element(s):
['Si']
AFLOW prototype label:
A_cI16_206_c
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.657', '0.10135586']
model name:
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.10135586 0.10135586 0.10135586]]
spacegroup =  206
cell =  [[6.657, 0, 0], [0, 6.657, 0], [0, 0, 6.657]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:38:20      -62.820105         1.950214
BFGS:    1 16:38:21      -63.524453         1.199412
BFGS:    2 16:38:21      -64.101800         0.498421
BFGS:    3 16:38:21      -64.288469         0.269649
BFGS:    4 16:38:21      -64.404103         0.152095
BFGS:    5 16:38:21      -64.489733         0.180354
BFGS:    6 16:38:22      -64.548310         0.216564
BFGS:    7 16:38:22      -64.563099         0.219857
BFGS:    8 16:38:22      -64.566305         0.214245
BFGS:    9 16:38:22      -64.571229         0.195030
BFGS:   10 16:38:22      -64.582179         0.133643
BFGS:   11 16:38:22      -64.592992         0.053026
BFGS:   12 16:38:22      -64.598642         0.011108
BFGS:   13 16:38:22      -64.599254         0.004395
BFGS:   14 16:38:22      -64.599275         0.000519
BFGS:   15 16:38:23      -64.599275         0.000006
BFGS:   16 16:38:23      -64.599275         0.000000
BFGS:   17 16:38:23      -64.599275         0.000000
Minimization converged after 17 steps.
Maximum force component: 1.3228386465290295e-10 eV/Angstrom
Maximum stress component: 3.15027266505452e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[0.125 0.125 0.125]
 [0.375 0.875 0.625]
 [0.875 0.625 0.375]
 [0.625 0.375 0.875]
 [0.625 0.625 0.625]
 [0.875 0.375 0.125]
 [0.375 0.125 0.875]
 [0.125 0.875 0.375]
 [0.875 0.875 0.875]
 [0.625 0.125 0.375]
 [0.125 0.375 0.625]
 [0.375 0.625 0.125]
 [0.375 0.375 0.375]
 [0.125 0.625 0.875]
 [0.625 0.875 0.125]
 [0.875 0.125 0.625]]
cellpar =  Cell([[6.629672108293273, 1.3483799123885295e-36, 0.0], [-1.3238567929256024e-36, 6.629672108293273, 0.0], [0.0, 0.0, 6.629672108293273]])
forces =  [[-1.32283865e-10 -1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10  1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10 -1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10  1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10 -1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10  1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10 -1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10  1.32283865e-10  1.32283865e-10]
 [ 1.32283865e-10  1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10 -1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10  1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10 -1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10  1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10 -1.32283865e-10  1.32283865e-10]
 [-1.32283865e-10  1.32283865e-10 -1.32283865e-10]
 [ 1.32283865e-10 -1.32283865e-10 -1.32283865e-10]]
stress =  [3.15027267e-11 3.15027267e-11 3.15027267e-11 0.00000000e+00
 0.00000000e+00 3.73916902e-34]
energy per atom =  -4.037454706167767
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_cI16_206_c, while relaxed is A_cI16_230_b. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.