element(s): ['V'] AFLOW prototype label: A_cI2_229_a Parameter names: ['a'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['3.0482'] model name: MEAM_LAMMPS_ShimLeeFleury_2011_VH__MO_072444764353_002 ==== Building ASE atoms object with: ==== representative atom symbols = ['V'] representative atom coordinates = [[0 0 0]] spacegroup = 229 cell = [[3.0482, 0, 0], [0, 3.0482, 0], [0, 0, 3.0482]] ========================================= Step Time Energy fmax BFGS: 0 17:16:03 -10.596156 0.226170 BFGS: 1 17:16:03 -10.598040 0.162346 BFGS: 2 17:16:03 -10.599998 0.004607 BFGS: 3 17:16:03 -10.600000 0.000090 BFGS: 4 17:16:03 -10.600000 0.000000 BFGS: 5 17:16:03 -10.600000 0.000000 Minimization converged after 5 steps. Maximum force component: 0.0 eV/Angstrom Maximum stress component: 3.6921880305094856e-14 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['V', 'V'] basis = [[0. 0. 0. ] [0.5 0.5 0.5]] cellpar = Cell([[3.0310889118759508, -6.4820662561505056e-37, 3.77096439099694e-34], [4.665903907419261e-34, 3.0310889118759508, 1.4710106006964888e-21], [1.3820364848539123e-34, 1.4710106006963523e-21, 3.0310889118759508]]) forces = [[0. 0. 0.] [0. 0. 0.]] stress = [-3.69218803e-14 -3.69218803e-14 -3.69218803e-14 -3.72726132e-30 2.22653332e-63 1.00969131e-63] energy per atom = -5.300000002940995 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0