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_ShimKoKim_2013_NiVH__MO_612225165948_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 16:07:20       -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: 5.000337637506316e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.794527551585947, 3.453263298861027e-33, -3.451855866809431e-34], [4.2382751910361434e-33, 2.794527551585947, 3.1494244152522945e-20], [1.0434374166906994e-33, 3.1494244152522433e-20, 2.794527551585947]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.00033764e-15 -5.00033764e-15 -5.00033764e-15 -1.90273834e-32
 -8.22057961e-36  7.19930373e-53]
energy per atom =  -4.2892710751090934
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0