2.64203843e-03 -8.13065791e-04] [ 4.78166383e-03 -6.70118423e-04 3.89047510e-04] [-1.72425063e-05 4.21957676e-03 -1.05979948e-03] [ 6.44657985e-03 -1.74783457e-03 -1.24114884e-03] [ 2.63060007e-03 -3.90017022e-03 -5.72849473e-04] [-1.75056870e-03 -2.72596470e-03 6.14749814e-05] [ 3.42012746e-04 4.59668800e-03 -3.41567797e-04] [-4.16548477e-03 -2.60854378e-03 2.18057210e-03]] Final stress: [ 2.37826731e-03 -2.47380353e-03 1.13363141e-04 -5.33247143e-07 -3.72165767e-03 1.35464808e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-3.25447201e-03 -2.85665571e-03 1.33984409e-03] [-1.06185665e-02 3.12079983e-03 -1.13707751e-03] [ 1.57748388e-04 8.87021971e-03 1.01981176e-03] [-2.37683338e-03 9.37401632e-03 -1.68952117e-03] [ 2.44486106e-03 -2.56422782e-03 -6.53703726e-04] [ 2.48345875e-02 1.36988332e-02 5.84407015e-03] [ 2.50883509e-03 -1.62019459e-03 -6.19107361e-03] [-8.85998917e-03 1.77157521e-03 -4.62288703e-04] [ 1.64091835e-02 -4.91087498e-03 7.86626811e-04] [-4.14000893e-03 -8.91088492e-03 2.19169257e-03] [ 1.74742014e-02 7.13979083e-03 7.86996159e-04] [-2.33228463e-02 -9.24562352e-03 2.19414531e-05] [-1.06396693e-02 2.64969565e-02 4.23336162e-03] [ 1.27324734e-02 -8.70551959e-03 2.24312623e-03] [-2.29866215e-05 2.75041829e-04 -6.21963262e-03] [-2.37599362e-02 3.99580574e-03 -5.70447756e-03] [ 7.38496511e-03 -2.23175220e-02 -1.03514882e-04] [ 1.38755848e-02 -2.28428490e-04 5.23370024e-03] [-7.77872655e-03 1.53634453e-02 4.68555074e-03] [ 1.65779554e-03 1.30095479e-02 -1.25710892e-03] [ 4.51048698e-03 2.87139449e-03 4.97042016e-04] [-1.10475285e-03 -1.17313648e-02 -5.59080023e-03] [-9.19444399e-04 -5.45201324e-03 -2.30979216e-05] [-2.28281029e-03 2.89546231e-03 -3.41634510e-04] [ 7.06976504e-03 -3.14319268e-03 -1.65132318e-03] [-1.46785995e-03 8.12228114e-04 1.48871743e-03] [ 1.14174266e-02 -8.42126360e-03 -2.30238452e-03] [-8.43156422e-03 -8.59624273e-04 8.38238701e-03] [-5.77541290e-03 -5.01994000e-03 -2.18234992e-03] [-5.14956748e-03 -5.77208231e-03 -1.98982094e-03] [-6.95075330e-03 1.15713622e-04 -1.49231099e-03] [-1.06513501e-03 -1.30723261e-02 5.27020814e-04] [-7.51171913e-03 6.19876267e-03 1.98141801e-03] [ 2.02120016e-04 2.64184223e-03 -6.20503516e-03] [ 6.23154002e-03 2.64570173e-03 2.14600932e-03] [ 6.52148005e-03 -6.46539895e-03 1.78783964e-03]] Final stress: [-3.46006043e-04 1.34568184e-05 -7.22681908e-05 2.34457449e-03 8.37245565e-05 4.64625280e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-1.08317125e-03 -1.18859132e-03 9.15774161e-05] [ 7.31195827e-03 -5.72283146e-03 1.62821758e-03] [-1.40183900e-03 -3.96092944e-03 -8.77604808e-04] [-1.22022671e-03 -8.91122718e-04 2.14000318e-04] [-9.86905307e-03 3.06259730e-03 2.28659815e-03] [-5.82780527e-04 2.13333846e-04 1.90655550e-04] [ 1.78304704e-03 1.05358254e-02 -7.33616982e-04] [ 6.07341870e-03 -2.28663296e-03 1.04234661e-03] [ 4.36729409e-04 -9.34111939e-04 2.17530494e-03] [-3.67449768e-03 -4.08004415e-03 -3.62482990e-05] [-4.06351116e-04 -1.16921913e-03 -1.54753468e-03] [-3.42631893e-03 -1.12572056e-03 -2.80986376e-03] [ 2.38541654e-03 5.49920612e-04 -5.76169210e-04] [-2.75486386e-03 1.47867035e-03 -3.80538951e-03] [ 8.57306111e-04 6.31569007e-03 -4.44568065e-03] [ 2.25343161e-03 -1.45550081e-03 1.80240611e-03] [ 4.49269117e-04 -7.14872060e-03 1.62692084e-03] [-1.66262275e-04 2.60037455e-03 4.33511141e-03] [-5.35999938e-04 1.33811754e-04 1.06136062e-03] [ 3.22394068e-04 5.16881932e-03 -4.24394252e-03] [-6.31541439e-03 -2.91721772e-03 -6.31377014e-03] [ 3.86207903e-03 -1.61360565e-03 2.37329618e-03] [ 5.11101415e-04 -6.14578015e-04 8.72115448e-04] [ 6.06159168e-03 2.18635310e-03 6.85477615e-03] [-6.19993412e-04 -3.72794511e-03 -1.42665296e-04] [-2.41190063e-03 3.49517137e-04 -1.76619916e-03] [-2.02287044e-03 3.48703779e-03 -4.62302749e-04] [-2.01942678e-03 2.14472732e-03 1.41531422e-03] [-1.73097640e-03 3.92004072e-03 -2.60971040e-03] [ 5.40747555e-03 1.40420378e-03 9.40718036e-04] [ 2.32115015e-03 2.65935641e-03 -3.57745641e-04] [ 1.48690313e-03 1.53466331e-03 2.02391430e-04] [ 2.26915135e-03 -2.57530413e-03 2.37053585e-03] [ 8.76869836e-04 -1.91884316e-03 -8.16833762e-04] [ 2.76893774e-03 -3.07092180e-03 5.98041258e-04] [-7.19628435e-03 -1.34310209e-03 -5.36410540e-04]] Final stress: [-2.71819128e-04 -1.76127632e-04 -1.21604744e-04 -2.35314216e-03 5.63769850e-05 -4.54033512e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[-4.40224799e-03 1.07709303e-02 -5.91411367e-04] [ 2.09489198e-02 7.70783796e-03 2.40296149e-03] [-5.52305326e-03 -8.44811376e-03 -9.07060740e-04] [ 5.26237025e-03 -7.90391958e-03 8.23870476e-04] [ 5.71255936e-03 9.90696120e-03 4.13678294e-04] [-2.12213260e-02 6.78057978e-03 -2.52077400e-03] [-1.93007790e-02 2.53601275e-02 -7.24581716e-03] [ 1.30377024e-02 -1.49364788e-02 -2.46910287e-04] [-3.23537891e-03 -4.46047697e-03 9.11648391e-03] [ 2.23383681e-03 -2.50626447e-02 2.16342414e-03] [ 7.23363578e-03 -3.33957772e-03 -1.16133040e-03] [ 3.10307283e-02 -1.99619923e-02 -2.36309500e-03] [-1.64797471e-03 9.57813625e-03 -7.06063844e-03] [-6.12810645e-04 -1.96211111e-02 -4.93835969e-04] [ 1.76198941e-03 9.38203814e-03 7.23053645e-03] [ 1.04701802e-02 -1.33133819e-03 -4.51500205e-03] [-3.45884662e-05 1.21448108e-02 2.29344571e-04] [-1.05108509e-02 -8.49625773e-04 5.43342336e-03] [-3.85595876e-05 1.09359047e-02 -9.84756455e-03] [ 9.94671482e-03 -1.40218903e-02 -3.03986895e-04] [ 4.38884227e-04 -6.83189059e-04 1.17841460e-02] [-3.56433473e-03 -2.63332911e-02 -1.81544697e-03] [-4.31082249e-02 