element(s):
['C', 'Si']
AFLOW prototype label:
A2B_cP12_205_c_a
Parameter names:
['a', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.7882', '0.41797522']
model name:
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Si']
representative atom coordinates =  [[0.41797522 0.41797522 0.41797522]
 [0.         0.         0.        ]]
spacegroup =  205
cell =  [[4.7882, 0, 0], [0, 4.7882, 0], [0, 0, 4.7882]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:58:17      -75.822977         3.450864
BFGS:    1 15:58:17      -76.417356         0.673420
BFGS:    2 15:58:17      -76.437472         0.636651
BFGS:    3 15:58:17      -76.516817         0.450266
BFGS:    4 15:58:17      -76.569419         0.310765
BFGS:    5 15:58:17      -76.600266         0.240411
BFGS:    6 15:58:17      -76.607061         0.083423
BFGS:    7 15:58:17      -76.607489         0.025991
BFGS:    8 15:58:17      -76.607550         0.000302
BFGS:    9 15:58:17      -76.607550         0.000012
BFGS:   10 15:58:17      -76.607550         0.000000
BFGS:   11 15:58:17      -76.607550         0.000000
Minimization converged after 11 steps.
Maximum force component: 2.386736131359628e-09 eV/Angstrom
Maximum stress component: 1.174501018001633e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[4.12033193e-01 4.12033193e-01 4.12033193e-01]
 [8.79668069e-02 5.87966807e-01 9.12033193e-01]
 [5.87966807e-01 9.12033193e-01 8.79668069e-02]
 [9.12033193e-01 8.79668069e-02 5.87966807e-01]
 [5.87966807e-01 5.87966807e-01 5.87966807e-01]
 [9.12033193e-01 4.12033193e-01 8.79668069e-02]
 [4.12033193e-01 8.79668069e-02 9.12033193e-01]
 [8.79668069e-02 9.12033193e-01 4.12033193e-01]
 [0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [1.32942270e-53 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.7120394941404635, -7.825022511362392e-38, 0.0], [-2.8648153116288694e-37, 4.7120394941404635, 0.0], [0.0, 0.0, 4.7120394941404635]])
forces =  [[ 2.38673613e-09  2.38673613e-09  2.38673613e-09]
 [-2.38673613e-09 -2.38673613e-09  2.38673613e-09]
 [-2.38673613e-09  2.38673613e-09 -2.38673613e-09]
 [ 2.38673613e-09 -2.38673613e-09 -2.38673613e-09]
 [-2.38673613e-09 -2.38673613e-09 -2.38673613e-09]
 [ 2.38673613e-09  2.38673613e-09 -2.38673613e-09]
 [ 2.38673613e-09 -2.38673613e-09  2.38673613e-09]
 [-2.38673613e-09  2.38673613e-09  2.38673613e-09]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [1.17450102e-10 1.17450102e-10 1.17450102e-10 0.00000000e+00
 0.00000000e+00 1.18429893e-32]
energy per atom =  -6.3839624756972535
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0