element(s):
['Al', 'Ni']
AFLOW prototype label:
AB3_tP4_123_a_ce
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:
['3.559', '0.98817083']
model name:
EAM_IMD_BrommerGaehler_2006A_AlNiCo__MO_122703700223_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Ni', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0. ]
 [0.  0.5 0.5]]
spacegroup =  123
cell =  [[3.559, 0, 0], [0, 3.559, 0], [0, 0, 3.5169]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 09:17:39      -17.759653        3.0326
BFGS:    1 09:17:39      -18.023510        2.3955
BFGS:    2 09:17:39      -18.233782        1.5763
BFGS:    3 09:17:39      -18.376735        1.0367
BFGS:    4 09:17:39      -18.475524        0.5771
BFGS:    5 09:17:39      -18.510881        0.0629
BFGS:    6 09:17:39      -18.511179        0.0124
BFGS:    7 09:17:39      -18.511190        0.0031
BFGS:    8 09:17:39      -18.511190        0.0032
BFGS:    9 09:17:39      -18.511192        0.0013
BFGS:   10 09:17:39      -18.511192        0.0003
BFGS:   11 09:17:39      -18.511192        0.0000
BFGS:   12 09:17:39      -18.511192        0.0000
BFGS:   13 09:17:39      -18.511192        0.0000
BFGS:   14 09:17:39      -18.511192        0.0000
Minimization converged after 14 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.5196231441907897e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Ni', 'Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]]
cellpar =  Cell([[3.726573057228025, -6.131434195577426e-35, -6.618243543605843e-33], [-3.772088533854797e-35, 3.7265730572280247, -7.542314234242665e-18], [3.161712521636173e-33, -7.52592333548827e-18, 3.726573057221937]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.25644804e-11 -2.25644804e-11 -2.51962314e-11  4.13172865e-28
 -2.23283973e-45  1.72770172e-61]
energy per atom =  -4.627797922671775
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is AB3_tP4_123_a_ce, while relaxed is AB3_cP4_221_a_c. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.