3.01602543e-02 -6.92181358e-06] [ 5.88787343e-03 2.37834911e-02 -2.61353449e-03] [-3.10293909e-03 -2.79520857e-02 -4.16128037e-03] [ 5.92234129e-03 6.55325139e-03 -8.87446257e-03] [-1.30842906e-03 4.12356401e-03 4.40874185e-03] [ 2.72059872e-03 4.91862438e-03 -5.69885024e-03] [ 2.28446061e-03 -3.01914099e-02 3.41101821e-03] [-6.94880318e-03 4.94458468e-03 6.54148894e-03] [ 8.51117502e-03 2.68798472e-02 -2.05776924e-03] [-1.10867284e-02 -6.51221666e-03 5.77199802e-03] [ 1.19895814e-02 -7.47984415e-03 7.74204014e-03] [-1.40918890e-02 -7.49092793e-03 -6.36296325e-03] [-7.91462118e-03 2.73580504e-02 5.86550652e-03] [ 1.22599872e-02 -4.70886050e-03 -4.49000652e-03]] Final stress: [ 5.60466700e-03 2.69569188e-03 6.48413625e-04 -1.25889823e-05 -7.78955993e-04 1.70727879e-04] Minimization converged after 50 steps. Minimization converged after 45 steps. Minimization converged after 50 steps. Minimization converged after 17 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 65 steps. Final forces: [[-0.032751 0.00226083 0.00076038] [-0.02712933 -0.05972981 0.00373331] [-0.07361516 0.11210136 0.01708964] [-0.03406058 -0.08037258 0.01156179] [-0.03897345 0.055712 0.01122847] [ 0.12381092 0.11636506 0.03203755] [ 0.04761195 -0.08767552 -0.04887688] [-0.11909611 0.08005643 0.07493698] [-0.05612429 -0.01143555 -0.05553693] [-0.1841186 -0.13288469 0.03859483] [-0.20269387 -0.24006109 0.05648378] [-0.00570181 0.19727159 -0.10324407] [-0.03412361 -0.03689113 -0.03311748] [ 0.01919311 -0.04902218 0.04112395] [ 0.03535606 0.02289973 -0.00723359] [-0.05314383 0.03139524 0.00122302] [ 0.18401864 0.3815451 0.00052316] [-0.08814625 -0.23737082 -0.02954089] [-0.0374295 0.01450211 -0.01619231] [-0.07559461 0.0649084 0.0386417 ] [-0.0113249 0.01088514 0.04204548] [ 0.04235454 -0.00779774 0.00972027] [ 0.07683859 -0.02752723 -0.01836876] [ 0.25840617 0.21208243 -0.05134918] [ 0.0071586 0.02620572 -0.05849569] [ 0.01458231 -0.0287906 -0.00180747] [ 0.00702309 -0.09158521 0.0465653 ] [-0.0047112 0.0414581 0.04719139] [ 0.06598776 -0.03100436 -0.06412652] [ 0.02874489 0.037041 -0.00289678] [ 0.06765798 -0.11776589 -0.06179396] [ 0.05502086 -0.13158491 0.03791735] [ 0.08676537 0.04283127 -0.02308772] [-0.02688403 0.06951092 0.08666268] [-0.04050913 0.03193646 -0.03203173] [ 0.02560043 -0.17946959 0.00965892]] Final stress: [-0.00061255 0.00106472 0.00054683 0.0022941 -0.00066809 0.00203055] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 1.50303041e-03 -4.23793408e-03 2.19826729e-04] [-1.30586755e-03 1.09891112e-03 -3.30977827e-04] [-2.27240446e-04 3.23119767e-03 6.90156364e-04] [ 1.38402634e-03 3.45553289e-04 1.00099548e-05] [-1.04454412e-03 -5.77285766e-03 -4.57127225e-04] [ 4.13267261e-03 1.31791694e-03 5.19625900e-04] [-3.10852315e-03 2.93333845e-03 -1.89655902e-03] [ 2.77445712e-03 -6.63045266e-04 -6.98033392e-04] [-8.99362106e-06 -7.81094800e-04 1.08565349e-03] [ 2.77189494e-03 -3.55676901e-03 1.44728885e-03] [-2.79153808e-03 3.99674078e-04 7.33199796e-04] [-1.09834553e-03 5.20608852e-04 -1.59642725e-03] [ 3.48184807e-04 -3.11853078e-03 2.12528233e-03] [-3.20811178e-03 -4.38712150e-03 1.21490114e-03] [ 3.07596145e-03 3.26013787e-03 -2.14865307e-03] [-4.05567425e-03 4.90498337e-04 -7.90853651e-04] [-2.32904879e-03 -5.14951131e-03 -1.34191351e-05] [ 5.52348937e-03 4.05907997e-03 -1.20403747e-03] [-9.62741923e-04 -1.35904905e-04 9.08431109e-05] [-1.09795637e-03 8.75659049e-04 9.38453295e-06] [-2.64129327e-03 -5.69663786e-04 -8.02309950e-04] [-1.59623190e-03 -1.61323619e-04 1.69368196e-03] [ 2.87617838e-04 -9.78114474e-04 1.23137438e-03] [ 3.70038982e-03 1.69523518e-03 -2.93803600e-03] [ 4.31543525e-05 3.48051506e-03 1.13975441e-03] [ 2.75531502e-03 1.44485547e-03 2.58027773e-03] [-3.55673717e-04 -8.16810902e-04 1.47321034e-03] [-1.95872869e-04 -1.15387981e-03 -1.07459081e-03] [-6.24426213e-04 3.94505955e-03 -6.23671400e-04] [-2.29210918e-03 4.22348794e-04 -6.89075824e-04] [ 9.64872266e-04 1.87939884e-03 1.44141893e-03] [-1.08746449e-03 1.30760099e-03 -1.18891849e-03] [-2.45393314e-03 -1.78265474e-03 -5.09477585e-04] [ 1.51830360e-03 -6.11555099e-04 5.91361154e-04] [ 5.95021802e-04 -8.03438845e-04 -1.61429356e-03] [ 1.10719865e-03 1.97262109e-03 2.79210565e-04]] Final stress: [-4.68373079e-05 1.89863106e-05 1.17510767e-05 -2.33966354e-03 -2.75585006e-05 -1.48310705e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-3.17527139e-03 -2.99492331e-05 6.05169032e-04] [-2.23023856e-03 1.67458135e-03 -1.60280158e-04] [ 1.86002652e-03 2.87326386e-03 5.60636551e-04] [ 1.11550628e-03 -1.03258321e-03 4.99532605e-05] [ 3.30903097e-03 2.03589886e-04 -4.06702950e-04] [ 4.13807745e-03 1.30182860e-03 3.61697052e-04] [ 4.88382760e-03 -2.11999085e-03 -1.86717867e-03] [-3.65945373e-03 6.08383104e-04 -6.90302671e-04] [ 7.93981694e-03 -8.60913895e-03 5.32219247e-03] [ 5.10492031e-04 4.73800537e-03 2.40142505e-03] [-1.55973317e-03 -2.68615943e-04 -1.96562182e-03] [ 3.29641935e-03 1.09800313e-03 -2.00219480e-03] [ 1.68969521e-03 -2.23226253e-04 -5.18217884e-04] [-1.53431842e-03 6.45772236e-04 -2.72975424e-03] [ 2.68488649e-03 3.25399122e-03 1.09213039e-03] [-2.02757609e-03 1.12890995e-04 4.16414371e-05] [ 1.06726733e-03 -8.23019719e-05 2.62653133e-03] [-3.37396965e-04 1.13383807e-05 1.48162559e-04] [-1.82083506e-03 3.91600725e-03 7.35067879e-06] [-5.03863847e-03 4.52991229e-03 2.65192113e-03] [-4.53648235e-03 -1.75360918e-03 -2.48652753e-03] [-6.29890359e-04 -1.16567504e-03 1.36183078e-03] [-3.69141474e-04 