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:
Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Ni__SM_078420412697_001
==== 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 17:11:32      -17.794819        0.1839
BFGS:    1 17:11:32      -17.796165        0.1578
BFGS:    2 17:11:32      -17.799998        0.0036
BFGS:    3 17:11:32      -17.800000        0.0001
BFGS:    4 17:11:32      -17.800000        0.0000
BFGS:    5 17:11:32      -17.800000        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.185163177091894e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.521391762232311, -5.7565098464671676e-37, 9.075885269424742e-36], [1.1349975732398802e-36, 3.521391762232311, 1.187355942531005e-28], [1.524915827393978e-36, 1.187356005191018e-28, 3.521391762232311]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.18516318e-14 -3.18516318e-14 -3.18516318e-14 -2.23734950e-32
 -1.32017263e-34 -1.60632208e-50]
energy per atom =  -4.450000000024904
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0