element(s):
['Si']
AFLOW prototype label:
A_hP4_194_f
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.8496', '1.6527431', '0.56294015']
model name:
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.33333333 0.66666667 0.56294015]]
spacegroup =  194
cell =  [[3.8496, 0, 0], [-1.9248, 3.3338513944086, 0], [0, 0, 6.3624]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:31:13      -18.572315        0.4760
BFGS:    1 15:31:13      -18.576934        0.3772
BFGS:    2 15:31:13      -18.585279        0.1427
BFGS:    3 15:31:13      -18.587026        0.1217
BFGS:    4 15:31:13      -18.588082        0.0410
BFGS:    5 15:31:13      -18.588239        0.0441
BFGS:    6 15:31:13      -18.588382        0.0431
BFGS:    7 15:31:13      -18.588589        0.0458
BFGS:    8 15:31:13      -18.588797        0.0339
BFGS:    9 15:31:13      -18.588880        0.0147
BFGS:   10 15:31:13      -18.588893        0.0024
BFGS:   11 15:31:13      -18.588893        0.0002
BFGS:   12 15:31:13      -18.588893        0.0000
BFGS:   13 15:31:13      -18.588893        0.0000
BFGS:   14 15:31:13      -18.588893        0.0000
Minimization converged after 14 steps.
Maximum force component: 9.23645289400826e-09 eV/Angstrom
Maximum stress component: 7.669548332648213e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.33333333 0.66666667 0.5625    ]
 [0.66666666 0.33333334 0.0625    ]
 [0.66666666 0.33333334 0.4375    ]
 [0.33333333 0.66666667 0.9375    ]]
cellpar =  Cell([[3.8363741920886913, 6.2284158996576815e-18, 1.6230941318871722e-37], [-1.9181870960443457, 3.322397508771809, -1.5828887873424338e-37], [-3.010976061589068e-36, -1.2153442517838814e-35, 6.264772824175495]])
forces =  [[-2.36434814e-31  3.00312548e-31 -9.23645289e-09]
 [-1.89147851e-31  3.27613688e-31 -9.23645289e-09]
 [ 1.10336246e-31 -8.19034221e-32  9.23645289e-09]
 [-3.15246419e-31  1.09204563e-31  9.23645289e-09]]
stress =  [ 7.66954833e-11  7.66954833e-11  1.56727114e-12  5.92193369e-34
 -1.70951500e-33  6.53622732e-27]
energy per atom =  -4.647223337947562
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0