element(s):
['Ge']
AFLOW prototype label:
A_tI4_141_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:
['5.1602', '0.55650944']
model name:
Tersoff_LAMMPS_MahdizadehAkhlamadi_2017_Ge__MO_344019981553_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ge']
representative atom coordinates =  [[0 0 0]]
spacegroup =  141
cell =  [[5.1602, 0, 0], [0, 5.1602, 0], [0, 0, 2.8717]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:23:32      -16.322620        11.727699
BFGS:    1 17:23:32      -16.841315         7.712623
BFGS:    2 17:23:32      -17.160639         2.614235
BFGS:    3 17:23:32      -17.349373         2.429868
BFGS:    4 17:23:32      -17.573914         2.118164
BFGS:    5 17:23:32      -17.738047         1.749688
BFGS:    6 17:23:32      -17.840680         1.320892
BFGS:    7 17:23:32      -17.886529         0.831372
BFGS:    8 17:23:32      -17.897215         0.585955
BFGS:    9 17:23:32      -17.911513         0.447278
BFGS:   10 17:23:32      -17.928847         0.281363
BFGS:   11 17:23:32      -17.935464         0.092744
BFGS:   12 17:23:32      -17.936512         0.013716
BFGS:   13 17:23:32      -17.936521         0.000771
BFGS:   14 17:23:32      -17.936521         0.000025
BFGS:   15 17:23:32      -17.936521         0.000001
BFGS:   16 17:23:32      -17.936521         0.000000
BFGS:   17 17:23:32      -17.936521         0.000000
Minimization converged after 17 steps.
Maximum force component: 1.1337667412503672e-31 eV/Angstrom
Maximum stress component: 1.783222926886824e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.00000000e+00 1.38666956e-32 1.37342879e-32]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [3.42828038e-33 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 3.45478620e-33 7.50000000e-01]]
cellpar =  Cell([[4.905711240754627, 1.1127102515791234e-36, -1.889715105047764e-36], [1.1702312335295104e-35, 4.905711240754625, -3.0745710120180354e-17], [3.603575021442211e-42, -1.740511794360795e-17, 2.569899798577974]])
forces =  [[ 6.04675595e-32 -6.04675595e-32 -1.97977879e-32]
 [-7.55844494e-33  1.13376674e-31 -1.58382303e-32]
 [ 8.31428944e-32  9.07013393e-32  1.58382303e-32]
 [ 8.31428944e-32  7.55844494e-32  1.58382303e-32]]
stress =  [ 7.61222438e-12  7.61222438e-12  1.78322293e-11 -5.57339744e-28
 -3.81203186e-54 -2.16477430e-63]
energy per atom =  -4.484130260180166
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0