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_1988T2_Si__MO_245095684871_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 15:39:18      -16.328992         0.083380
BFGS:    1 15:39:18      -16.329267         0.070648
BFGS:    2 15:39:18      -16.329961         0.000869
BFGS:    3 15:39:18      -16.329961         0.000009
BFGS:    4 15:39:18      -16.329961         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.663987361299242e-11 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([[3.8605339616935903, 1.5947000823140714e-33, 5.775192830630503e-33], [-1.31194650768424e-32, 3.8605339616935903, 1.390665649336211e-18], [-1.6322553223109064e-32, 1.3906656493362413e-18, 3.8605339616935903]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 7.66398736e-11  7.66398736e-11  7.66398736e-11 -2.46165668e-26
  3.76361791e-60  3.76776486e-59]
energy per atom =  -4.082490320078613
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0