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_2006A_AlNiCo__MO_122703700223_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 18:15:40      -13.107592        1.8949
BFGS:    1 18:15:40      -13.254680        1.7300
BFGS:    2 18:15:40      -13.492306        1.4376
BFGS:    3 18:15:40      -13.686420        1.1472
BFGS:    4 18:15:40      -13.832447        0.7866
BFGS:    5 18:15:40      -13.922318        0.4478
BFGS:    6 18:15:40      -13.972633        0.2326
BFGS:    7 18:15:40      -13.998029        0.1273
BFGS:    8 18:15:40      -14.014277        0.0585
BFGS:    9 18:15:40      -13.998027        0.3966
BFGS:   10 18:15:40      -14.014986        0.0270
BFGS:   11 18:15:40      -14.015121        0.0111
BFGS:   12 18:15:40      -14.015147        0.0008
BFGS:   13 18:15:40      -14.015147        0.0000
BFGS:   14 18:15:40      -14.015147        0.0000
BFGS:   15 18:15:40      -14.015147        0.0000
Minimization converged after 15 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.602649491836472e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'Co', 'Ni']
basis =  [[6.82680055e-49 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([[4.009068437701982, 1.260283914959872e-32, -4.5832737613994916e-33], [2.7473913725132525e-32, 4.009068437701982, -6.63743709718582e-18], [1.3034364534201664e-32, -6.637437097185833e-18, 4.009068437701982]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [4.60264949e-15 4.60264949e-15 4.60264949e-15 1.43275786e-31
 3.19537827e-34 1.38414584e-50]
energy per atom =  -3.503786672844547
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0