element(s):
['H', 'V']
AFLOW prototype label:
A2B_cF12_225_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2363']
model name:
MEAM_LAMMPS_ShimLeeFleury_2011_VH__MO_072444764353_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['H', 'V']
representative atom coordinates =  [[0.25 0.25 0.25]
 [0.   0.   0.  ]]
spacegroup =  225
cell =  [[4.2363, 0, 0], [0, 4.2363, 0], [0, 0, 4.2363]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:27:49      -41.921305         1.652670
BFGS:    1 15:27:49      -42.035832         1.581408
BFGS:    2 15:27:49      -42.261936         1.434143
BFGS:    3 15:27:49      -42.466317         1.291732
BFGS:    4 15:27:49      -42.649692         1.154044
BFGS:    5 15:27:49      -42.812760         1.020952
BFGS:    6 15:27:49      -42.956201         0.892333
BFGS:    7 15:27:49      -43.080678         0.768066
BFGS:    8 15:27:50      -43.186833         0.648034
BFGS:    9 15:27:50      -43.275294         0.532121
BFGS:   10 15:27:50      -43.346670         0.420217
BFGS:   11 15:27:50      -43.401554         0.312211
BFGS:   12 15:27:50      -43.440522         0.207997
BFGS:   13 15:27:50      -43.464137         0.107473
BFGS:   14 15:27:50      -43.472944         0.010535
BFGS:   15 15:27:50      -43.473031         0.000212
BFGS:   16 15:27:50      -43.473031         0.000000
BFGS:   17 15:27:50      -43.473031         0.000000
Minimization converged after 17 steps.
Maximum force component: 4.758557834690478e-31 eV/Angstrom
Maximum stress component: 2.4964621499911656e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'V', 'V', 'V', 'V']
basis =  [[2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]
 [5.24147499e-17 1.04829500e-16 1.04829500e-16]
 [5.24147499e-17 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.04829500e-16 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.04829500e-16]]
cellpar =  Cell([[4.476058858010808, 3.0397855153424207e-32, -3.887448738669406e-32], [4.1494020167156487e-32, 4.476058858010808, 2.7004450538852652e-17], [-2.285396981253725e-32, 2.7004450538852668e-17, 4.476058858010808]])
forces =  [[-9.19528084e-33  6.43669659e-32  2.63214914e-31]
 [ 1.06895140e-31  4.82752244e-32  3.80454745e-31]
 [ 1.37929213e-32 -4.59764042e-33 -4.50568761e-31]
 [ 1.05745730e-31 -3.44823031e-32  5.51716850e-32]
 [-1.51722134e-31  4.36775840e-32 -3.63213593e-31]
 [-7.35622467e-32 -3.76431809e-32 -2.80456066e-31]
 [-1.51722134e-31 -5.74705052e-33  4.75855783e-31]
 [-1.50572724e-31  9.19528084e-33  2.71260785e-31]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-2.49646215e-12 -2.49646215e-12 -2.49646215e-12 -1.86458700e-28
 -1.28347099e-59 -2.19802100e-60]
energy per atom =  -3.6227526003173924
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0