element(s):
['Ni']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5048']
model name:
EAM_Dynamo_AngeloMoodyBaskes_1995_NiAlH__MO_418978237058_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.5048, 0, 0], [0, 3.5048, 0], [0, 0, 3.5048]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:07:56      -17.795817        0.1619
BFGS:    1 17:07:56      -17.796864        0.1399
BFGS:    2 17:07:56      -17.799999        0.0028
BFGS:    3 17:07:56      -17.800000        0.0001
BFGS:    4 17:07:56      -17.800000        0.0000
BFGS:    5 17:07:56      -17.800000        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.10580457908864e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.85957172e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.5200003501103985, 3.039315043195753e-33, -2.7229236326526834e-34], [1.641602635216006e-33, 3.5200003501103985, 2.8152073332652036e-18], [-9.272368679199677e-34, 2.815207333265203e-18, 3.5200003501103985]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-7.10580458e-15 -7.10580458e-15 -7.10580458e-15  1.50555759e-31
  9.22664281e-64 -2.08362180e-64]
energy per atom =  -4.450000012593794
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0