element(s):
['Fe', '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:
['3.7004']
model name:
MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[3.7004, 0, 0], [0, 3.7004, 0], [0, 0, 3.7004]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:29:28      -17.085882         0.856001
BFGS:    1 09:29:28      -17.115625         0.764880
BFGS:    2 09:29:28      -17.200298         0.353343
BFGS:    3 09:29:28      -17.220120         0.054378
BFGS:    4 09:29:28      -17.220559         0.003110
BFGS:    5 09:29:28      -17.220560         0.000025
BFGS:    6 09:29:28      -17.220560         0.000000
BFGS:    7 09:29:28      -17.220560         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.979807166692791e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Ni']
basis =  [[0.0000000e+00 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 1.0675514e-34 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 0.0000000e+00]
 [0.0000000e+00 0.0000000e+00 0.0000000e+00]]
cellpar =  Cell([[3.608125936083902, -4.036659802195919e-33, 5.992101101540897e-34], [-4.2885570617238186e-33, 3.608125936083902, 4.436156186609031e-18], [-2.662489420153022e-34, 4.436156186609032e-18, 3.608125936083902]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 4.97980717e-15  4.97980717e-15  4.97980717e-15  7.13325162e-32
 -1.57799577e-34 -1.59689907e-51]
energy per atom =  -4.3051401130371705
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0