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_KoShimLee_2011_NiH__MO_091278480940_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 10:55:01       -8.766375         1.086112
BFGS:    1 10:55:01       -8.801461         0.884100
BFGS:    2 10:55:01       -8.855603         0.195636
BFGS:    3 10:55:01       -8.856505         0.202194
BFGS:    4 10:55:01       -8.857990         0.128781
BFGS:    5 10:55:01       -8.858557         0.036755
BFGS:    6 10:55:01       -8.858629         0.005401
BFGS:    7 10:55:01       -8.858631         0.000293
BFGS:    8 10:55:01       -8.858631         0.000022
BFGS:    9 10:55:02       -8.858631         0.000001
BFGS:   10 10:55:02       -8.858631         0.000000
Minimization converged after 10 steps.
Maximum force component: 5.7417189349768894e-33 eV/Angstrom
Maximum stress component: 5.550309614724851e-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([[2.4843924323892033, -1.655728122771658e-17, 7.932271316846864e-36], [-1.2421962161946016, 2.151546959418863, 3.430968204159508e-37], [-2.081473847640318e-36, 2.3026997840306833e-35, 4.091423391407808]])
forces =  [[-5.74171893e-33  5.52497162e-33 -7.26669214e-69]
 [ 5.74171893e-33 -5.52497162e-33  7.26669214e-69]]
stress =  [5.55030961e-10 5.55030961e-10 3.15565449e-10 4.08396494e-34
 6.37753178e-46 1.00664538e-25]
energy per atom =  -4.42931530453028
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0