element(s):
['Co', 'Ni']
AFLOW prototype label:
A3B_cP4_221_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.6559']
model name:
EAM_IMD_BrommerGaehler_2006B_AlNiCo__MO_128037485276_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Ni']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[3.6559, 0, 0], [0, 3.6559, 0], [0, 0, 3.6559]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:16:01       -3.484314       14.0041
BFGS:    1 18:16:01       -4.353869       11.9688
BFGS:    2 18:16:01       -5.660740        9.5722
BFGS:    3 18:16:01       -6.694188        7.0061
BFGS:    4 18:16:01       -7.465642        4.8267
BFGS:    5 18:16:01       -8.033139        3.2817
BFGS:    6 18:16:01       -8.444545        2.1322
BFGS:    7 18:16:01       -8.729128        1.4393
BFGS:    8 18:16:01       -8.928945        1.0861
BFGS:    9 18:16:01       -9.079597        1.0528
BFGS:   10 18:16:01       -9.211696        1.2326
BFGS:   11 18:16:01       -9.334130        1.3324
BFGS:   12 18:16:01       -9.441071        1.3025
BFGS:   13 18:16:01       -9.524254        1.1141
BFGS:   14 18:16:01       -9.574437        0.7893
BFGS:   15 18:16:01       -9.584441        0.3455
BFGS:   16 18:16:01       -9.559145        0.0686
BFGS:   17 18:16:01       -9.565538        0.0042
BFGS:   18 18:16:01       -9.565191        0.0000
BFGS:   19 18:16:01       -9.565188        0.0000
BFGS:   20 18:16:01       -9.565188        0.0000
Minimization converged after 20 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.708985235238774e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'Co', 'Ni']
basis =  [[1.95654426e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.07359624e-17 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 6.07359624e-17]
 [0.00000000e+00 6.07359624e-17 6.07359624e-17]]
cellpar =  Cell([[4.371404853164463, 2.8594415197510006e-32, 2.523202623803052e-33], [7.010775801158025e-34, 4.371404853164463, -1.6033277851001688e-17], [-1.2729381192476065e-33, -1.6033277851001697e-17, 4.371404853164463]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.70898524e-15 -3.70898524e-15 -3.70898524e-15 -7.26006648e-32
 -5.37523126e-35 -6.35337644e-52]
energy per atom =  0.2896678840672542
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0