element(s):
['Ge']
AFLOW prototype label:
A_hP2_194_c
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:
['2.96', '1.708277']
model name:
Tersoff_LAMMPS_MahdizadehAkhlamadi_2017_Ge__MO_344019981553_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ge']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.96, 0, 0], [-1.48, 2.5634351952019, 0], [0, 0, 5.0565]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:56:01       -3.577996       28.6895
BFGS:    1 14:56:01       -6.724892       21.8947
BFGS:    2 14:56:01       -8.930506       20.5420
BFGS:    3 14:56:01      -10.074764       12.7376
BFGS:    4 14:56:01      -10.558270        3.2739
BFGS:    5 14:56:01      -10.594979        0.7281
BFGS:    6 14:56:01      -10.601246        0.5950
BFGS:    7 14:56:01      -10.615832        0.1813
BFGS:    8 14:56:01      -10.616062        0.1638
BFGS:    9 14:56:01      -10.616337        0.1725
BFGS:   10 14:56:01      -10.617126        0.1552
BFGS:   11 14:56:01      -10.617768        0.0930
BFGS:   12 14:56:01      -10.618070        0.0432
BFGS:   13 14:56:01      -10.618114        0.0095
BFGS:   14 14:56:01      -10.618117        0.0005
BFGS:   15 14:56:01      -10.618117        0.0000
BFGS:   16 14:56:01      -10.618117        0.0000
BFGS:   17 14:56:01      -10.618117        0.0000
BFGS:   18 14:56:01      -10.618117        0.0000
Minimization converged after 18 steps.
Maximum force component: 1.1344379898230058e-31 eV/Angstrom
Maximum stress component: 1.4041747287759659e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.7610963175440117, 8.770864483538765e-18, 1.4106031068342245e-35], [-1.3805481587720059, 2.391179553288779, 2.2722785235709346e-35], [1.7232457448172452e-35, -6.527425907103175e-34, 4.508996028362162]])
forces =  [[-1.13443799e-31  3.92980847e-32  3.70517780e-32]
 [ 1.13443799e-31 -3.92980847e-32 -7.41035560e-32]]
stress =  [-1.62208000e-12 -1.62208000e-12 -1.40417473e-11  9.96711914e-45
  3.55142095e-45  4.52101254e-28]
energy per atom =  -5.309058341595273
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0