element(s):
['Si']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.868']
model name:
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.868, 0, 0], [0, 3.868, 0], [0, 0, 3.868]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:38:10        4.922936        32.815577
BFGS:    1 16:38:10       -0.116335        33.836185
BFGS:    2 16:38:10       -5.015699        30.610056
BFGS:    3 16:38:10       -8.992951        21.306546
BFGS:    4 16:38:10      -11.089271         5.783046
BFGS:    5 16:38:10      -11.225325         0.943716
BFGS:    6 16:38:10      -11.228992         0.008141
BFGS:    7 16:38:10      -11.228992         0.000002
BFGS:    8 16:38:10      -11.228992         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.566333246445848e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.88959922e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.076906721493898, 3.215890961080249e-32, -4.157268035635705e-32], [2.8408914173953905e-32, 4.076906721493898, 7.35972817182106e-18], [2.0356664271532592e-32, 7.35972817182099e-18, 4.076906721493898]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 4.56633325e-13  4.56633325e-13  4.56633325e-13  1.04523146e-29
 -1.00582805e-34 -2.00892175e-51]
energy per atom =  -2.8072480459695917
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0