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:
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000
==== 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 15:10:32       -8.192325         2.683913
BFGS:    1 15:10:32       -8.139627         4.802593
BFGS:    2 15:10:32       -8.248701         1.164125
BFGS:    3 15:10:32       -8.255905         0.515005
BFGS:    4 15:10:32       -8.258485         0.279698
BFGS:    5 15:10:32       -8.260868         0.433079
BFGS:    6 15:10:32       -8.273879         0.727665
BFGS:    7 15:10:32       -8.288105         0.761223
BFGS:    8 15:10:32       -8.301782         0.631273
BFGS:    9 15:10:32       -8.310170         0.385124
BFGS:   10 15:10:32       -8.311371         0.174013
BFGS:   11 15:10:32       -8.311626         0.124436
BFGS:   12 15:10:32       -8.311750         0.040101
BFGS:   13 15:10:32       -8.311762         0.004652
BFGS:   14 15:10:32       -8.311763         0.000216
BFGS:   15 15:10:32       -8.311763         0.000035
BFGS:   16 15:10:32       -8.311763         0.000001
BFGS:   17 15:10:32       -8.311763         0.000000
Minimization converged after 17 steps.
Maximum force component: 4.022312696946922e-32 eV/Angstrom
Maximum stress component: 7.507011027175241e-10 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([[2.8260900887066644, -1.1305081557798328e-17, -1.269952304997233e-36], [-1.4130450443533322, 2.447465810203389, -2.4263688067731326e-35], [3.0598001948795746e-36, 6.146489750844072e-35, 3.999041405808048]])
forces =  [[-7.25713537e-33 -3.26812907e-32  3.35735828e-67]
 [-3.48342498e-32  4.02231270e-32 -3.93546271e-67]]
stress =  [ 7.50701103e-10  7.50701103e-10  4.00996378e-10 -6.71655620e-33
  1.41158991e-45 -3.14749204e-25]
energy per atom =  -4.1558814271499545
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0