1.63437834e-03 -4.23504363e-03] [ 4.48652705e-03 -2.98173506e-03 3.65104979e-03] [-1.74799081e-03 -1.91636130e-04 1.78571976e-03] [-8.17803514e-03 2.04053385e-03 -7.37075351e-05] [-2.62966108e-04 4.10174882e-04 2.71128889e-04] [-2.41348057e-03 -3.44778918e-03 -6.18046566e-03] [ 2.05329637e-03 2.68514165e-03 3.77064589e-04] [ 2.79454122e-03 2.23708996e-03 -2.48386869e-03] [ 3.25960299e-04 -6.36842646e-04 -1.69705310e-04] [ 1.80989994e-03 -1.38746272e-03 -1.08467938e-03] [-2.58700566e-03 3.07760258e-04 -3.01833279e-03] [ 9.03823761e-04 -3.64345490e-04 3.98374954e-03] [-7.11572954e-04 -6.10672389e-03 1.86077662e-03] [-2.04906753e-03 -3.88102087e-03 9.12452810e-04]] Final stress: [-1.48589235e-03 1.47372094e-03 1.71020523e-05 3.23644182e-05 2.34812723e-03 -1.96066639e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-1.63315131e-03 -1.25205203e-03 4.22714354e-04] [ 4.80280294e-03 -2.35973078e-03 1.35676183e-03] [-1.66367577e-03 9.60315985e-04 9.65480488e-05] [ 6.87719039e-04 -1.93474697e-03 4.20526928e-05] [-4.57157989e-03 1.64644638e-03 7.27105097e-04] [ 1.28224242e-04 8.76255169e-04 3.18944284e-05] [-2.35372572e-03 7.79118439e-05 4.14336075e-03] [-5.19748551e-04 4.05978109e-03 -5.96034037e-03] [ 3.59600926e-03 3.98088961e-04 1.04714622e-03] [ 4.24507648e-03 -6.61795762e-04 2.90392367e-03] [-2.40468169e-03 -3.43088358e-03 -6.49679006e-04] [-4.71038111e-03 2.72846331e-03 -3.47360750e-03] [ 3.71028523e-03 -2.42123300e-03 -1.32850412e-03] [ 1.52058799e-03 6.94029025e-03 -1.35322655e-04] [-2.21748322e-03 -1.97109421e-03 6.78356934e-04] [-3.52726410e-03 3.15841861e-03 3.15549239e-03] [ 6.96045654e-04 -7.13044316e-03 -1.49413639e-03] [ 3.75302355e-03 4.03558146e-03 -2.21528365e-03] [ 4.85450902e-03 1.87796947e-03 1.17675269e-03] [ 3.91143692e-03 7.09339361e-03 6.42044440e-05] [-4.99651865e-03 -3.42577717e-03 -9.66820264e-04] [-7.09801894e-03 4.98834829e-03 5.34601556e-04] [ 3.79563860e-03 -5.29782011e-03 -7.71804458e-04] [ 3.66910822e-03 -1.37786668e-03 7.88868961e-04] [-3.09936571e-03 -3.56002692e-04 4.68551307e-03] [ 1.40184934e-03 -3.01649504e-03 -4.14223151e-04] [-7.24326917e-05 1.76610714e-03 -5.04579613e-03] [-3.71630374e-03 -3.02747641e-04 -1.06970922e-03] [ 2.83868929e-03 -2.70619806e-03 4.40029947e-03] [-2.93773770e-03 -4.76857235e-03 -2.79921613e-03] [ 1.23218865e-03 -2.76826603e-03 4.91374112e-05] [-2.65661266e-03 3.22338216e-03 3.31419056e-03] [-3.58000785e-03 1.51971669e-03 -2.34412694e-03] [ 3.01776624e-03 5.30546139e-04 1.15412236e-03] [ 1.19781762e-03 -3.45278758e-03 9.84674022e-04] [ 2.69991103e-03 2.75349626e-03 -3.08915097e-03]] Final stress: [ 1.50854316e-03 -1.49521565e-03 -2.46007991e-05 -8.93524006e-06 -2.33468636e-03 4.94115912e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 4.52887789e-03 2.26986650e-03 -8.27490252e-04] [-2.60716527e-03 2.71376568e-03 -6.58173789e-04] [-1.14160964e-03 3.43941945e-03 3.75023394e-04] [ 7.77707322e-04 7.36276018e-04 1.76882059e-04] [ 2.20855596e-03 -1.60445704e-03 -4.55987848e-04] [ 9.75298603e-03 8.61463429e-03 2.62585553e-03] [-8.91404805e-03 -9.68120691e-03 -6.68273030e-03] [ 1.67715663e-02 -5.94136721e-03 2.59126093e-03] [ 1.07112081e-03 -4.33220735e-03 4.77518380e-03] [-3.12700141e-03 -9.96800129e-03 6.50691278e-03] [-3.46370587e-03 4.40690120e-03 -2.87765297e-03] [-4.31003815e-03 -3.81068341e-03 -5.20406246e-03] [-1.46681106e-02 6.23595683e-04 -3.60292567e-04] [ 1.80612223e-04 -5.75416280e-03 -7.59182389e-04] [ 1.83620278e-02 6.52691853e-04 -1.82148124e-03] [ 3.96361098e-03 6.92436517e-03 -3.78117017e-03] [ 5.21789487e-03 -8.16523295e-03 1.45218046e-03] [-1.56935163e-02 -3.64116425e-03 4.35136015e-03] [-5.38424555e-03 1.47507565e-03 7.36798342e-04] [ 1.27308782e-03 2.36121340e-05 1.74062516e-03] [-6.48126616e-03 1.04657999e-02 -3.56713900e-03] [-2.41960242e-03 -2.94774339e-03 -1.54821091e-03] [ 1.74253542e-03 9.32482619e-03 -1.76216497e-03] [ 8.36712862e-03 -1.73186618e-03 5.04433669e-03] [ 1.21189866e-03 1.43675742e-03 -1.99842889e-03] [ 7.48048019e-04 4.45921890e-04 2.19989224e-03] [-3.21720321e-03 8.30234876e-05 2.87367960e-03] [ 1.33935728e-03 1.99196721e-03 -1.53554370e-03] [-2.64775689e-03 3.98012446e-03 -4.59384316e-04] [-6.17074952e-03 3.04988233e-04 -2.59638282e-03] [-1.19302293e-03 -1.45408883e-04 1.49558503e-03] [ 1.26323487e-03 3.46524193e-03 4.13597423e-04] [-4.64814522e-03 -1.92543899e-03 -2.01710832e-04] [ 4.24618472e-03 -2.75500565e-03 -2.55803775e-03] [ 5.70388485e-04 -3.49955429e-03 2.02767985e-03] [ 2.49036315e-03 2.52464623e-03 2.68373722e-04]] Final stress: [-3.08579444e-04 -2.30339588e-04 -9.37454802e-05 1.51428308e-03 3.93083339e-05 2.82450385e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-2.91060464e-04 1.30680705e-03 1.49573960e-05] [ 5.39706957e-03 -3.02161674e-03 1.10706247e-03] [-4.06904162e-05 1.10881425e-03 2.21520567e-04] [-4.20192395e-04 -3.12729193e-03 4.23176734e-04] [ 4.47539659e-04 6.20225936e-04 -2.80894210e-05] [-1.33039573e-03 -3.31719361e-04 -1.57485703e-04] [ 7.54833146e-03 -5.44180359e-04 -1.80641307e-03] [ 5.14716796e-04 1.21588879e-03 4.31445136e-04] [ 7.63645656e-03 4.19310282e-03 1.88509689e-03] [-4.23052981e-03 8.33204084e-03 2.25684231e-03] [-9.51039472e-04 2.67670615e-03 -9.61209321e-04] [-3.52818176e-03 3.11027190e-03 -2.76734152e-03] [-3.69135695e-03 2.51606698e-04 -1.91922447e-03] [-1.47326393e-04 2.05310873e-03 -1.13916707e-03] [ 7.27533998e-03 1.90789243e-03 -7.20373404e-04] [-1.31699509e-04 -9.24806703e-05 1.44334009e-03] [-3.34748196e-03 -8.54062922e-03 -2.75440013e-04] [ 2.95288323e-05 6.08070848e-03 1.71240128e-03] [-2.69971825e-03 2.51992601e-03 -5.99492125e-04] [-4.41263555e-03 -7.22698923e-03 -5.06826424e-05] [-6.02367197e-03 2.51824631e-03 -1.87235779e-03] [ 5.71565804e-03 -6.03817051e-03 -3.53620189e-04] [-4.19672304e-05 -4.46342336e-03 -3.92206142e-04] [ 2.19606660e-03 -5.07661927e-03 4.39949108e-03] [-2.02432475e-03 -3.14544291e-03 1.05810767e-03] [-3.24564816e-03 1.35709783e-04 -3.16457744e-03] [ 4.03138268e-04 1.34294461e-03 -1.03114357e-03] [-1.07848510e-03 -5.16964926e-05 1.05403588e-03] [-3.50134730e-04 1.45636245e-03 -1.27927263e-03] [-3.11559751e-04 -1.65114833e-03 1.58421031e-03] [ 2.39586950e-03 3.56096823e-03 -1.87676184e-03] [ 1.18122213e-03 -1.99360335e-03 3.03033990e-03] [ 4.33210304e-04 9.72450247e-04 1.28796054e-04] [-2.80307903e-03 1.38746139e-03 -1.06343900e-03] [-5.24180868e-05 -8.84133826e-04 3.45042567e-03] [-2.05502415e-05 -5.62097535e-04 -2.74295207e-03]] Final stress: [-2.30454113e-04 -2.86284485e-04 -6.86967604e-05 -1.46781090e-03 2.71667625e-05 -2.81529732e-03] Minimization converged after 42 steps. Minimization converged after 50 steps. Minimization converged after 43 steps. Minimization converged after 50 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 62 steps. Final forces: [[-6.27732528e-03 -2.63070096e-03 1.44907319e-03] [ 2.80878935e-03 3.03948805e-04 3.85396304e-04] [ 7.60292650e-04 8.93268474e-04 2.81813459e-05] [ 4.75921037e-05 1.73740955e-03 -3.96805799e-04] [-3.86257734e-03 3.62732724e-03 5.44494674e-04] [ 1.26909652e-04 1.73948094e-03 3.70957620e-04] [-9.27168397e-04 2.09943015e-04 1.51061351e-03] [-1.72275800e-03 -4.95129154e-04 -1.67031068e-03] [-3.91711606e-06 6.41250155e-04 -7.24099713e-04] [-1.69548066e-05 -2.96006259e-03 -7.33334895e-04] [ 7.04840063e-04 -2.62404355e-03 5.56968131e-04] [ 2.14873605e-04 -3.00692540e-03 -4.96220743e-04] [ 7.88504298e-04 -8.54119798e-04 -2.96988656e-03] [ 1.39570759e-03 -3.24558184e-03 -4.62647357e-04] [ 2.32903345e-03 3.15879771e-04 1.12005299e-03] [ 2.07419464e-04 -1.47466751e-03 -2.82918840e-04] [-9.46044837e-05 3.34587055e-03 1.08296893e-03] [-3.36217590e-03 -7.29122424e-04 8.12531395e-04] [ 6.78062473e-04 3.43756732e-04 -4.18811974e-03] [ 5.96782031e-04 5.41243745e-04 -7.84104369e-04] [-6.68598175e-04 1.18139232e-03 1.67346073e-03] [ 1.59331229e-04 -1.93551758e-04 -5.20582842e-04] [-2.47367982e-04 -1.17377983e-03 2.03848725e-03] [-3.24410760e-04 -1.83006115e-03 2.16896076e-03] [ 1.27571993e-03 8.58118048e-04 -1.75141244e-03] [ 1.26094369e-03 6.52846523e-04 1.31130552e-03] [-1.16602459e-03 1.54431709e-03 1.40585860e-03] [-2.11401403e-04 1.63940653e-03 -5.61905466e-06] [ 3.87178157e-04 2.78210689e-03 8.88710507e-04] [ 2.02572651e-03 1.05998123e-03 1.71334562e-04] [ 2.81065685e-03 8.68414994e-04 -9.35817018e-04] [-2.78293325e-04 -1.10083757e-03 2.00295496e-03] [ 1.28887243e-03 -1.18260854e-03 -1.96191926e-03] [ 8.01127182e-04 1.12951386e-03 -4.58713029e-04] [-9.96447106e-04 -1.52864533e-04 1.09389434e-03] [-5.08338057e-04 -1.76141985e-03 -2.27369297e-03]] Final stress: [-6.77195001e-05 -5.20209540e-07 5.90431437e-06 1.46482853e-03 -3.11954400e-05 9.64808763e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 4.39380739e-04 -6.48695564e-04 4.99940485e-05] [ 4.10415905e-03 -3.09420455e-03 8.83901353e-04] [-9.61884320e-07 1.45493761e-03 2.60984448e-04] [ 2.89767607e-04 -3.10262380e-03 3.84755749e-04] [-2.23618728e-03 4.98700170e-04 4.10548737e-04] [-8.32760069e-04 -1.27092037e-03 -1.64368297e-04] [-1.14753789e-03 5.29458180e-04 -1.92047069e-03] [-1.51584758e-03 1.64873371e-03 -3.35998151e-04] [ 2.11705439e-04 3.10841558e-03 1.50271725e-03] [ 1.38514596e-04 4.92620464e-04 1.38292755e-03] [ 1.52115124e-03 1.50699636e-03 -1.34770983e-04] [-4.93340688e-04 4.49591073e-04 -1.59320620e-03] [-1.38490343e-03 -1.56102443e-03 1.73619977e-03] [ 7.73109947e-04 1.01001769e-03 -1.41096640e-03] [ 1.63252160e-03 -1.61878243e-03 -8.26316536e-04] [-1.59994998e-03 1.55405637e-03 -4.79423309e-04] [-8.12737114e-05 2.86887011e-04 1.52093954e-03] [ 2.37185050e-04 2.52418403e-03 -1.23707423e-03] [-1.33512779e-04 2.20542070e-03 -1.96962937e-04] [ 1.18120884e-03 -4.04677259e-03 7.63980971e-04] [-6.07409697e-05 1.62259781e-03 -1.13695890e-03] [ 5.72629895e-04 8.75063961e-04 1.48750605e-03] [ 8.12218415e-04 -1.66866188e-05 -3.12204832e-04] [-2.97971770e-03 -9.98169000e-04 -1.79640477e-04] [ 2.44892979e-03 3.39193226e-03 -5.95726184e-04] [-1.41395401e-04 -6.03570281e-04 -6.75284781e-04] [ 1.62683047e-03 2.68128345e-03 -1.63532629e-03] [-4.08274423e-03 -1.08878719e-03 6.45605628e-04] [ 1.82516797e-03 -1.44319454e-03 1.09381652e-03] [ 3.59898789e-03 -9.21947901e-04 1.34433612e-03] [-2.41369086e-03 -4.09023667e-03 1.13062467e-03] [ 8.41461338e-05 -3.31509841e-04 8.93149992e-05] [ 4.34167873e-04 -2.44490431e-03 1.06205340e-03] [ 1.50000771e-03 2.04760018e-03 -6.58054244e-04] [-9.82649524e-04 9.13232377e-04 -1.77557202e-03] [-3.34457627e-03 -1.51969888e-03 -4.81881338e-04]] Final stress: [-8.69588247e-05 -1.47023536e-06 -4.49049823e-06 -1.46316737e-03 -2.07819861e-06 -9.13221299e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-3.22270066e-03 7.24765731e-04 3.93559670e-04] [ 2.44369853e-03 -3.45248232e-03 4.15290347e-04] [-3.53674477e-03 5.64168444e-04 -3.45573387e-05] [-2.91610764e-03 -3.11633770e-03 5.76618786e-04] [-3.04701631e-03 3.12564593e-03 7.16620371e-04] [ 2.20623228e-04 3.10882224e-03 4.08674498e-04] [-2.49117283e-03 -2.68897083e-03 -2.74852482e-03] [-5.57254000e-04 -1.24232938e-04 4.81332504e-05] [-3.38801115e-04 -2.02258789e-03 -1.96267770e-03] [ 1.67975467e-03 9.06712074e-04 1.21984886e-03] [ 8.93040572e-04 3.27351390e-04 2.62606151e-03] [-1.37502852e-04 3.30980424e-03 1.30171824e-03] [-4.70302385e-04 -2.21440846e-03 3.44009203e-03] [ 5.15254264e-04 -1.06324809e-03 4.41069205e-05] [-6.29264387e-04 2.88437859e-03 4.01726331e-03] [ 1.67216658e-04 2.10187024e-03 -2.86506625e-03] [ 3.56198034e-04 -3.75540132e-03 -8.17090153e-04] [-1.98195468e-04 -5.29270342e-04 -3.23233076e-03] [-1.03621303e-03 7.79346095e-04 -3.77836562e-04] [-2.01046587e-03 3.15863511e-03 3.62362979e-03] [-2.86539949e-04 -8.12274894e-04 1.50794328e-03] [ 7.91405854e-04 -2.59580267e-03 1.08299873e-03] [ 2.15402277e-03 -4.14403278e-04 -5.25274929e-03] [ 9.50109327e-04 1.68983494e-03 1.67966175e-03] [ 3.21414047e-03 9.25071183e-04 -2.30616111e-04] [-2.55302120e-03 2.85459516e-04 -1.63607173e-04] [ 3.01642187e-03 -2.45950274e-03 1.44624453e-03] [ 2.38168686e-03 7.83883541e-04 1.61461328e-03] [-1.12191392e-03 2.98779791e-03 4.75579199e-04] [-1.21742556e-03 7.31410172e-04 2.16595781e-03] [ 2.69202641e-03 -3.53255656e-04 -3.40166190e-03] [ 2.45466552e-03 1.78153434e-03 -1.80909798e-03] [ 3.93605988e-04 -2.59948625e-03 2.09931732e-03] [-1.75711837e-03 -1.50576881e-03 -6.90299761e-04] [-2.29989205e-03 8.67556402e-04 -3.99987502e-03] [ 5.50378135e-03 -1.33661390e-03 -3.31794264e-03]] Final stress: [-9.43221864e-04 9.10753837e-04 6.57781864e-06 3.17128456e-05 1.46469971e-03 -1.44439385e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-8.03042654e-02 -1.81187266e-02 1.19329384e-02] [ 3.27275010e-02 -1.28422764e-01 1.72890122e-02] [ 6.70027198e-02 9.47581979e-02 1.11445895e-02] [-1.29295838e-01 -9.52357912e-02 1.14488324e-02] [-1.21889944e-01 6.72148375e-02 2.31411462e-02] [ 3.72272531e-02 -3.66823316e-02 4.85508858e-04] [-3.83612821e-01 -5.82684693e-02 -4.74555901e-02] [-7.07582932e-01 -9.21663594e-02 -5.89068991e-02] [-1.17388510e-02 3.89110328e-01 8.78811022e-02] [ 3.21161349e-01 1.57369693e-01 -3.60720104e-02] [-3.32714039e-01 -2.08102639e-01 3.58412877e-02] [-3.99339513e-02 2.90028397e-02 -4.85530790e-03] [ 9.67932243e-02 -9.17799959e-02 6.61301707e-02] [-5.19550643e-02 -1.02700216e-01 -1.42792284e-01] [-9.91997734e-02 5.15509917e-02 8.53230020e-02] [-1.84712761e-02 -1.12330373e-01 -5.09203904e-02] [ 1.24527787e-03 2.90747966e-01 7.97567858e-02] [ 2.58934024e-02 -5.16268669e-02 -5.34852159e-02] [ 7.37463725e-01 -4.33780610e-01 -3.81535156e-02] [ 1.23087086e-01 3.84202304e-01 1.30283624e-01] [ 4.13592088e-03 -2.25165422e-01 -7.98717350e-02] [-4.13913657e-02 2.09325365e-01 3.21045478e-02] [-5.97208189e-02 -6.26537510e-01 -1.34674266e-01] [ 5.43567632e-01 2.28847904e-01 1.25894278e-01] [ 8.94296124e-02 -6.59844466e-03 9.54186069e-03] [-1.34314300e-02 -5.85341646e-02 -5.74895841e-02] [ 1.87160013e-01 3.55682417e-02 -2.34599835e-02] [-1.20161959e-01 2.13264974e-02 -7.33777263e-02] [-2.98160104e-02 1.59146720e-01 6.62460292e-02] [-8.92273618e-02 -7.26945767e-02 7.06327054e-02] [-5.21636786e-02 2.76855321e-02 -1.50473902e-02] [ 1.48851987e-01 1.38377998e-01 -4.69274416e-02] [-1.98123560e-01 2.29509113e-02 5.95995460e-02] [ 1.30230440e-01 1.26417780e-01 6.16228951e-02] [ 2.69624418e-02 -1.06528163e-01 -7.67897749e-02] [ 7.79535333e-03 9.16693183e-02 -4.60207471e-02]] Final stress: [ 0.00569339 0.00521134 -0.00134454 0.00125173 -0.00149352 -0.00035174] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-0.00187482 0.01498297 -0.00469846] [-0.01716069 0.02728425 -0.00246649] [ 0.00794822 -0.00295677 -0.00517764] [ 0.00522005 -0.00521554 0.00820313] [ 0.01245737 0.00436241 0.03165104] [-0.02062006 0.00170126 -0.03012845] [-0.03330215 -0.07985991 0.01557491] [-0.08319671 -0.00178927 -0.01361135] [ 0.11711556 -0.04342513 0.00089223] [-0.06189007 -0.10195713 0.02065661] [-0.00540017 -0.01483155 0.00896989] [ 0.03195303 0.02192478 -0.02021062] [ 0.00415058 -0.01254939 0.00523734] [ 0.0120247 0.01518052 -0.00826977] [ 0.00822451 -0.00821652 0.00179543] [-0.00462156 0.01202388 0.00513135] [ 0.01213927 -0.01755883 -0.01210662] [-0.00680938 -0.01935119 0.01050251] [ 0.01427638 -0.02795564 -0.0137495 ] [-0.07321074 0.12502992 -0.0357957 ] [ 0.07870346 0.03802135 -0.01037474] [-0.10823733 -0.07375849 0.03019236] [ 0.01293162 0.16692685 0.01182156] [ 0.1069654 0.03483414 -0.00274164] [-0.01423981 -0.01820267 0.00616529] [ 0.00739531 0.01649756 0.00274174] [-0.00520868 -0.02878134 -0.00320411] [ 0.00320239 -0.00588731 0.00497533] [ 0.00925066 0.0193366 -0.00170922] [ 0.00533746 -0.01537271 -0.01565404] [ 0.00369359 -0.00119945 0.02124652] [-0.00732968 0.00487872 0.01239479] [-0.00327167 -0.00024062 -0.012133 ] [ 0.01918173 -0.02037617 0.0032583 ] [-0.02536673 0.00645511 0.00652754] [-0.00043103 -0.00995467 -0.01590653]] Final stress: [ 2.81770073e-02 2.74930270e-02 1.62034821e-02 7.59165133e-04 -4.43216095e-05 9.35646454e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[-3.67478049e-03 -7.66346954e-04 3.74378659e-04] [-1.14426933e-03 1.74561211e-03 -1.73523334e-04] [-9.30437052e-05 -2.10435213e-03 -2.84362281e-04] [-1.92244609e-04 -2.31326611e-03 3.34954872e-04] [ 4.17192021e-03 -1.30608753e-03 -6.02358119e-04] [ 9.70595756e-04 1.54421788e-03 1.10806544e-04] [-5.49682730e-04 -2.83020441e-03 -8.70621811e-04] [ 1.21354501e-03 -9.42004040e-04 4.48767943e-05] [-7.74196200e-03 1.09417714e-02 1.52095658e-03] [ 1.02805420e-03 3.58481718e-03 