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_CostaAgrenClavaguera_2007_AlNi__MO_131642768288_002
==== 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 15:06:22       -8.766375         1.086111
BFGS:    1 15:06:22       -8.801461         0.884100
BFGS:    2 15:06:22       -8.855603         0.195636
BFGS:    3 15:06:22       -8.856505         0.202194
BFGS:    4 15:06:22       -8.857990         0.128781
BFGS:    5 15:06:22       -8.858557         0.036755
BFGS:    6 15:06:22       -8.858629         0.005402
BFGS:    7 15:06:22       -8.858631         0.000293
BFGS:    8 15:06:22       -8.858631         0.000022
BFGS:    9 15:06:22       -8.858631         0.000001
BFGS:   10 15:06:22       -8.858631         0.000000
Minimization converged after 10 steps.
Maximum force component: 1.1483437891663456e-32 eV/Angstrom
Maximum stress component: 5.54541119990479e-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([[2.4843924370859987, -2.3296918467794978e-17, 4.75496302085693e-37], [-1.2421962185429993, 2.151546963486407, -2.4352491829775854e-37], [1.639917823995905e-36, 4.565380616420426e-36, 4.091423462011768]])
forces =  [[ 1.14834379e-32 -2.20998865e-33  2.20378784e-69]
 [-1.14834379e-32  2.20998865e-33 -2.20378784e-69]]
stress =  [ 5.54541120e-10  5.54541120e-10  3.15369011e-10 -2.33369420e-34
 -8.42271559e-46  2.08525730e-26]
energy per atom =  -4.429315304775199
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0