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_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_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 12:45:18      -17.187469         1.358182
BFGS:    1 12:45:19      -17.247662         1.224121
BFGS:    2 12:45:19      -17.367097         0.844666
BFGS:    3 12:45:20      -17.431612         0.414556
BFGS:    4 12:45:20      -17.442558         0.117310
BFGS:    5 12:45:21      -17.443117         0.126595
BFGS:    6 12:45:21      -17.444870         0.170611
BFGS:    7 12:45:22      -17.448190         0.199580
BFGS:    8 12:45:22      -17.452223         0.160802
BFGS:    9 12:45:23      -17.454308         0.067439
BFGS:   10 12:45:23      -17.454850         0.016055
BFGS:   11 12:45:24      -17.454888         0.000472
BFGS:   12 12:45:24      -17.454888         0.000033
BFGS:   13 12:45:25      -17.454888         0.000000
BFGS:   14 12:45:25      -17.454888         0.000000
Minimization converged after 14 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.2764959737849395e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Fe', 'Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]]
cellpar =  Cell([[4.050371844866573, -1.8364361110898944e-35, -1.6792415238129336e-32], [1.4721651034047107e-35, 4.050371844866573, -1.0414441259722773e-17], [2.5700551015248553e-32, -7.654957349570205e-18, 2.8376732595455825]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.27649597e-10 -1.27649597e-10 -7.02789724e-11 -1.44490682e-26
  8.43689746e-43  2.81023812e-59]
energy per atom =  -4.363721980096736
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0