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_MendelevKramerHao_2012_NiZr__MO_149104665840_005
==== 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 15:06:18       -8.652670         0.713439
BFGS:    1 15:06:18       -8.665649         0.566684
BFGS:    2 15:06:18       -8.698833         0.295702
BFGS:    3 15:06:18       -8.701228         0.296304
BFGS:    4 15:06:18       -8.706594         0.043127
BFGS:    5 15:06:18       -8.706723         0.015095
BFGS:    6 15:06:18       -8.706727         0.014655
BFGS:    7 15:06:18       -8.706736         0.010712
BFGS:    8 15:06:18       -8.706742         0.004784
BFGS:    9 15:06:18       -8.706745         0.001833
BFGS:   10 15:06:18       -8.706745         0.000243
BFGS:   11 15:06:18       -8.706745         0.000022
BFGS:   12 15:06:18       -8.706745         0.000001
BFGS:   13 15:06:18       -8.706745         0.000000
BFGS:   14 15:06:18       -8.706745         0.000000
Minimization converged after 14 steps.
Maximum force component: 9.575286006886305e-34 eV/Angstrom
Maximum stress component: 1.9876720944423703e-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([[2.4858863726564127, 4.225951906150511e-17, 8.986121893004325e-37], [-1.2429431863282063, 2.1528407496420034, 3.984296680733674e-37], [-1.3065779707158122e-35, -3.733188017958334e-35, 4.120416112784991]])
forces =  [[ 9.57528601e-34 -5.52829395e-34  1.28442199e-70]
 [-9.57528601e-34  5.52829395e-34 -1.28442199e-70]]
stress =  [ 1.98767209e-11  1.98767209e-11 -7.37050126e-12  3.47382140e-34
 -2.00561172e-34 -2.07702267e-27]
energy per atom =  -4.353372390140228
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0