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:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== 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 16:23:20      -36.046329        14.976001
BFGS:    1 16:23:20      -38.237471        15.881567
BFGS:    2 16:23:20      -40.441420        16.798627
BFGS:    3 16:23:20      -42.643782        17.652196
BFGS:    4 16:23:20      -44.833497        18.457658
BFGS:    5 16:23:20      -46.991198        19.187497
BFGS:    6 16:23:20      -49.095521        19.806918
BFGS:    7 16:23:20      -51.124456        20.311676
BFGS:    8 16:23:20      -53.091420        20.604017
BFGS:    9 16:23:20      -54.929596        20.589924
BFGS:   10 16:23:20      -56.668209        20.253047
BFGS:   11 16:23:20      -58.390576        19.437897
BFGS:   12 16:23:20      -60.167141        18.100065
BFGS:   13 16:23:20      -62.028865        15.969776
BFGS:   14 16:23:20      -63.946991        12.883593
BFGS:   15 16:23:20      -65.425074         8.645154
BFGS:   16 16:23:20      -66.222957         2.881836
BFGS:   17 16:23:20      -66.295523         0.808305
BFGS:   18 16:23:20      -66.300531         0.094432
BFGS:   19 16:23:20      -66.300537         0.064445
BFGS:   20 16:23:20      -66.300560         0.011048
BFGS:   21 16:23:20      -66.300561         0.002407
BFGS:   22 16:23:20      -66.300561         0.000119
BFGS:   23 16:23:20      -66.300561         0.000003
BFGS:   24 16:23:20      -66.300561         0.000000
BFGS:   25 16:23:20      -66.300561         0.000000
Minimization converged after 25 steps.
Maximum force component: 3.455153619277836e-30 eV/Angstrom
Maximum stress component: 2.925492964732432e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge', 'Ge', 'Ge']
basis =  [[0.00000000e+00 8.82442434e-33 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [1.30063526e-33 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 0.00000000e+00 7.50000000e-01]]
cellpar =  Cell([[4.379927559358288, -1.834723695301931e-35, 2.8620713442087576e-34], [-3.210278955129073e-36, 4.379927559358288, 6.830687902372926e-19], [4.009785827269394e-36, 1.7085991225246092e-19, 2.2893539295814147]])
forces =  [[-1.94880985e-66  2.65884868e-30  4.14659039e-49]
 [ 2.55717578e-66 -3.45515362e-30  1.41092329e-32]
 [-8.63788405e-31 -1.60948074e-30 -2.82184658e-32]
 [-8.63788405e-31 -1.88278879e-30 -2.82184658e-32]]
stress =  [-2.92549296e-11 -2.92549296e-11 -1.39544136e-11 -7.19911064e-27
 -3.07312766e-34 -3.41185709e-50]
energy per atom =  -16.575140238862335
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0