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:
MEAM_LAMMPS_ShimParkCho_2003_NiW__MO_500937681860_001
==== 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 11:03:16       -8.766375         1.086112
BFGS:    1 11:03:16       -8.801461         0.884100
BFGS:    2 11:03:16       -8.855603         0.195637
BFGS:    3 11:03:16       -8.856505         0.202194
BFGS:    4 11:03:16       -8.857990         0.128781
BFGS:    5 11:03:16       -8.858557         0.036755
BFGS:    6 11:03:16       -8.858629         0.005401
BFGS:    7 11:03:16       -8.858631         0.000293
BFGS:    8 11:03:16       -8.858631         0.000022
BFGS:    9 11:03:17       -8.858631         0.000001
BFGS:   10 11:03:17       -8.858631         0.000000
Minimization converged after 10 steps.
Maximum force component: 1.6810228935282977e-32 eV/Angstrom
Maximum stress component: 5.552038065267508e-10 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([[2.484392426646955, -8.58603046783781e-18, 8.176631054815265e-38], [-1.2421962133234774, 2.151546954445929, -1.806139073328531e-36], [-4.67140295702918e-36, -7.895451305620839e-36, 4.0914233855588]])
forces =  [[ 1.14834378e-32 -1.10499432e-32  1.68102289e-32]
 [-1.14834378e-32  1.10499432e-32 -1.68102289e-32]]
stress =  [5.55203807e-10 5.55203807e-10 3.15714310e-10 4.68331126e-45
 1.78498499e-45 1.97133985e-25]
energy per atom =  -4.429315304529015
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0