element(s):
['Si']
AFLOW prototype label:
A_tI4_141_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:
['4.8146', '0.54949529']
model name:
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  141
cell =  [[4.8146, 0, 0], [0, 4.8146, 0], [0, 0, 2.6456]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:25:35      -16.072387         1.588312
BFGS:    1 16:25:35      -16.129022         3.003596
BFGS:    2 16:25:35      -16.364380         6.100487
BFGS:    3 16:25:35      -16.736819         8.241923
BFGS:    4 16:25:35      -17.167347         7.963462
BFGS:    5 16:25:35      -17.508237         3.905649
BFGS:    6 16:25:35      -17.600761         3.115045
BFGS:    7 16:25:35      -17.644455         0.824775
BFGS:    8 16:25:35      -17.668555         0.369940
BFGS:    9 16:25:35      -17.673734         0.187614
BFGS:   10 16:25:35      -17.673927         0.015153
BFGS:   11 16:25:35      -17.673927         0.000783
BFGS:   12 16:25:35      -17.673927         0.000005
BFGS:   13 16:25:35      -17.673927         0.000000
BFGS:   14 16:25:35      -17.673927         0.000000
Minimization converged after 14 steps.
Maximum force component: 4.338776614385998e-32 eV/Angstrom
Maximum stress component: 8.274057547819e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[1.24077094e-33 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [2.45141107e-34 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 1.64140181e-34 7.50000000e-01]]
cellpar =  Cell([[4.693378371825165, -3.737344802403778e-36, 9.865434597145704e-39], [5.620771413437394e-36, 4.693378371825165, 9.083407319625915e-18], [1.5621853546746887e-37, 4.914975726895852e-18, 2.8134758481974638]])
forces =  [[-2.89251774e-32  2.89251774e-32  5.59808197e-50]
 [ 2.89251774e-32 -7.57271914e-51 -4.33484591e-33]
 [-4.33877661e-32 -2.89251774e-32 -5.59808197e-50]
 [-2.89251774e-32 -4.33877661e-32 -1.30045377e-32]]
stress =  [ 4.37733020e-12  4.37733020e-12  8.27405755e-11 -2.70326100e-27
 -4.66725688e-34  1.49044177e-50]
energy per atom =  -4.418481833990768
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0