element(s):
['Si']
AFLOW prototype label:
A_tI8_139_h
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.6881', '0.57703982', '0.8213634']
model name:
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.8213634 0.8213634 0.       ]]
spacegroup =  139
cell =  [[6.6881, 0, 0], [0, 6.6881, 0], [0, 0, 3.8593]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:20:07      -35.868025        0.5195
BFGS:    1 17:20:07      -35.882655        0.5312
BFGS:    2 17:20:07      -35.923965        0.5031
BFGS:    3 17:20:07      -35.941775        0.4182
BFGS:    4 17:20:07      -35.969054        0.3542
BFGS:    5 17:20:07      -35.983595        0.3799
BFGS:    6 17:20:07      -35.986222        0.3386
BFGS:    7 17:20:07      -35.991222        0.2358
BFGS:    8 17:20:07      -35.996700        0.1724
BFGS:    9 17:20:07      -36.003759        0.1521
BFGS:   10 17:20:07      -36.006862        0.0681
BFGS:   11 17:20:07      -36.007425        0.0148
BFGS:   12 17:20:07      -36.007460        0.0020
BFGS:   13 17:20:07      -36.007461        0.0001
BFGS:   14 17:20:07      -36.007461        0.0000
BFGS:   15 17:20:07      -36.007461        0.0000
BFGS:   16 17:20:07      -36.007461        0.0000
Minimization converged after 16 steps.
Maximum force component: 5.41287022098018e-10 eV/Angstrom
Maximum stress component: 1.0583518060729162e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[8.18015868e-01 8.18015868e-01 1.96258664e-34]
 [1.81984132e-01 1.81984132e-01 0.00000000e+00]
 [1.81984132e-01 8.18015868e-01 0.00000000e+00]
 [8.18015868e-01 1.81984132e-01 4.90646661e-35]
 [3.18015868e-01 3.18015868e-01 5.00000000e-01]
 [6.81984132e-01 6.81984132e-01 5.00000000e-01]
 [6.81984132e-01 3.18015868e-01 5.00000000e-01]
 [3.18015868e-01 6.81984132e-01 5.00000000e-01]]
cellpar =  Cell([[6.507741439894008, 2.619477385310984e-36, -5.945281086168789e-36], [-1.0962280107849951e-36, 6.507741439894008, 6.035980321040144e-18], [-1.1365092755176555e-32, 3.3492187845167633e-18, 3.925289009719515]])
forces =  [[ 5.41287022e-10  5.41287022e-10  5.02047978e-28]
 [-5.41287022e-10 -5.41287022e-10 -5.02047978e-28]
 [-5.41287022e-10  5.41287022e-10  5.02048450e-28]
 [ 5.41287022e-10 -5.41287022e-10 -5.02048072e-28]
 [ 5.41287022e-10  5.41287022e-10  5.02047978e-28]
 [-5.41287022e-10 -5.41287022e-10 -5.02047883e-28]
 [-5.41287022e-10  5.41287022e-10  5.02048450e-28]
 [ 5.41287022e-10 -5.41287022e-10 -5.02048167e-28]]
stress =  [ 1.05835181e-10  1.05835181e-10 -1.31426128e-11  1.26301681e-26
 -9.04731689e-35  6.05858745e-51]
energy per atom =  -4.50093261594026
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0