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_MendelevKramerHao_2012_NiZr__MO_149104665840_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 17:09:23      -17.538853        0.1399
BFGS:    1 17:09:23      -17.539636        0.1214
BFGS:    2 17:09:23      -17.542035        0.0009
BFGS:    3 17:09:23      -17.542035        0.0000
BFGS:    4 17:09:23      -17.542035        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.9633579052952526e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['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 5.34600968e-38 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.06920194e-37]]
cellpar =  Cell([[3.5181211293633745, 1.1720371267952418e-33, 4.929897858451538e-33], [1.4597108021539631e-33, 3.5181211293633745, -3.2156524825398786e-21], [-3.1836149021806306e-33, -3.2156524825349137e-21, 3.5181211293633745]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.96335791e-11 -2.96335791e-11 -2.96335791e-11  9.68345493e-28
  3.56590983e-35  2.62215577e-51]
energy per atom =  -4.38550876955374
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0