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 17:39:24      -62.820105        1.9502
BFGS:    1 17:39:24      -63.524453        1.1994
BFGS:    2 17:39:24      -64.101800        0.4984
BFGS:    3 17:39:24      -64.288469        0.2696
BFGS:    4 17:39:24      -64.404103        0.1521
BFGS:    5 17:39:24      -64.489733        0.1804
BFGS:    6 17:39:24      -64.548310        0.2166
BFGS:    7 17:39:24      -64.563099        0.2199
BFGS:    8 17:39:24      -64.566305        0.2142
BFGS:    9 17:39:24      -64.571229        0.1950
BFGS:   10 17:39:24      -64.582179        0.1336
BFGS:   11 17:39:24      -64.592992        0.0530
BFGS:   12 17:39:24      -64.598642        0.0111
BFGS:   13 17:39:24      -64.599254        0.0044
BFGS:   14 17:39:24      -64.599275        0.0005
BFGS:   15 17:39:24      -64.599275        0.0000
BFGS:   16 17:39:24      -64.599275        0.0000
BFGS:   17 17:39:24      -64.599275        0.0000
Minimization converged after 17 steps.
Maximum force component: 1.322845000495861e-10 eV/Angstrom
Maximum stress component: 3.1503140499728945e-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([[6.629672108293275, 5.6538811793516165e-37, 0.0], [-2.4972047902820603e-37, 6.629672108293275, 0.0], [0.0, 0.0, 6.629672108293275]])
forces =  [[-1.322845e-10 -1.322845e-10 -1.322845e-10]
 [ 1.322845e-10  1.322845e-10 -1.322845e-10]
 [ 1.322845e-10 -1.322845e-10  1.322845e-10]
 [-1.322845e-10  1.322845e-10  1.322845e-10]
 [-1.322845e-10 -1.322845e-10 -1.322845e-10]
 [ 1.322845e-10  1.322845e-10 -1.322845e-10]
 [ 1.322845e-10 -1.322845e-10  1.322845e-10]
 [-1.322845e-10  1.322845e-10  1.322845e-10]
 [ 1.322845e-10  1.322845e-10  1.322845e-10]
 [-1.322845e-10 -1.322845e-10  1.322845e-10]
 [-1.322845e-10  1.322845e-10 -1.322845e-10]
 [ 1.322845e-10 -1.322845e-10 -1.322845e-10]
 [ 1.322845e-10  1.322845e-10  1.322845e-10]
 [-1.322845e-10 -1.322845e-10  1.322845e-10]
 [-1.322845e-10  1.322845e-10 -1.322845e-10]
 [ 1.322845e-10 -1.322845e-10 -1.322845e-10]]
stress =  [ 3.15031405e-11  3.15031405e-11  3.15031405e-11  0.00000000e+00
  0.00000000e+00 -9.12689384e-64]
energy per atom =  -4.0374547061677655
===============================================
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.