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_Tersoff_1988T3_Si__MO_186459956893_004
==== 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 16:40:31      -15.375926         2.016500
BFGS:    1 16:40:31      -15.474896         0.131030
BFGS:    2 16:40:31      -15.475196         0.031764
BFGS:    3 16:40:31      -15.475215         0.000320
BFGS:    4 16:40:31      -15.475215         0.000001
BFGS:    5 16:40:31      -15.475215         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.2613925430969779e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.51118453e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.72117644e-37 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.8974184341180274, 1.0538076028292396e-33, -2.9499861578187317e-35], [8.167430002645906e-33, 3.8974184341180274, -4.239305844751476e-20], [-7.12790921204656e-34, -4.2393058447514295e-20, 3.8974184341180274]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [1.26139254e-12 1.26139254e-12 1.26139254e-12 1.67494396e-29
 5.40972428e-34 1.64661627e-50]
energy per atom =  -3.86880363686242
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0