element(s):
['H']
AFLOW prototype label:
A_tP1_123_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.1695', '0.94664774']
model name:
MEAM_LAMMPS_ShimKoKim_2013_NiVH__MO_612225165948_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['H']
representative atom coordinates =  [[0 0 0]]
spacegroup =  123
cell =  [[3.1695, 0, 0], [0, 3.1695, 0], [0, 0, 3.0004]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:31:45       -0.006046        0.0320
BFGS:    1 17:31:45       -0.006067        0.0322
BFGS:    2 17:31:45       -0.008939        0.0555
BFGS:    3 17:31:45       -0.013420        0.0947
BFGS:    4 17:31:45       -0.020481        0.1598
BFGS:    5 17:31:45       -0.031664        0.2662
BFGS:    6 17:31:45       -0.049393        0.4365
BFGS:    7 17:31:45       -0.077401        0.7023
BFGS:    8 17:31:45       -0.121246        1.1021
BFGS:    9 17:31:45       -0.188622        1.6708
BFGS:   10 17:31:45       -0.288575        2.4063
BFGS:   11 17:31:45       -0.427641        3.1850
BFGS:   12 17:31:45       -0.599261        3.5708
BFGS:   13 17:31:45       -0.758888        2.3962
BFGS:   14 17:31:45       -0.769365        3.1305
BFGS:   15 17:31:45       -0.798170        0.7730
BFGS:   16 17:31:45       -0.802733        0.2587
BFGS:   17 17:31:45       -0.807203        0.4103
BFGS:   18 17:31:45       -0.812517        0.7475
BFGS:   19 17:31:45       -0.826451        0.9715
BFGS:   20 17:31:45       -0.837225        0.6478
BFGS:   21 17:31:45       -0.843678        0.2578
BFGS:   22 17:31:45       -0.846865        0.0217
BFGS:   23 17:31:45       -0.848475        0.1094
BFGS:   24 17:31:45       -0.849406        0.1180
BFGS:   25 17:31:45       -0.849971        0.0747
BFGS:   26 17:31:45       -0.850291        0.0230
BFGS:   27 17:31:45       -0.850459        0.0119
BFGS:   28 17:31:45       -0.850550        0.0241
BFGS:   29 17:31:45       -0.850603        0.0201
BFGS:   30 17:31:45       -0.850633        0.0100
BFGS:   31 17:31:45       -0.850649        0.0009
BFGS:   32 17:31:45       -0.850660        0.0038
BFGS:   33 17:31:45       -0.850669        0.0049
BFGS:   34 17:31:45       -0.850669        0.0024
BFGS:   35 17:31:45       -0.850669        0.0000
BFGS:   36 17:31:45       -0.850669        0.0000
Minimization converged after 36 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.519472584582264e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[5.115123717472254, 7.169354562304023e-33, 4.014384653325234e-33], [2.9758365957060365e-33, 5.115123717472253, 2.6324803331349058e-17], [9.33322547647558e-33, 2.924902866400246e-17, 1.1077154974437209]])
forces =  [[0. 0. 0.]]
stress =  [1.75178881e-45 3.62468211e-44 3.51947258e-12 3.48431227e-28
 1.39067386e-45 1.37678072e-61]
energy per atom =  -0.8506691837090892
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0