element(s):
['Co']
AFLOW prototype label:
A_oC4_63_c
Parameter names:
['a', 'b/a', 'c/a', 'y1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4688', '2.0780541', '1.6128483', '0.3625698']
model name:
EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co']
representative atom coordinates =  [[0.        0.3625698 0.25     ]]
spacegroup =  63
cell =  [[2.4688, 0, 0], [0, 5.1303, 0], [0, 0, 3.9818]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:34:45      -16.969733        1.4905
BFGS:    1 16:34:45      -17.016608        1.3444
BFGS:    2 16:34:45      -17.102147        1.0657
BFGS:    3 16:34:45      -17.162143        0.9020
BFGS:    4 16:34:45      -17.207731        0.8385
BFGS:    5 16:34:45      -17.248327        0.8304
BFGS:    6 16:34:45      -17.287426        0.8154
BFGS:    7 16:34:45      -17.324405        0.9566
BFGS:    8 16:34:45      -17.358479        1.1679
BFGS:    9 16:34:45      -17.390337        1.3245
BFGS:   10 16:34:45      -17.423058        1.3941
BFGS:   11 16:34:45      -17.460159        1.3565
BFGS:   12 16:34:45      -17.504858        1.1926
BFGS:   13 16:34:45      -17.562927        0.8506
BFGS:   14 16:34:45      -17.610751        0.4425
BFGS:   15 16:34:45      -17.629295        0.0956
BFGS:   16 16:34:45      -17.629945        0.0730
BFGS:   17 16:34:45      -17.630474        0.0664
BFGS:   18 16:34:45      -17.631234        0.0641
BFGS:   19 16:34:45      -17.632629        0.1024
BFGS:   20 16:34:45      -17.633884        0.0888
BFGS:   21 16:34:45      -17.634481        0.0368
BFGS:   22 16:34:45      -17.634581        0.0046
BFGS:   23 16:34:45      -17.634583        0.0005
BFGS:   24 16:34:45      -17.634583        0.0005
BFGS:   25 16:34:45      -17.634583        0.0004
BFGS:   26 16:34:45      -17.634583        0.0003
BFGS:   27 16:34:45      -17.634583        0.0002
BFGS:   28 16:34:45      -17.634583        0.0000
BFGS:   29 16:34:45      -17.634583        0.0000
BFGS:   30 16:34:45      -17.634583        0.0000
BFGS:   31 16:34:45      -17.634583        0.0000
BFGS:   32 16:34:45      -17.634583        0.0000
Minimization converged after 32 steps.
Maximum force component: 5.887055497792153e-10 eV/Angstrom
Maximum stress component: 9.702446661436248e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'Co', 'Co']
basis =  [[4.96058616e-35 3.33333333e-01 2.50000000e-01]
 [0.00000000e+00 6.66666667e-01 7.50000000e-01]
 [5.00000000e-01 8.33333333e-01 2.50000000e-01]
 [5.00000000e-01 1.66666667e-01 7.50000000e-01]]
cellpar =  Cell([[2.501514328331869, -3.3143388612603785e-36, 0.0], [2.8011390842550394e-36, 4.3327499118916855, 0.0], [0.0, 0.0, 4.19010064816373]])
forces =  [[ 1.15625792e-32  5.88705550e-10 -1.29117445e-32]
 [-3.85419308e-33 -5.88705550e-10  1.29117445e-32]
 [ 1.15625792e-32  5.88705550e-10  1.29117445e-32]
 [-3.85419308e-33 -5.88705550e-10 -1.29117445e-32]]
stress =  [ 2.46937835e-11 -3.17782779e-11 -9.70244666e-11  0.00000000e+00
  0.00000000e+00 -7.75989517e-47]
energy per atom =  -4.408645715316952
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_oC4_63_c, while relaxed is A_hP2_194_c. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.