element(s):
['Ge']
AFLOW prototype label:
A_cI16_206_c
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.0346', '0.10153438']
model name:
Tersoff_LAMMPS_MahdizadehAkhlamadi_2017_Ge__MO_344019981553_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ge']
representative atom coordinates =  [[0.10153438 0.10153438 0.10153438]]
spacegroup =  206
cell =  [[7.0346, 0, 0], [0, 7.0346, 0], [0, 0, 7.0346]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:36:03      -62.983477         1.024075
BFGS:    1 15:36:03      -63.124246         0.973496
BFGS:    2 15:36:03      -63.376944         0.793657
BFGS:    3 15:36:03      -63.431363         0.682954
BFGS:    4 15:36:03      -63.487619         0.606300
BFGS:    5 15:36:03      -63.572613         0.517616
BFGS:    6 15:36:03      -63.658564         0.436496
BFGS:    7 15:36:03      -63.740192         0.387673
BFGS:    8 15:36:03      -63.812835         0.334386
BFGS:    9 15:36:03      -63.872926         0.267019
BFGS:   10 15:36:03      -63.917746         0.188426
BFGS:   11 15:36:03      -63.944941         0.098584
BFGS:   12 15:36:03      -63.952211         0.013198
BFGS:   13 15:36:03      -63.952290         0.006621
BFGS:   14 15:36:03      -63.952315         0.000017
BFGS:   15 15:36:03      -63.952315         0.000000
BFGS:   16 15:36:03      -63.952315         0.000000
Minimization converged after 16 steps.
Maximum force component: 5.77933606642674e-14 eV/Angstrom
Maximum stress component: 2.1211365186443907e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.09995266 0.09995266 0.09995266]
 [0.40004734 0.90004734 0.59995266]
 [0.90004734 0.59995266 0.40004734]
 [0.59995266 0.40004734 0.90004734]
 [0.59995266 0.59995266 0.59995266]
 [0.90004734 0.40004734 0.09995266]
 [0.40004734 0.09995266 0.90004734]
 [0.09995266 0.90004734 0.40004734]
 [0.90004734 0.90004734 0.90004734]
 [0.59995266 0.09995266 0.40004734]
 [0.09995266 0.40004734 0.59995266]
 [0.40004734 0.59995266 0.09995266]
 [0.40004734 0.40004734 0.40004734]
 [0.09995266 0.59995266 0.90004734]
 [0.59995266 0.90004734 0.09995266]
 [0.90004734 0.09995266 0.59995266]]
cellpar =  Cell([[6.804758237363775, 3.5698118425400767e-37, 5.00398921327235e-69], [1.785602460255277e-36, 6.804758237363775, 1.328642766738356e-50], [2.1123200438773626e-84, -9.538580272753471e-32, 6.804758237363775]])
forces =  [[-5.77933607e-14 -5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14  5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14 -5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14  5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14 -5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14  5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14 -5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14  5.77933607e-14  5.77933607e-14]
 [ 5.77933607e-14  5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14 -5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14  5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14 -5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14  5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14 -5.77933607e-14  5.77933607e-14]
 [-5.77933607e-14  5.77933607e-14 -5.77933607e-14]
 [ 5.77933607e-14 -5.77933607e-14 -5.77933607e-14]]
stress =  [ 2.12113652e-14  2.12113652e-14  2.12113652e-14  8.99678735e-63
 -3.98010768e-65 -2.83938173e-33]
energy per atom =  -3.9970197092311883
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0