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_VailheFarkas_1997_CoAl__MO_284963179498_005
==== 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 15:39:38       -8.764727         0.625132
BFGS:    1 15:39:38       -8.770981         0.478416
BFGS:    2 15:39:38       -8.778742         0.095913
BFGS:    3 15:39:38       -8.779096         0.085208
BFGS:    4 15:39:38       -8.779666         0.059406
BFGS:    5 15:39:38       -8.779845         0.018402
BFGS:    6 15:39:38       -8.779862         0.006702
BFGS:    7 15:39:38       -8.779865         0.000409
BFGS:    8 15:39:38       -8.779865         0.000019
BFGS:    9 15:39:38       -8.779865         0.000000
BFGS:   10 15:39:38       -8.779865         0.000000
BFGS:   11 15:39:38       -8.779865         0.000000
Minimization converged after 11 steps.
Maximum force component: 1.3385215112439419e-32 eV/Angstrom
Maximum stress component: 1.3707810759394813e-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([[2.5078656063171065, -3.5064542670441574e-18, 1.977409887746228e-36], [-1.2539328031585533, 2.171875324347878, 1.985354084566598e-36], [1.6122144974645282e-36, 1.1929069969253316e-36, 4.070679137888554]])
forces =  [[ 7.72795755e-33 -1.33852151e-32  8.36249904e-33]
 [-7.72795755e-33  1.33852151e-32 -8.36249904e-33]]
stress =  [ 1.01723225e-10  1.01723225e-10 -1.37078108e-10 -4.64726505e-34
 -8.04929918e-34  2.68164980e-26]
energy per atom =  -4.389932325697666
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0