element(s):
['Cr']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.8741']
model name:
EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.8741, 0, 0], [0, 2.8741, 0], [0, 0, 2.8741]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:47:08       -8.094396        0.0652
BFGS:    1 17:47:08       -8.094549        0.0440
BFGS:    2 17:47:08       -8.094674        0.0009
BFGS:    3 17:47:08       -8.094674        0.0000
BFGS:    4 17:47:08       -8.094674        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1886038202093164e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8781544689715135, 1.7131142147750043e-32, 4.246415302243691e-33], [2.85471199831205e-33, 2.8781544689715135, -4.0827393130113356e-22], [1.589822403693374e-32, -4.0827393131326936e-22, 2.8781544689715135]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.18860382e-10 -1.18860382e-10 -1.18860382e-10 -1.58817836e-26
 -2.32494289e-34 -4.46898127e-50]
energy per atom =  -4.047336889726885
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0