9.68574528e-04] [ 5.77515984e-03 -1.91244013e-03 -3.15016246e-04] [ 3.33396812e-03 -5.88691724e-03 -1.46543576e-03] [ 6.24676366e-03 9.12844469e-04 -2.33039227e-03] [-6.25665200e-05 2.79155035e-03 5.17876451e-04] [-5.31396690e-03 1.70066991e-03 1.20286270e-03] [-5.11256386e-04 -4.20884038e-04 1.75662650e-03] [ 5.38322597e-04 -1.11164212e-03 -8.55302996e-04] [-1.75196206e-03 -2.58237767e-03 -1.84450857e-04] [ 2.40956998e-03 -9.44939457e-04 1.29252639e-03] [ 3.81066012e-03 -7.80446350e-03 -9.29762633e-05] [ 5.24890541e-04 6.42010491e-03 -1.38525093e-03] [-2.17963378e-04 -1.43407713e-03 -3.41117248e-03] [-4.44579957e-03 7.78999623e-04 -6.70713455e-04] [-3.82234654e-03 -1.46168107e-03 4.29566594e-03] [-3.38033119e-04 -9.98432956e-04 1.03821200e-03] [ 3.49519657e-04 -1.17696013e-03 -1.29483507e-03] [ 2.12888802e-03 -9.11258634e-04 -3.29298152e-04] [ 4.16296037e-04 1.13660753e-03 -1.38613669e-03] [-1.85186093e-03 2.68201486e-03 -7.69466597e-04] [-1.25949171e-03 -2.17037248e-03 1.29993989e-03] [ 8.90260979e-04 1.37701834e-03 -2.16254818e-03] [-5.18088789e-04 1.77434537e-03 2.31370593e-03] [-1.29571975e-03 2.75449923e-03 1.37929432e-03] [-2.50138354e-04 -1.63766636e-05 1.29430332e-03] [ 3.77373961e-04 -2.30160567e-03 1.89765262e-03] [ 8.49388202e-04 1.25161691e-03 -3.05935256e-03]] Final stress: [-1.53843200e-04 -2.67955089e-04 -6.22477967e-05 -9.17095214e-04 2.21709003e-05 -1.78106193e-03] Minimization converged after 42 steps. Minimization converged after 48 steps. Minimization converged after 40 steps. Minimization converged after 48 steps. Minimization converged after 12 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 61 steps. Final forces: [[ 3.10516004e-03 1.58901933e-03 -7.56406108e-04] [-2.25326960e-03 1.00243578e-03 -3.61156019e-04] [ 3.78860090e-04 -2.54881494e-03 -3.87706569e-04] [-1.67132722e-03 2.18883163e-03 -3.37151156e-04] [ 3.17112594e-03 -1.15278134e-03 -4.52292874e-04] [-2.00069315e-03 7.05027872e-04 -2.91553820e-04] [-3.39048948e-03 -2.24381680e-03 -5.40312894e-04] [-4.31509206e-05 3.33579579e-04 1.17513116e-03] [ 2.06399455e-03 -3.85725195e-03 1.94075427e-04] [-1.95423477e-03 2.49321543e-04 -9.12649809e-04] [ 2.29111028e-03 1.22849797e-03 9.67035984e-04] [-1.48526918e-03 -3.73835944e-03 5.70079769e-04] [-6.50472407e-03 6.81199691e-04 -8.95351490e-04] [ 2.01829106e-04 -7.40976422e-03 8.49263770e-04] [ 6.69583485e-03 -1.22316823e-03 8.78968213e-04] [-6.69260348e-03 4.84273979e-03 1.99060059e-03] [ 2.33556559e-03 2.70753893e-03 1.67832304e-03] [ 4.34525625e-03 -6.27854671e-04 -3.08150475e-03] [ 5.37992104e-04 -3.14319230e-03 2.33564859e-03] [-2.10403540e-03 4.96756610e-03 1.58862073e-04] [ 4.71052902e-04 -1.67271611e-03 -1.14508161e-03] [-5.19203111e-04 1.26253970e-03 -3.18793314e-03] [ 4.39686375e-04 -1.03084130e-04 -3.46056703e-04] [-7.05344199e-05 2.21833761e-03 1.41217286e-03] [-3.33006792e-06 9.40997223e-04 -8.23654121e-04] [-1.20225621e-05 1.38311115e-03 7.85819171e-04] [ 3.74411169e-03 6.78708791e-04 -1.56751728e-03] [-2.94994029e-03 1.33625982e-03 1.65207894e-03] [-3.00540740e-03 1.04060060e-04 -1.73389387e-03] [-6.50058619e-04 2.40108658e-03 3.48852402e-04] [-8.80173834e-04 -4.58980192e-04 -6.43668281e-04] [ 1.19122647e-03 -2.49922857e-04 -1.73302780e-04] [-6.35929698e-04 -1.85982235e-03 1.76923861e-03] [ 2.90131245e-03 -9.38843788e-04 1.05656050e-03] [ 1.40144892e-03 6.15339516e-04 -6.87055234e-04] [ 1.55082967e-03 -2.07825340e-04 5.01537425e-04]] Final stress: [-7.06574918e-05 6.11726763e-05 -7.80376481e-06 9.15796760e-04 3.28782765e-05 5.91529794e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 0.05114064 -0.00972815 -0.00395463] [ 0.23960184 -0.10131103 0.05430562] [-0.25525479 -0.14212221 -0.01850742] [ 0.26156141 -0.12531397 -0.00317846] [-0.03402515 0.05023457 0.01451673] [-0.28420575 -0.05593058 -0.03814875] [ 0.05718187 0.07911028 0.13134803] [ 0.06070182 -0.14830136 -0.09948852] [-0.10223226 0.19680671 -0.03115329] [ 0.08705203 0.00167822 -0.04104258] [-0.29480028 0.06357985 0.04140024] [-0.05784985 0.10447123 -0.00162257] [ 0.11178877 -0.21926218 0.17605903] [ 0.00761884 0.06904131 -0.03559936] [ 0.22687097 -0.04118315 -0.14569351] [ 0.13699956 -0.00979113 -0.04518494] [-0.01427146 -0.11888987 0.10019837] [-0.28616306 -0.0591418 -0.05378016] [ 0.03673797 0.0703417 -0.06943722] [ 0.25646556 0.19600018 -0.00114943] [-0.34692625 -0.28331794 0.05910121] [-0.25017291 0.28464151 0.17442798] [ 0.03216717 -0.01124767 -0.00271782] [ 0.2534468 0.11666861 -0.15488765] [-0.05475371 -0.00239217 -0.02212724] [ 0.43317133 -0.15922506 0.1443927 ] [ 0.07370268 0.30015048 0.2221679 ] [-0.05372612 0.06282691 -0.18463724] [ 0.19898248 -0.03314156 0.00308047] [-0.47714745 -0.16115277 -0.15732521] [ 0.10496246 0.02978244 0.1028017 ] [-0.04375183 0.01790819 -0.28214918] [-0.12857822 0.02091491 -0.12185153] [ 0.19695809 0.03746451 0.0019153 ] [-0.15388987 0.02551059 0.01126881] [ 0.01063665 -0.0456796 0.27665258]] Final stress: [-0.00127379 0.00210487 -0.00292192 -0.00076662 -0.00220824 0.00090494] Minimization converged after 50 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-7.34607014e-04 1.24002613e-03 7.09397835e-05] [-2.55973305e-03 2.91649805e-03 -5.04920859e-04] [-8.76667210e-05 1.39892301e-03 1.56642432e-04] [ 2.26451494e-04 2.82224219e-03 -4.68565626e-04] [ 1.46156969e-03 1.44658363e-03 -1.22271114e-04] [ 3.14291495e-03 3.79698142e-03 8.40538624e-04] [ 7.67195843e-04 5.11837798e-03 1.02748103e-03] [ 1.06223319e-02 -2.20312420e-04 