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 10:27:14       -3.484314        14.004147
BFGS:    1 10:27:17       -4.353869        11.968758
BFGS:    2 10:27:17       -5.660740         9.572158
BFGS:    3 10:27:18       -6.694188         7.006063
BFGS:    4 10:27:18       -7.465642         4.826693
BFGS:    5 10:27:18       -8.033139         3.281699
BFGS:    6 10:27:18       -8.444545         2.132151
BFGS:    7 10:27:18       -8.729128         1.439325
BFGS:    8 10:27:18       -8.928945         1.086127
BFGS:    9 10:27:18       -9.079597         1.052761
BFGS:   10 10:27:18       -9.211696         1.232577
BFGS:   11 10:27:18       -9.334130         1.332426
BFGS:   12 10:27:18       -9.441071         1.302511
BFGS:   13 10:27:18       -9.524254         1.114092
BFGS:   14 10:27:18       -9.574437         0.789307
BFGS:   15 10:27:18       -9.584441         0.345476
BFGS:   16 10:27:18       -9.559145         0.068609
BFGS:   17 10:27:18       -9.565538         0.004229
BFGS:   18 10:27:18       -9.565191         0.000043
BFGS:   19 10:27:18       -9.565188         0.000000
BFGS:   20 10:27:19       -9.565188         0.000000
Minimization converged after 20 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.0338187877347223e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'Co', 'Ni']
basis =  [[1.25218833e-48 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([[4.371404853164464, -9.619281814812856e-33, 1.5067354655122432e-32], [2.771477167829701e-32, 4.371404853164464, 7.337715606146569e-18], [-4.5258777914703603e-32, 7.337715606146592e-18, 4.371404853164464]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.03381879e-15 -3.03381879e-15 -3.03381879e-15  5.06174607e-32
  2.62042524e-34 -5.69894409e-51]
energy per atom =  0.28966788406725374
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0