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_BonnyPasianotMalerba_2009_FeNi__MO_267721408934_005
==== 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      -17.796870        0.1616
BFGS:    1 17:07:56      -17.797913        0.1397
BFGS:    2 17:07:56      -17.801045        0.0028
BFGS:    3 17:07:56      -17.801046        0.0000
BFGS:    4 17:07:56      -17.801046        0.0000
BFGS:    5 17:07:57      -17.801046        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3698567152635395e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [2.42978544e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.34315469e-38 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.520000954093759, -5.5506244576377335e-34, 4.891257003411752e-35], [-4.47760198596737e-34, 3.520000954093759, -1.6930053738149088e-21], [-5.43253142170186e-35, -1.6930053738149133e-21, 3.520000954093759]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.36985672e-13 -1.36985672e-13 -1.36985672e-13  9.40888141e-32
  5.18123951e-36 -3.56499486e-54]
energy per atom =  -4.413809393233662
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0