1.42659985e-03] [ 5.30193404e-03 -9.42282928e-03 -1.30390139e-03] [-5.11414193e-03 -9.22390227e-03 -3.26489532e-04] [ 3.00817731e-03 -2.27803312e-03 -9.10087161e-04] [-1.39427675e-02 1.82510206e-02 -5.27100671e-04] [ 3.61934860e-03 3.87569990e-03 -3.27752593e-03] [ 1.14785315e-03 -2.74297652e-03 -8.85893481e-04] [-3.60071804e-03 5.57464100e-04 2.02485283e-03] [-3.32460678e-03 -3.92583796e-03 -2.75045638e-04] [-2.26153587e-04 2.63268348e-04 2.35047142e-03] [ 2.78189123e-03 -2.33999478e-03 -2.48070781e-05] [-4.72129609e-03 -3.73756825e-03 3.04720917e-04] [-8.63141055e-03 9.33720204e-04 -2.14952433e-03] [-5.17846219e-03 -2.17935633e-04 2.09252475e-04] [-5.96079430e-04 -2.28251154e-03 -3.24325572e-03] [ 1.39100028e-02 -8.90561548e-03 2.64850794e-03] [ 1.46737327e-04 3.06388636e-05 2.14488472e-03] [ 3.73080064e-04 -4.58489141e-04 -1.88401213e-03] [-2.94424170e-03 4.99125534e-03 3.68609695e-04] [-2.04718123e-03 -1.07196715e-03 -1.52793259e-03] [ 5.03195378e-03 -2.20845832e-03 3.87577040e-03] [-1.90035204e-03 1.79735691e-03 -2.72404329e-03] [ 1.17765976e-03 8.37809084e-04 6.81921163e-04] [ 7.91703522e-04 8.32765276e-04 -4.57570221e-04] [ 3.72998867e-03 -3.50366542e-03 2.60940879e-03] [-1.03965564e-03 2.32824121e-04 2.02796718e-03] [-7.27257017e-04 2.06666296e-03 -3.77041601e-03] [ 8.89724619e-04 -1.56456446e-03 3.63779933e-03] [-7.54188355e-04 6.94543639e-04 -2.02300578e-03]] Final stress: [ 1.81376732e-05 -1.03219041e-04 7.36566879e-06 5.72737600e-04 4.31515324e-05 1.04581764e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 1.54314352e-03 8.88152804e-05 -1.64055820e-04] [ 2.87777713e-03 -2.31155755e-03 5.98930481e-04] [ 1.43033042e-04 3.15675475e-04 -6.17234727e-06] [-2.15263526e-04 -2.57114087e-03 3.15698174e-04] [-1.94328472e-03 4.58238587e-04 3.47162614e-04] [-3.32538862e-03 -2.12138047e-03 -4.69235662e-04] [-3.60955987e-03 -1.22725883e-02 9.04784031e-04] [-9.60181122e-03 9.24671182e-04 -9.98164186e-04] [-1.00134961e-02 1.36389718e-02 8.86846348e-04] [ 3.74198785e-03 1.13689542e-02 -2.38003864e-03] [-5.45133752e-03 -1.20042529e-03 1.60796754e-03] [-1.66883445e-04 3.39434075e-03 -4.13230176e-04] [ 5.95629175e-03 5.37734682e-04 1.10531622e-04] [-1.52434243e-04 3.82767394e-04 -1.36966325e-03] [-4.86935200e-03 2.52043548e-03 1.01855889e-03] [-3.94933010e-03 -1.41990577e-04 -1.15561619e-04] [ 1.07607756e-03 5.48415219e-04 1.75351272e-03] [ 2.58199078e-03 -2.62336035e-03 -1.57304502e-03] [ 8.49992794e-03 -3.97417056e-03 1.65386880e-03] [ 9.39750758e-03 5.89781785e-04 5.80186627e-04] [ 2.52387918e-03 1.02593721e-03 -1.08645354e-03] [ 4.78309709e-03 -4.39277938e-03 -7.69774350e-04] [-5.55220865e-03 -8.19767725e-03 -4.40565352e-04] [ 4.20211996e-03 8.07418379e-04 1.87377347e-04] [-2.17510186e-03 -2.86076289e-03 -1.10781186e-03] [ 7.53701315e-04 -2.62023002e-04 -3.19132488e-03] [ 2.18165625e-03 2.65702206e-05 -5.54534499e-04] [-3.55335664e-04 5.95383729e-04 7.19443815e-04] [ 1.41364737e-03 4.08302705e-04 -2.08153064e-04] [ 2.82118572e-03 -1.13947857e-03 1.53307566e-03] [ 2.42386663e-03 3.02297718e-03 9.67803976e-04] [-9.57465644e-05 1.42919174e-03 2.00481678e-03] [-1.20423363e-03 1.73392543e-04 1.78690543e-03] [ 6.63009011e-05 -2.64067047e-06 -1.01463991e-03] [-1.12201127e-03 1.75690206e-04 -1.05736257e-03] [-3.18441252e-03 1.63830995e-03 -5.76841073e-05]] Final stress: [-2.82177786e-05 -1.67533728e-04 -4.42473220e-05 -5.86635841e-04 8.71294877e-06 -1.06877719e-03] Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 57 steps. Minimization converged after 57 steps. Minimization converged after 53 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-1.15727379e-03 3.97914809e-04 1.33336196e-04] [-5.64860041e-03 -2.82159447e-03 -5.69135697e-04] [-3.10196196e-03 2.26284889e-03 3.88506186e-04] [ 1.17594425e-03 6.91661650e-04 -1.21263991e-04] [ 1.77450363e-03 1.18483374e-03 -1.63374241e-04] [ 7.42811025e-03 -8.37985859e-04 1.04203905e-03] [-1.70977793e-03 4.88042324e-03 6.38292734e-04] [-4.57601065e-03 1.54470059e-03 2.08599450e-03] [ 6.90176718e-03 -8.79683878e-04 -9.84382214e-04] [-7.51503356e-04 4.34731341e-03 -7.59192324e-03] [-1.42943289e-03 -1.38907523e-03 2.88169987e-03] [ 1.80640844e-05 -1.60939248e-03 2.75353576e-03] [ 1.07435520e-03 4.12540470e-03 -1.39443579e-03] [ 1.86169186e-03 -2.67018596e-04 -3.95308824e-04] [-1.21858927e-03 1.20157717e-03 4.89492410e-04] [-5.86851682e-03 -2.73142753e-03 3.98069331e-03] [-6.32068451e-04 1.79149353e-03 -1.11864708e-03] [ 5.23822521e-03 -4.76333013e-04 -1.43862668e-03] [ 6.29929356e-03 2.11829158e-03 4.94439523e-03] [-2.54032541e-03 1.95764467e-03 6.23097343e-05] [-1.36371692e-03 8.53932762e-04 -3.96185666e-03] [-1.90359277e-03 5.67919422e-04 1.18340330e-03] [-2.06202489e-03 -2.33428125e-03 -1.11828712e-03] [ 1.86286672e-03 -1.58899593e-03 -2.16268413e-04] [-3.58728824e-03 -6.07774751e-03 1.89152465e-03] [-2.35155544e-03 -3.62280976e-03 -2.56750399e-03] [-1.83225853e-03 -1.46263580e-04 -1.41472212e-03] [ 4.68480963e-04 1.25039639e-03 1.83942506e-03] [ 3.60089126e-03 -3.48226140e-03 -4.43241447e-03] [ 2.79834453e-03 -1.08055361e-03 2.74791983e-04] [ 6.27959439e-04 -2.56249118e-03 -1.87068169e-03] [ 7.66940453e-04 1.84219810e-03 -3.28112115e-03] [ 1.30692783e-03 6.85374307e-04 5.30704955e-03] [ 2.91333294e-04 -1.23889975e-03 -6.07199443e-04] [ 6.54492142e-04 -2.64373079e-04 -1.50714631e-03] [-2.41569413e-03 1.70725915e-03 4.85780959e-03]] Final stress: [ 4.68312555e-05 -1.45456953e-04 -3.80518594e-05 3.65326886e-04 5.08413393e-05 