element(s):
['Si']
AFLOW prototype label:
A_hP2_194_c
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:
['2.6864', '1.708383']
model name:
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.6864, 0, 0], [-1.3432, 2.3264906447265, 0], [0, 0, 4.5894]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:59:20       -8.046959         1.740149
BFGS:    1 15:59:20       -8.118850         1.154247
BFGS:    2 15:59:20       -8.183904         0.195105
BFGS:    3 15:59:21       -8.186044         0.140953
BFGS:    4 15:59:21       -8.186368         0.091105
BFGS:    5 15:59:21       -8.186571         0.025694
BFGS:    6 15:59:21       -8.186611         0.007187
BFGS:    7 15:59:21       -8.186613         0.000811
BFGS:    8 15:59:21       -8.186613         0.000086
BFGS:    9 15:59:21       -8.186613         0.000002
BFGS:   10 15:59:21       -8.186613         0.000000
BFGS:   11 15:59:21       -8.186613         0.000000
Minimization converged after 11 steps.
Maximum force component: 3.4505884560821296e-32 eV/Angstrom
Maximum stress component: 1.2573600986829559e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.799449937595591, 6.995013886425207e-18, 1.5416522390062298e-37], [-1.3997249687977955, 2.4243947625805427, -1.5486082755505106e-36], [2.018238162051458e-36, 1.901877171043781e-36, 4.540830298597095]])
forces =  [[-3.45058846e-32  1.99219817e-32 -1.39922025e-68]
 [ 3.45058846e-32 -1.99219817e-32  1.39922025e-68]]
stress =  [-1.22386374e-11 -1.22386374e-11  1.25736010e-11 -4.66520368e-34
 -1.61607396e-34 -1.90658657e-29]
energy per atom =  -4.093306718455624
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0