element(s):
['Co']
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:
['2.5032', '1.5893656']
model name:
EAM_Dynamo_PunYamakovMishin_2013_NiAlCo__MO_826591359508_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.5032, 0, 0], [-1.2516, 2.1678347907532, 0], [0, 0, 3.9785]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:39:41       -8.765660         0.644162
BFGS:    1 15:39:41       -8.773901         0.454813
BFGS:    2 15:39:41       -8.781666         0.078578
BFGS:    3 15:39:41       -8.781800         0.043799
BFGS:    4 15:39:41       -8.781930         0.041067
BFGS:    5 15:39:41       -8.782052         0.026717
BFGS:    6 15:39:41       -8.782093         0.009316
BFGS:    7 15:39:41       -8.782098         0.002320
BFGS:    8 15:39:41       -8.782099         0.000151
BFGS:    9 15:39:41       -8.782099         0.000008
BFGS:   10 15:39:41       -8.782099         0.000000
BFGS:   11 15:39:42       -8.782099         0.000000
Minimization converged after 11 steps.
Maximum force component: 2.3283809589389787e-32 eV/Angstrom
Maximum stress component: 2.948947344950396e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.51867607053566, 3.422105350733877e-18, 4.05469099382947e-38], [-1.25933803526783, 2.1812374609878487, 3.5254389569010125e-37], [-7.01946375075824e-38, 1.3507877995301266e-35, 4.055738889694498]])
forces =  [[-7.76126986e-33  4.48097124e-33  1.66636138e-32]
 [ 2.32838096e-32 -1.34429137e-32 -1.66636138e-32]]
stress =  [-1.02723292e-10 -1.02723292e-10 -2.94894734e-10 -1.16109105e-34
 -2.01106870e-34  2.41095491e-26]
energy per atom =  -4.391049342001398
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0