7.10387360e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-7.86407449e-04 2.22449670e-03 -1.39136714e-04] [ 4.93464808e-03 -1.26436945e-03 8.23927121e-04] [-2.59274643e-04 -2.07700028e-03 -3.02037928e-04] [-6.53248774e-04 -2.01336416e-03 3.00151307e-04] [ 1.18578454e-03 1.28004389e-03 2.83500525e-05] [-4.41067321e-03 -6.70504872e-04 -6.74015861e-04] [ 2.13708552e-03 1.19994163e-03 -5.59606055e-04] [-2.95608935e-03 -6.27469622e-04 2.28790900e-04] [ 5.25661311e-04 -2.39787101e-04 -1.67199502e-04] [ 2.51151959e-03 2.31373259e-03 2.13101876e-03] [-1.44076038e-03 -2.28781263e-03 8.82425296e-05] [ 1.74573001e-03 -2.62453179e-03 -1.49434855e-03] [ 1.48855190e-03 5.56046350e-04 -2.10551419e-03] [-1.22859868e-04 -3.77511473e-04 -2.32894415e-05] [-1.69111493e-03 1.49930862e-03 3.15828945e-03] [ 2.07040600e-03 4.08160281e-04 4.09033767e-04] [ 9.97666163e-04 1.11863081e-03 -1.23624652e-03] [-3.34884783e-03 -2.39227621e-03 -1.76792330e-04] [ 2.01267055e-03 7.97768902e-04 7.93260159e-04] [-1.86152526e-03 -1.91769198e-03 2.54823396e-04] [ 1.99060145e-03 1.21163682e-03 -4.71208244e-04] [ 7.68452702e-04 -1.23759913e-03 -4.31097516e-03] [-2.74816685e-03 -9.79483204e-04 -1.07797892e-03] [ 6.54317676e-04 -1.05253820e-03 4.96891159e-03] [ 2.15236601e-03 -1.31282600e-03 8.05545569e-06] [-2.90194380e-03 2.43731060e-04 -1.37785770e-04] [-3.05286749e-04 -2.03639601e-03 -9.73872592e-04] [ 7.65386963e-04 1.85550726e-03 7.99679430e-04] [-3.79828354e-03 1.00383761e-04 -3.27381251e-04] [ 4.07362924e-03 1.29317020e-03 1.37284312e-03] [-9.36287359e-04 1.81987990e-03 -2.43829581e-03] [ 1.70865297e-03 -1.50401381e-04 2.70841313e-03] [-4.66493401e-05 4.38639175e-03 2.25857843e-03] [-1.42535933e-03 7.09426835e-04 -8.51961137e-04] [ 1.78792676e-03 9.58528175e-04 2.34965413e-03] [-3.81827878e-03 -7.15222064e-04 -5.21437676e-03]] Final stress: [-1.13770175e-05 -8.96521503e-05 1.24665106e-05 -3.44963432e-04 4.38246792e-05 -7.04976874e-04] Minimization converged after 39 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 53 steps. Minimization converged after 50 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 53 steps. Minimization converged after 56 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 25 steps. Minimization converged after 11 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 54 steps. Minimization converged after 52 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.1,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.66733 0.36228 0.07309 0.00002 -0.07861 -0. ] [ 0.36228 0.65823 0.07259 0.00003 0.07867 -0.00008] [ 0.07309 0.07259 1.13899 0. 0.00002 -0.00001] [ 0.00002 0.00003 0. 0.12319 -0.00005 0.07962] [-0.07861 0.07867 0.00002 -0.00005 0.12319 -0. ] [-0. -0.00008 -0.00001 0.07962 -0. 0.1562 ]] 95%% Error estimate [ASE units]: [[0.01552 0.00984 0.00115 0.00012 0.00017 0.00006] [0.00984 0.01048 0.00066 0.00019 0.00021 0.00027] [0.00115 0.00066 0.00003 0.00002 0.00012 0.00014] [0.00012 0.00019 0.00002 0.00003 0.00012 0.00065] [0.00017 0.00021 0.00012 0.00012 0.00001 0.00002] [0.00006 0.00027 0.00014 0.00065 0.00002 0.00432]] Maximum deviation from material symmetry [ASE units]: 0.079619 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.138988 [ASE units] and requested fractional tolerance 0.010000. WARNING: None of the calculations successfully completed with errors within tolerance. Using the following run with the lowest errors: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.72876 0.4193 0.0813 -0.00001 -0.07765 0.00001] [ 0.4193 0.72357 0.08162 0.00001 0.07764 0.00003] [ 0.0813 0.08162 1.13927 0. 0.00004 -0. ] [-0.00001 0.00001 0. 0.12341 -0. 0.07814] [-0.07765 0.07764 0.00004 -0. 0.12317 0.00001] [ 0.00001 0.00003 -0. 0.07814 0.00001 0.15433]] 95%% Error estimate [ASE units]: [[0.0037 0.0119 0.00284 0.00001 0.00446 0.00113] [0.0119 0.0093 0.00248 0.00012 0.00433 0.00145] [0.00284 0.00248 0.00042 0. 0.00021 0.00033] [0.00001 0.00012 0. 0.00216 0. 0.0026 ] [0.00446 0.00433 0.00021 0. 0.0004 0.00008] [0.00113 0.00145 0.00033 0.0026 0.00008 0.0052 ]] Maximum deviation from material symmetry [ASE units]: 0.078137 WARNING: Maximum deviation from material symmetry according to space group 163 is too big compared to maximum elastic constant component 1.139271 [ASE units] and requested fractional tolerance 0.010000. R E S U L T S Elastic constants [GPa]: [[116.76021 67.17991 13.02514 -0.00086 -12.44157 0.00157] [ 67.17991 115.92868 13.0762 0.00086 12.43925 0.00456] [ 13.02514 13.0762 182.5313 0.00016 0.00652 -0. ] [ -0.00086 0.00086 0.00016 19.77209 -0.00002 12.5189 ] [-12.44157 12.43925 0.00652 -0.00002 19.73328 0.00122] [ 0.00157 0.00456 -0. 12.5189 0.00122 24.72642]] 95 %% Error estimate [GPa]: [[0.59359 1.90598 0.45575 0.00201 0.7144 0.18102] [1.90598 1.49066 0.39769 0.0193 0.69332 0.23156] [0.45575 0.39769 0.06651 0.0005 0.03402 0.05278] [0.00201 0.0193 0.0005 0.34529 0.00019 0.41711] [0.7144 0.69332 0.03402 0.00019 0.06389 0.01242] [0.18102 0.23156 0.05278 0.41711 0.01242 0.83276]] Maximum deviation from material symmetry [GPa] = 12.51890 Bulk modulus [GPa] = 66.79857 Unique elastic constants for space group 163 [GPa] ['c11', 'c12', 'c13', 'c14', 'c33', 'c44'] [116.76021235474475, 67.1799128421238, 13.02513674302386, -0.0008560631166309659, 182.53129661322717, 19.772092748778643] Nearest matrix of isotropic elastic constants: Distance to isotropic state [-] = 1.87979 Isotropic bulk modulus [GPa] = 66.83405 Isotropic shear modulus [GPa] = 24.63466