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:
SW_LeeHwang_2012LDA_Si__MO_517338295712_001
==== 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 17:55:23       -1.680261         8.582884
BFGS:    1 17:55:23       -2.304759         3.067849
BFGS:    2 17:55:23       -2.423606         0.492460
BFGS:    3 17:55:23       -2.427460         0.158752
BFGS:    4 17:55:23       -2.427807         0.049296
BFGS:    5 17:55:23       -2.427881         0.017184
BFGS:    6 17:55:23       -2.427884         0.002098
BFGS:    7 17:55:23       -2.427884         0.000149
BFGS:    8 17:55:23       -2.427884         0.000005
BFGS:    9 17:55:23       -2.427884         0.000000
BFGS:   10 17:55:23       -2.427884         0.000000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.628035207316904e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.864777404736997, -1.8968055966942497e-17, -1.5433668160440787e-36], [-1.4323887023684985, 2.480970008689895, 3.042876446022691e-36], [3.7816618674694095e-35, -2.5213112980791415e-35, 2.617828573034604]])
forces =  [[0. 0. 0.]]
stress =  [-5.62803521e-11 -5.62803521e-11 -3.14051880e-11 -2.75120025e-47
  9.64378481e-46 -1.96898871e-26]
energy per atom =  -2.4278842095969035
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0