element(s):
['Ni']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5048']
model name:
EAM_Dynamo_BonnyTerentyevPasianot_2011_FeNiCr__MO_677715648236_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.5048, 0, 0], [0, 3.5048, 0], [0, 0, 3.5048]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:31:10      -17.795238         0.149995
BFGS:    1 16:31:10      -17.796140         0.130708
BFGS:    2 16:31:10      -17.798969         0.001115
BFGS:    3 16:31:10      -17.798969         0.000006
BFGS:    4 16:31:10      -17.798969         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.562565574068649e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.86054642e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 8.55076369e-37 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 8.55076369e-37]]
cellpar =  Cell([[3.5192944731411524, 4.670224655691469e-33, 8.506526379835169e-33], [2.4085744701102125e-33, 3.5192944731411524, -4.90683539780172e-20], [9.156967615626544e-33, -4.906835397802639e-20, 3.5192944731411524]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.56256557e-11 -1.56256557e-11 -1.56256557e-11 -5.31208414e-28
  3.73199035e-34  6.66818200e-50]
energy per atom =  -4.449742209639581
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0