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_BelandTammMu_2017_FeNiCr__MO_715003088863_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 10:50:14       -4.692076         3.797170
BFGS:    1 10:50:14       -5.227597         3.590893
BFGS:    2 10:50:14       -5.706758         3.595492
BFGS:    3 10:50:14       -6.112112         3.703648
BFGS:    4 10:50:14       -6.474173         3.411103
BFGS:    5 10:50:14       -6.790906         2.376507
BFGS:    6 10:50:14       -7.058663         1.960956
BFGS:    7 10:50:14       -7.221393         1.184742
BFGS:    8 10:50:14       -7.265963         1.223086
BFGS:    9 10:50:14       -7.280777         0.954807
BFGS:   10 10:50:15       -7.304691         0.330682
BFGS:   11 10:50:15       -7.309051         0.138852
BFGS:   12 10:50:15       -7.309818         0.008569
BFGS:   13 10:50:15       -7.309820         0.000810
BFGS:   14 10:50:15       -7.309820         0.000008
BFGS:   15 10:50:15       -7.309820         0.000000
BFGS:   16 10:50:15       -7.309820         0.000000
Minimization converged after 16 steps.
Maximum force component: 3.600148372130324e-32 eV/Angstrom
Maximum stress component: 5.2082985449794244e-11 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([[2.5233409569798084, 6.190583379559965e-17, -5.881267198799492e-36], [-1.2616704784899042, 2.185277371154249, 3.4313809201527097e-35], [2.8018567154700683e-35, 5.878813091567084e-35, 4.381181035048021]])
forces =  [[ 5.18376310e-33 -8.97854107e-33  3.60014837e-32]
 [-1.55512893e-32  8.97854107e-33 -3.60014837e-32]]
stress =  [ 2.42228070e-11  2.42228070e-11  5.20829854e-11 -2.68214007e-34
 -9.29120575e-35 -1.05842122e-27]
energy per atom =  -3.6549098615545472
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0