element(s):
['Ge']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.3628']
model name:
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ge']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.3628, 0, 0], [0, 3.3628, 0], [0, 0, 3.3628]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:55:21       -5.363737       13.9060
BFGS:    1 17:55:21       -6.774074        4.8359
BFGS:    2 17:55:21       -6.980849        0.4363
BFGS:    3 17:55:21       -6.983682        0.3276
BFGS:    4 17:55:21       -6.989711        0.1758
BFGS:    5 17:55:21       -6.992036        0.0095
BFGS:    6 17:55:21       -6.992042        0.0003
BFGS:    7 17:55:21       -6.992042        0.0000
BFGS:    8 17:55:21       -6.992042        0.0000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.647692181327826e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.201334032665075, -4.037058724575146e-33, 3.641861498890103e-33], [-1.1694689582492431e-32, 3.201334032665075, -2.8674495234988852e-18], [-3.540190246007444e-33, -2.8674495234988794e-18, 3.201334032665075]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-7.64769218e-13 -7.64769218e-13 -7.64769218e-13  1.64239810e-30
  1.00225269e-33 -1.30894383e-51]
energy per atom =  -3.496021082878502
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0