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:
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002
==== 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 17:15:49      -13.029343        5.6504
BFGS:    1 17:15:49      -13.791892        4.5410
BFGS:    2 17:15:49      -14.398462        3.5680
BFGS:    3 17:15:49      -14.868337        2.7160
BFGS:    4 17:15:49      -15.218621        1.9713
BFGS:    5 17:15:49      -15.464471        1.3216
BFGS:    6 17:15:49      -15.619320        0.7562
BFGS:    7 17:15:49      -15.695067        0.2654
BFGS:    8 17:15:49      -15.706842        0.0280
BFGS:    9 17:15:49      -15.706982        0.0012
BFGS:   10 17:15:49      -15.706982        0.0000
BFGS:   11 17:15:49      -15.706982        0.0000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.257305007295728e-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([[4.235821874192634, -5.084816415659895e-33, -5.201577419070872e-32], [-2.7618063488852064e-33, 4.235821874192634, 5.455541300658615e-17], [-1.8475623922881486e-32, 5.4555413006586116e-17, 4.235821874192634]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-7.25730501e-11 -7.25730501e-11 -7.25730501e-11  5.07852931e-28
  5.72484636e-35 -2.47288556e-52]
energy per atom =  -3.9267454536378845
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0