element(s):
['Ge']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2619']
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 =  225
cell =  [[4.2619, 0, 0], [0, 4.2619, 0], [0, 0, 4.2619]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:20:52       -5.361890        26.921352
BFGS:    1 16:20:52       -9.630083        28.976015
BFGS:    2 16:20:52      -13.792917        25.822989
BFGS:    3 16:20:52      -17.220449        19.536433
BFGS:    4 16:20:52      -19.599729        12.145880
BFGS:    5 16:20:53      -20.881319         5.067080
BFGS:    6 16:20:53      -21.178397         0.767588
BFGS:    7 16:20:53      -21.192225         0.674929
BFGS:    8 16:20:53      -21.236393         0.060399
BFGS:    9 16:20:53      -21.236715         0.004163
BFGS:   10 16:20:53      -21.236717         0.000023
BFGS:   11 16:20:53      -21.236717         0.000000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.552782398493733e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 3.15660853e-33 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.9048084410267947, -1.5063573965586837e-32, -1.1367092166869594e-33], [-2.7034409200079435e-33, 3.9048084410267947, 8.769154584915911e-17], [-1.0774765682902648e-32, 8.769154584915913e-17, 3.9048084410267947]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.55278240e-10 -5.55278240e-10 -5.55278240e-10 -9.13302736e-26
 -1.34731685e-34 -2.61928054e-50]
energy per atom =  -5.309179191278149
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0