element(s):
['Ni']
AFLOW prototype label:
A_hP2_194_c
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:
['2.582', '1.5943455']
model name:
EAM_CubicNaturalSpline_AngeloMoodyBaskes_1995_Ni__MO_800536961967_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.582, 0, 0], [-1.291, 2.2360775925714, 0], [0, 0, 4.1166]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:04:56       -8.794051         0.948085
BFGS:    1 14:04:56       -8.818138         0.803786
BFGS:    2 14:04:56       -8.866611         0.334200
BFGS:    3 14:04:56       -8.869520         0.346398
BFGS:    4 14:04:56       -8.871919         0.264902
BFGS:    5 14:04:56       -8.874681         0.052089
BFGS:    6 14:04:56       -8.874869         0.009695
BFGS:    7 14:04:56       -8.874875         0.000422
BFGS:    8 14:04:56       -8.874875         0.000045
BFGS:    9 14:04:56       -8.874875         0.000001
BFGS:   10 14:04:56       -8.874875         0.000000
BFGS:   11 14:04:56       -8.874875         0.000000
Minimization converged after 11 steps.
Maximum force component: 2.037707808541509e-32 eV/Angstrom
Maximum stress component: 2.5222044044920488e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.4797774655238984, 2.3441239314987318e-17, -1.9948048460049336e-36], [-1.2398887327619492, 2.1475502808758855, 1.4048795548396192e-36], [-1.535448958048848e-36, -1.556026426731089e-35, 4.178883239945327]])
forces =  [[-2.03770781e-32  1.76470673e-32  1.97402743e-68]
 [ 2.03770781e-32 -1.76470673e-32 -1.97402743e-68]]
stress =  [2.52220440e-11 2.52220440e-11 1.41960415e-11 4.00593299e-34
 9.91211353e-35 3.36316175e-27]
energy per atom =  -4.437437505681318
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0