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 17:07:56      -17.795238        0.1500
BFGS:    1 17:07:56      -17.796140        0.1307
BFGS:    2 17:07:56      -17.798969        0.0011
BFGS:    3 17:07:56      -17.798969        0.0000
BFGS:    4 17:07:56      -17.798969        0.0000
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]
 [1.94421857e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 8.55076369e-37 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.5192944731411524, -5.836955426665946e-33, 9.199375639204635e-34], [-1.079836715607894e-32, 3.5192944731411524, -4.906835397800903e-20], [1.032575827608375e-32, -4.906835397802595e-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  2.65580519e-28
  6.63464952e-34  3.05057709e-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