element(s):
['Cr']
AFLOW prototype label:
A_hP2_194_c
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:
['3.0849', '1.6535058']
model name:
EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.0849, 0, 0], [-1.54245, 2.6716017681346, 0], [0, 0, 5.1009]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:54:22       -5.506972         4.007472
BFGS:    1 14:54:22       -6.058637         3.590928
BFGS:    2 14:54:22       -6.557155         3.247896
BFGS:    3 14:54:22       -6.999160         2.799029
BFGS:    4 14:54:22       -7.395672         2.627508
BFGS:    5 14:54:23       -7.753515         2.371922
BFGS:    6 14:54:23       -8.075041         1.966484
BFGS:    7 14:54:23       -8.297236         1.108786
BFGS:    8 14:54:23       -8.384434         0.356266
BFGS:    9 14:54:23       -8.386680         0.292128
BFGS:   10 14:54:23       -8.392163         0.232018
BFGS:   11 14:54:23       -8.394108         0.140382
BFGS:   12 14:54:23       -8.395171         0.024203
BFGS:   13 14:54:23       -8.395195         0.010129
BFGS:   14 14:54:23       -8.395198         0.000210
BFGS:   15 14:54:23       -8.395198         0.000001
BFGS:   16 14:54:23       -8.395198         0.000000
BFGS:   17 14:54:23       -8.395198         0.000000
Minimization converged after 17 steps.
Maximum force component: 1.7761921479173134e-32 eV/Angstrom
Maximum stress component: 1.5802397464962327e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.4959168533455083, 2.738754050680912e-17, 1.1859307896838008e-35], [-1.2479584266727541, 2.1615274007309284, 2.3264544212110638e-35], [2.0676433460543017e-35, -3.4354394122567124e-35, 3.9720112345493996]])
forces =  [[ 1.02548501e-32  1.77619215e-32  2.88623268e-67]
 [-1.02548501e-32 -1.77619215e-32 -2.88623268e-67]]
stress =  [-1.06334667e-13 -1.06334667e-13 -1.58023975e-13  2.39275370e-34
 -4.14437097e-34  3.69266827e-29]
energy per atom =  -4.19759906102453
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0