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_StollerTammBeland_2016_Ni__MO_103383163946_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 10:53:14       -8.767204         1.047315
BFGS:    1 10:53:14       -8.798036         0.871082
BFGS:    2 10:53:14       -8.852964         0.156701
BFGS:    3 10:53:14       -8.854393         0.149363
BFGS:    4 10:53:14       -8.854704         0.128943
BFGS:    5 10:53:14       -8.855736         0.002271
BFGS:    6 10:53:14       -8.855737         0.000033
BFGS:    7 10:53:14       -8.855737         0.000001
BFGS:    8 10:53:14       -8.855737         0.000000
BFGS:    9 10:53:14       -8.855737         0.000000
Minimization converged after 9 steps.
Maximum force component: 5.298626724831827e-32 eV/Angstrom
Maximum stress component: 1.1429101231547146e-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([[2.481888339539852, 1.3735757229784587e-17, 3.2891067082170943e-38], [-1.240944169769926, 2.149378351397889, 3.5832842097291865e-38], [2.5726442833426438e-37, 3.648314312240691e-36, 4.104808540030397]])
forces =  [[-5.09860594e-32 -1.76620891e-32 -3.37304477e-32]
 [ 1.01972119e-32  5.29862672e-32  3.37304477e-32]]
stress =  [ 7.06979888e-11  7.06979888e-11  1.14291012e-10  2.47395828e-34
  2.52060085e-35 -8.72807445e-27]
energy per atom =  -4.400636951278072
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0