element(s):
['Ni']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.7844']
model name:
MEAM_LAMMPS_KimKimJung_2017_NiAlTi__MO_478967255435_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.7844, 0, 0], [0, 2.7844, 0], [0, 0, 2.7844]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:06:11       -8.577064        0.1364
BFGS:    1 18:06:11       -8.577753        0.0993
BFGS:    2 18:06:11       -8.578542        0.0020
BFGS:    3 18:06:11       -8.578542        0.0000
BFGS:    4 18:06:11       -8.578542        0.0000
BFGS:    5 18:06:11       -8.578542        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.759689101988364e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.794527551575702, 2.8544038142048054e-34, -3.295346802528185e-35], [2.0177736053619754e-34, 2.794527551575702, 1.9723951336646804e-22], [1.032583810414223e-33, 1.9723951336655724e-22, 2.794527551575702]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.75968910e-15 -3.75968910e-15 -3.75968910e-15 -1.37709062e-30
  1.10977825e-34  3.27167708e-50]
energy per atom =  -4.289271075256798
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0