element(s):
['C', 'Si']
AFLOW prototype label:
AB_hP4_186_b_b
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.0918', '1.6407271', '8.9172044e-05', '0.37591083']
model name:
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Si']
representative atom coordinates =  [[0.33333333 0.66666667 0.50008917]
 [0.33333333 0.66666667 0.87591083]]
spacegroup =  186
cell =  [[3.0918, 0, 0], [-1.5459, 2.6775773434207, 0], [0, 0, 5.0728]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:57:48      -25.719862         0.532675
BFGS:    1 12:57:48      -25.721200         0.573989
BFGS:    2 12:57:48      -25.726497         0.192973
BFGS:    3 12:57:48      -25.727617         0.184555
BFGS:    4 12:57:48      -25.729868         0.061985
BFGS:    5 12:57:48      -25.729956         0.020869
BFGS:    6 12:57:48      -25.729969         0.011124
BFGS:    7 12:57:48      -25.729980         0.014018
BFGS:    8 12:57:48      -25.729994         0.015679
BFGS:    9 12:57:48      -25.729999         0.007221
BFGS:   10 12:57:48      -25.730000         0.001073
BFGS:   11 12:57:48      -25.730000         0.000052
BFGS:   12 12:57:48      -25.730000         0.000004
BFGS:   13 12:57:48      -25.730000         0.000000
BFGS:   14 12:57:48      -25.730000         0.000000
Minimization converged after 14 steps.
Maximum force component: 2.3991722220007006e-09 eV/Angstrom
Maximum stress component: 1.4851960229747303e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'Si', 'Si']
basis =  [[3.33333330e-01 6.66666670e-01 5.00500000e-01]
 [6.66666663e-01 3.33333337e-01 4.99999999e-04]
 [3.33333330e-01 6.66666670e-01 8.75500000e-01]
 [6.66666663e-01 3.33333337e-01 3.75500000e-01]]
cellpar =  Cell([[3.082764488505825, 7.923475857995647e-19, 2.785348003739963e-38], [-1.5413822442529126, 2.669752360930585, -2.3221342395171702e-37], [-2.423211724923855e-36, 1.2469111228948851e-36, 5.034133329488876]])
forces =  [[ 1.21593619e-30 -7.02021088e-31  2.39917222e-09]
 [-6.07968096e-31  1.05303163e-30  2.39917222e-09]
 [-1.62124826e-30 -5.94670826e-46 -2.39917219e-09]
 [ 1.01328016e-31 -1.75505272e-31 -2.39917219e-09]]
stress =  [-7.91660214e-11 -7.91660214e-11  1.48519602e-10  1.53435261e-45
  4.81067105e-46  1.65482275e-26]
energy per atom =  -6.432499999995335
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0