element(s):
['Si']
AFLOW prototype label:
A_hP1_191_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.6513', '0.93471127']
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 =  191
cell =  [[2.6513, 0, 0], [-1.32565, 2.2960931530537, 0], [0, 0, 2.4782]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:56:52       -4.094984         1.919646
BFGS:    1 17:56:52       -4.150028         0.774391
BFGS:    2 17:56:52       -4.158766         0.350982
BFGS:    3 17:56:52       -4.160209         0.066277
BFGS:    4 17:56:52       -4.160274         0.042541
BFGS:    5 17:56:52       -4.160316         0.006991
BFGS:    6 17:56:52       -4.160318         0.001693
BFGS:    7 17:56:52       -4.160318         0.000076
BFGS:    8 17:56:52       -4.160318         0.000004
BFGS:    9 17:56:52       -4.160318         0.000000
BFGS:   10 17:56:52       -4.160318         0.000000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.832499845861327e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.699101802205286, -2.5392514382717665e-18, 4.633969138495374e-38], [-1.349550901102643, 2.3374907281101382, 9.406482722262901e-38], [1.1166381824414038e-36, 2.3368419526177178e-36, 2.6093781347062204]])
forces =  [[0. 0. 0.]]
stress =  [ 6.83249985e-11  6.83249985e-11 -6.61105227e-11 -1.34646037e-46
 -5.46984061e-47 -3.14527132e-27]
energy per atom =  -4.160317736267826
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0