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 16:07:20       -8.577064         0.136423
BFGS:    1 16:07:20       -8.577753         0.099306
BFGS:    2 16:07:20       -8.578542         0.002044
BFGS:    3 16:07:21       -8.578542         0.000032
BFGS:    4 16:07:21       -8.578542         0.000000
BFGS:    5 16:07:21       -8.578542         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.359535608078055e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.7945275515757015, -1.4604816904969759e-33, -1.9338196895663237e-33], [1.4882460494246626e-33, 2.7945275515757015, 1.3953098510094137e-22], [5.391935792656251e-33, 1.3953098509496583e-22, 2.7945275515757015]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.35953561e-15 -4.35953561e-15 -4.35953561e-15  2.90221751e-30
  5.75440573e-35 -1.27276116e-50]
energy per atom =  -4.289271075256799
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0