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_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_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 16:40:55      -14.435058         5.507299
BFGS:    1 16:40:55      -15.162983         4.226369
BFGS:    2 16:40:55      -15.710915         3.104431
BFGS:    3 16:40:55      -16.101420         2.124699
BFGS:    4 16:40:55      -16.354677         1.272054
BFGS:    5 16:40:55      -16.488708         0.532881
BFGS:    6 16:40:55      -16.520496         0.063443
BFGS:    7 16:40:55      -16.520986         0.003801
BFGS:    8 16:40:55      -16.520988         0.000030
BFGS:    9 16:40:55      -16.520988         0.000000
BFGS:   10 16:40:55      -16.520988         0.000000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.8476611045039158e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [9.89335673e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.1496194919855505, -2.101986019589889e-32, 5.6331064251694175e-33], [-1.8195895935458005e-32, 4.1496194919855505, 4.3307721045802195e-17], [-2.4148299988382235e-33, 4.330772104580216e-17, 4.1496194919855505]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.84766110e-15 -2.84766110e-15 -2.84766110e-15 -5.19113845e-32
  3.72822986e-36  5.02737220e-53]
energy per atom =  -4.130246994339417
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0