element(s):
['Si']
AFLOW prototype label:
A_tI4_141_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:
['4.8146', '0.54949529']
model name:
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  141
cell =  [[4.8146, 0, 0], [0, 4.8146, 0], [0, 0, 2.6456]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:12:28      -15.889265        1.9983
BFGS:    1 17:12:28      -15.949243        2.1490
BFGS:    2 17:12:28      -16.056402        1.9919
BFGS:    3 17:12:28      -16.141920        1.2449
BFGS:    4 17:12:28      -16.181158        0.2607
BFGS:    5 17:12:28      -16.184524        0.2057
BFGS:    6 17:12:28      -16.186119        0.1041
BFGS:    7 17:12:28      -16.186724        0.0454
BFGS:    8 17:12:28      -16.186776        0.0086
BFGS:    9 17:12:28      -16.186778        0.0003
BFGS:   10 17:12:28      -16.186778        0.0000
BFGS:   11 17:12:28      -16.186778        0.0000
BFGS:   12 17:12:28      -16.186778        0.0000
BFGS:   13 17:12:28      -16.186778        0.0000
Minimization converged after 13 steps.
Maximum force component: 3.1044054444750436e-32 eV/Angstrom
Maximum stress component: 3.7283504135703755e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 0.00000000e+00 3.21833772e-33]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.70880583e-34 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 0.00000000e+00 7.50000000e-01]]
cellpar =  Cell([[4.85480729773177, 1.0522275956402092e-36, 2.912253228759316e-37], [-1.7758687458558935e-36, 4.85480729773177, -3.0268337542495433e-18], [1.557255010644036e-37, -1.5823629566372687e-18, 2.5185929120259662]])
forces =  [[ 4.67500937e-34  2.57125516e-33 -1.60310419e-51]
 [-1.40250281e-33 -4.87603232e-51  7.76101361e-33]
 [ 4.67500937e-34  2.33750469e-34  1.35817738e-32]
 [ 2.33750469e-34 -2.33750469e-34  3.10440544e-32]]
stress =  [3.86078746e-12 3.86078746e-12 3.72835041e-11 2.17517872e-27
 3.81712780e-49 2.05371342e-65]
energy per atom =  -4.046694556936694
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0