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:
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005
==== 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 15:39:18      -15.853021         1.613189
BFGS:    1 15:39:18      -15.904653         0.039221
BFGS:    2 15:39:18      -15.904690         0.005578
BFGS:    3 15:39:18      -15.904691         0.000026
BFGS:    4 15:39:18      -15.904691         0.000000
BFGS:    5 15:39:18      -15.904691         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.783532349269124e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.846331194526916, 1.642357212088933e-32, -4.252172644393985e-33], [1.0147898713665415e-32, 3.846331194526916, 7.54086931682773e-25], [-1.770091867159671e-33, 7.5408693421979235e-25, 3.846331194526916]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.78353235e-15 -2.78353235e-15 -2.78353235e-15  3.63811328e-32
  1.73574478e-35  3.75190463e-52]
energy per atom =  -3.976172708813225
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0