element(s):
['H', 'Ni']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.664']
model name:
EAM_Dynamo_TehranchiCurtin_2010_NiH__MO_535504325462_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['H', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[3.664, 0, 0], [0, 3.664, 0], [0, 0, 3.664]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:40:24      -26.338679         0.399008
BFGS:    1 15:40:24      -26.345293         0.373677
BFGS:    2 15:40:24      -26.385309         0.163757
BFGS:    3 15:40:24      -26.395684         0.016108
BFGS:    4 15:40:24      -26.395795         0.000729
BFGS:    5 15:40:24      -26.395795         0.000077
BFGS:    6 15:40:24      -26.395795         0.000000
BFGS:    7 15:40:24      -26.395795         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.9279227842310033e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H', 'H', 'H', 'H', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.68914867e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.24500949e-36]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [9.22287168e-50 5.00000000e-01 3.24500949e-36]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[3.709407380849971, -1.322173776291376e-32, 1.7688326981271466e-33], [1.6573216889749456e-33, 3.709407380849971, -1.1081064440141582e-19], [8.691373343589133e-33, -1.1081064440142466e-19, 3.709407380849971]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.92792278e-11 -1.92792278e-11 -1.92792278e-11  8.15618837e-27
  2.42612689e-34 -7.50325613e-50]
energy per atom =  -3.299474384366018
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0