element(s):
['Si']
AFLOW prototype label:
A_hP1_191_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:
['2.6513', '0.93471127']
model name:
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.6513, 0, 0], [-1.32565, 2.2960931530537, 0], [0, 0, 2.4782]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:31:50        5.253215         7.015492
BFGS:    1 15:31:50        4.331951         5.561657
BFGS:    2 15:31:50        3.602033         4.628839
BFGS:    3 15:31:50        2.987096         3.912894
BFGS:    4 15:31:50        2.478277         3.313213
BFGS:    5 15:31:50        2.057086         2.790068
BFGS:    6 15:31:50        1.695175         2.324229
BFGS:    7 15:31:50        1.386077         1.966801
BFGS:    8 15:31:50        1.125385         1.643810
BFGS:    9 15:31:50        0.909148         1.350593
BFGS:   10 15:31:50        0.735920         1.086998
BFGS:   11 15:31:50        0.600635         0.893534
BFGS:   12 15:31:50        0.485893         0.768351
BFGS:   13 15:31:50        0.386691         0.655144
BFGS:   14 15:31:50        0.301627         0.552490
BFGS:   15 15:31:50        0.229455         0.459172
BFGS:   16 15:31:50        0.169064         0.374139
BFGS:   17 15:31:50        0.119465         0.302008
BFGS:   18 15:31:50        0.079771         0.251629
BFGS:   19 15:31:50        0.049188         0.204977
BFGS:   20 15:31:50        0.027092         0.161867
BFGS:   21 15:31:50        0.012812         0.122147
BFGS:   22 15:31:50        0.005547         0.085489
BFGS:   23 15:31:50        0.002991         0.061630
BFGS:   24 15:31:50        0.000723         0.029520
BFGS:   25 15:31:50        0.000004         0.002082
BFGS:   26 15:31:50        0.000000         0.000076
BFGS:   27 15:31:50        0.000000         0.000000
BFGS:   28 15:31:50        0.000000         0.000000
Minimization converged after 28 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.816309154422808e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[5.837836853088306, -2.9682712472515766e-16, -7.746576767198419e-35], [-2.918918426544153, 5.055715017923477, 5.897283199491883e-35], [2.0617267503107428e-36, -1.1647329094284177e-34, 5.499999999910966]])
forces =  [[0. 0. 0.]]
stress =  [-9.76031385e-83 -1.00420540e-82 -2.81630915e-13  3.16085682e-48
 -3.03274604e-48  3.40377262e-83]
energy per atom =  0.0
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0