element(s):
['Cr', 'Fe']
AFLOW prototype label:
AB3_cP4_221_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.8057']
model name:
EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Fe']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.5 0.5]]
spacegroup =  221
cell =  [[3.8057, 0, 0], [0, 3.8057, 0], [0, 0, 3.8057]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:43:54      -15.710032         1.408400
BFGS:    1 16:43:54      -15.785996         1.112561
BFGS:    2 16:43:54      -15.906222         0.532869
BFGS:    3 16:43:54      -15.955363         0.204085
BFGS:    4 16:43:55      -15.965656         0.037450
BFGS:    5 16:43:55      -15.966026         0.001092
BFGS:    6 16:43:55      -15.966026         0.000008
BFGS:    7 16:43:55      -15.966026         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.5932035021734849e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.73708229e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 4.20758060e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 4.20758060e-34]]
cellpar =  Cell([[3.6618287356504386, -5.2815442650899956e-33, -9.678909185978664e-33], [-1.324309506029725e-32, 3.6618287356504386, 2.6116410933985858e-17], [-2.2602549963185054e-32, 2.6116410933985873e-17, 3.6618287356504386]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.59320350e-10  1.59320350e-10  1.59320350e-10 -2.57910802e-27
 -1.53205075e-34  2.87103404e-51]
energy per atom =  -3.991506462319786
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0