element(s):
['Co', 'Fe']
AFLOW prototype label:
AB3_tP4_123_a_ce
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.1168', '0.73625146']
model name:
MEAM_LAMMPS_ChoiKimSeol_2017_CoFe__MO_179158257180_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Fe', 'Fe']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0. ]
 [0.  0.5 0.5]]
spacegroup =  123
cell =  [[4.1168, 0, 0], [0, 4.1168, 0], [0, 0, 3.031]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:46:45      -17.246973         1.347389
BFGS:    1 11:46:45      -17.310100         1.208853
BFGS:    2 11:46:45      -17.436434         0.810485
BFGS:    3 11:46:45      -17.503353         0.353444
BFGS:    4 11:46:45      -17.501855         0.765032
BFGS:    5 11:46:45      -17.510531         0.228814
BFGS:    6 11:46:45      -17.512324         0.177478
BFGS:    7 11:46:45      -17.513494         0.238472
BFGS:    8 11:46:45      -17.514840         0.178050
BFGS:    9 11:46:45      -17.516133         0.078380
BFGS:   10 11:46:45      -17.516370         0.073557
BFGS:   11 11:46:45      -17.517876         0.004909
BFGS:   12 11:46:45      -17.517879         0.000244
BFGS:   13 11:46:45      -17.517879         0.000006
BFGS:   14 11:46:45      -17.517879         0.000000
Minimization converged after 14 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.687562095631093e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 8.39451513e-36]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.19623204e-35 5.00000000e-01]]
cellpar =  Cell([[4.024992379940891, -1.105645885639727e-33, 4.535666483379113e-33], [-7.422251265722793e-34, 4.024992379940891, 3.4288769363740926e-19], [8.261573322814206e-34, 2.6643551301778467e-19, 2.867839766208159]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-9.25964889e-12 -9.25964889e-12  4.68756210e-10  2.25336645e-26
  7.12217642e-44  3.76326544e-60]
energy per atom =  -4.379469680029875
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0