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_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
==== 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 14:04:57       -8.741164         1.319665
BFGS:    1 14:04:57       -8.790254         1.026900
BFGS:    2 14:04:57       -8.856823         0.160868
BFGS:    3 14:04:57       -8.858836         0.053550
BFGS:    4 14:04:57       -8.858881         0.048320
BFGS:    5 14:04:57       -8.859120         0.006197
BFGS:    6 14:04:57       -8.859123         0.000802
BFGS:    7 14:04:57       -8.859123         0.000014
BFGS:    8 14:04:57       -8.859123         0.000000
BFGS:    9 14:04:57       -8.859123         0.000000
Minimization converged after 9 steps.
Maximum force component: 3.06071641422925e-32 eV/Angstrom
Maximum stress component: 7.2725018424098e-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([[2.483148159760706, 3.005460227272338e-17, 5.028300721845693e-37], [-1.241574079880353, 2.150469387713351, -2.9523532307294118e-36], [-1.510995637344761e-35, 3.248596127888162e-35, 4.019864608650559]])
forces =  [[ 3.06071641e-32 -2.65065817e-32  3.94894927e-68]
 [-3.06071641e-32  2.65065817e-32 -3.94894927e-68]]
stress =  [ 6.82047288e-11  6.82047288e-11  7.27250184e-11  6.77660080e-35
  1.17374169e-34 -2.89428232e-27]
energy per atom =  -4.429561463601136
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0