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_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_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 14:40:37       -3.755467        1.9859
BFGS:    1 14:40:37       -3.798991        1.0582
BFGS:    2 14:40:37       -3.824086        0.3309
BFGS:    3 14:40:37       -3.827742        0.0969
BFGS:    4 14:40:37       -3.828064        0.0198
BFGS:    5 14:40:37       -3.828079        0.0062
BFGS:    6 14:40:37       -3.828080        0.0012
BFGS:    7 14:40:37       -3.828080        0.0001
BFGS:    8 14:40:37       -3.828080        0.0000
BFGS:    9 14:40:37       -3.828080        0.0000
BFGS:   10 14:40:37       -3.828080        0.0000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.002466958297983e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.614155337606817, 5.983766571941285e-18, 1.7893321331260189e-37], [-1.3070776688034085, 2.2639249318061885, 9.12833062645432e-37], [1.600967961932345e-35, 7.457539686072562e-35, 2.6905718568726966]])
forces =  [[0. 0. 0.]]
stress =  [ 3.00246696e-10  3.00246696e-10 -1.28730884e-11  1.26471847e-34
  8.03204101e-34 -1.14524994e-26]
energy per atom =  -3.828080239215318
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0