element(s):
['Si']
AFLOW prototype label:
A_cI12_229_d
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.7307']
model name:
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.25 0.   0.5 ]]
spacegroup =  229
cell =  [[6.7307, 0, 0], [0, 6.7307, 0], [0, 0, 6.7307]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 23:59:46      -48.214282         0.405501
BFGS:    1 23:59:46      -48.221180         0.388360
BFGS:    2 23:59:46      -48.268168         0.237181
BFGS:    3 23:59:46      -48.292042         0.080167
BFGS:    4 23:59:46      -48.295035         0.002272
BFGS:    5 23:59:46      -48.295038         0.000021
BFGS:    6 23:59:46      -48.295038         0.000000
Minimization converged after 6 steps.
Maximum force component: 1.0257400964564701e-30 eV/Angstrom
Maximum stress component: 2.1142453117708949e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[2.50000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 7.31904044e-33 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 0.00000000e+00]
 [5.00000000e-01 7.50000000e-01 0.00000000e+00]
 [1.23818738e-36 5.00000000e-01 2.50000000e-01]
 [0.00000000e+00 5.00000000e-01 7.50000000e-01]
 [1.41059322e-37 2.50000000e-01 5.00000000e-01]
 [1.56732580e-38 7.50000000e-01 5.00000000e-01]
 [2.50000000e-01 5.00000000e-01 0.00000000e+00]
 [7.50000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 3.65228797e-33 7.50000000e-01]
 [5.00000000e-01 3.65952022e-33 2.50000000e-01]]
cellpar =  Cell([[6.657433850630176, 2.778943172425984e-34, 3.518104795422204e-33], [-9.183421616524798e-34, 6.657433850630176, -4.863142938006827e-19], [-5.184373263557295e-33, -4.863142938007752e-19, 6.657433850630176]])
forces =  [[ 2.73530692e-32  1.14177064e-66  1.44546632e-65]
 [ 3.07722029e-31  1.28449197e-65  1.62614961e-64]
 [ 1.04427193e-64 -7.52209404e-31 -8.54783414e-34]
 [-1.05412295e-64  7.64176372e-31 -5.58217927e-50]
 [-7.98779177e-64 -7.49285809e-50  1.02574010e-30]
 [ 5.16543868e-64  4.84538156e-50 -6.63311929e-31]
 [-1.70956683e-33  9.57357423e-32 -6.99333421e-51]
 [ 1.03761543e-65 -7.52209404e-32  5.49476260e-51]
 [ 3.00883762e-31  1.25594770e-65  1.59001295e-64]
 [ 6.83826731e-32 -3.86350495e-52  5.28897237e-33]
 [-3.38149852e-64 -3.17197659e-50  4.34229974e-31]
 [ 3.19511671e-64  2.99714323e-50 -4.10296039e-31]]
stress =  [ 2.11424531e-10  2.11424531e-10  2.11424531e-10 -1.14144460e-25
 -9.60748112e-59  9.19486763e-60]
energy per atom =  -4.024586459859015
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0