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_AngeloMoodyBaskes_1995_NiAlH__MO_418978237058_005
==== 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 14:31:11      -27.501545        0.6065
BFGS:    1 14:31:12      -27.516822        0.5690
BFGS:    2 14:31:12      -27.586698        0.3665
BFGS:    3 14:31:12      -27.627877        0.1862
BFGS:    4 14:31:12      -27.643567        0.0262
BFGS:    5 14:31:12      -27.643908        0.0017
BFGS:    6 14:31:12      -27.643910        0.0000
BFGS:    7 14:31:12      -27.643910        0.0000
BFGS:    8 14:31:12      -27.643910        0.0000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.2017028669755228e-14 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]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.28715259e-35 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 1.28715259e-35]
 [1.14322115e-50 1.28715259e-35 5.00000000e-01]]
cellpar =  Cell([[3.7406791485183932, -5.835335393657562e-33, 8.409487611559242e-33], [-3.542390096853961e-32, 3.7406791485183932, 8.160305450954793e-19], [-4.059498431072969e-34, 8.160305450954793e-19, 3.7406791485183932]])
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 =  [-1.20170287e-14 -1.20170287e-14 -1.20170287e-14 -8.32265367e-31
 -5.68905325e-34 -2.87248873e-50]
energy per atom =  -3.455488694148108
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0