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:
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 =  225
cell =  [[3.868, 0, 0], [0, 3.868, 0], [0, 0, 3.868]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:16:02      -16.150577        0.9907
BFGS:    1 17:16:02      -16.188909        0.8161
BFGS:    2 17:16:02      -16.268153        0.2542
BFGS:    3 17:16:02      -16.277577        0.0261
BFGS:    4 17:16:02      -16.277682        0.0010
BFGS:    5 17:16:02      -16.277682        0.0000
BFGS:    6 17:16:02      -16.277682        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.011048548264142e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.9545105827875076, -4.7347840881845946e-32, 6.622642452345446e-33], [-7.265597870430487e-33, 3.9545105827875076, -5.372764320843632e-18], [2.393150170964113e-32, -5.37276432084365e-18, 3.9545105827875076]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.01104855e-11 -4.01104855e-11 -4.01104855e-11  1.61606293e-26
  3.28415566e-35 -7.30972233e-51]
energy per atom =  -4.0694204900936235
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0