element(s):
['Cr', 'Ni']
AFLOW prototype label:
A3B_cP4_221_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5867']
model name:
MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Ni']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[3.5867, 0, 0], [0, 3.5867, 0], [0, 0, 3.5867]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:29:21      -16.455584         0.239734
BFGS:    1 09:29:21      -16.457852         0.202002
BFGS:    2 09:29:21      -16.463534         0.006329
BFGS:    3 09:29:21      -16.463539         0.000175
BFGS:    4 09:29:21      -16.463539         0.000000
BFGS:    5 09:29:21      -16.463539         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.3894843503683364e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Ni']
basis =  [[1.89707145e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.19077717e-17 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 6.19077717e-17]
 [2.10617241e-65 6.19077717e-17 6.19077717e-17]]
cellpar =  Cell([[3.6067580114858484, -6.835916593305489e-33, -9.058132325114735e-33], [-6.837533268114008e-33, 3.6067580114858484, 1.0181276419575822e-19], [-6.283994492991268e-33, 1.0181276419574908e-19, 3.6067580114858484]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.38948435e-13 -3.38948435e-13 -3.38948435e-13  5.20931205e-29
 -1.38179384e-34  2.75098929e-50]
energy per atom =  -4.115884832593879
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0