element(s):
['H']
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:
['4.2058']
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 =  229
cell =  [[4.2058, 0, 0], [0, 4.2058, 0], [0, 0, 4.2058]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:56:51       -0.002283        0.0048
BFGS:    1 17:56:51       -0.002284        0.0048
BFGS:    2 17:56:51       -0.003118        0.0064
BFGS:    3 17:56:51       -0.004244        0.0087
BFGS:    4 17:56:51       -0.005757        0.0116
BFGS:    5 17:56:51       -0.007784        0.0156
BFGS:    6 17:56:51       -0.010483        0.0206
BFGS:    7 17:56:51       -0.014053        0.0272
BFGS:    8 17:56:51       -0.018741        0.0356
BFGS:    9 17:56:51       -0.024844        0.0461
BFGS:   10 17:56:51       -0.032702        0.0591
BFGS:   11 17:56:51       -0.042684        0.0744
BFGS:   12 17:56:51       -0.055146        0.0920
BFGS:   13 17:56:51       -0.070350        0.1107
BFGS:   14 17:56:51       -0.088314        0.1283
BFGS:   15 17:56:51       -0.108550        0.1400
BFGS:   16 17:56:51       -0.129613        0.1375
BFGS:   17 17:56:51       -0.148371        0.1061
BFGS:   18 17:56:51       -0.158794        0.0211
BFGS:   19 17:56:51       -0.158972        0.0126
BFGS:   20 17:56:51       -0.159054        0.0007
BFGS:   21 17:56:51       -0.159054        0.0000
BFGS:   22 17:56:51       -0.159054        0.0000
BFGS:   23 17:56:51       -0.159054        0.0000
Minimization converged after 23 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.0274125941332213e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H', 'H']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.40127619240443, -8.105135143129047e-33, -3.707611421105211e-33], [-1.0250521563241472e-32, 2.4012761924044304, 2.4180948027344993e-17], [2.692662993813861e-33, 2.418094802734499e-17, 2.4012761924044304]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.02741259e-13  2.02741259e-13  2.02741259e-13 -1.13821821e-30
 -2.83214319e-62  4.44674667e-62]
energy per atom =  -0.07952718424203814
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0