element(s):
['Ge']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.3628']
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 =  229
cell =  [[3.3628, 0, 0], [0, 3.3628, 0], [0, 0, 3.3628]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:55:32      -17.600170       15.5428
BFGS:    1 17:55:32      -20.087028       17.6988
BFGS:    2 17:55:32      -22.904255       19.8696
BFGS:    3 17:55:32      -26.045045       21.9790
BFGS:    4 17:55:32      -29.481084       23.7439
BFGS:    5 17:55:32      -33.131804       24.6983
BFGS:    6 17:55:32      -36.813303       24.0338
BFGS:    7 17:55:32      -40.181065       20.0703
BFGS:    8 17:55:32      -42.541346       10.1576
BFGS:    9 17:55:32      -42.698670       10.2678
BFGS:   10 17:55:32      -43.000679        1.6701
BFGS:   11 17:55:32      -43.010703        0.2189
BFGS:   12 17:55:32      -43.010873        0.0060
BFGS:   13 17:55:32      -43.010873        0.0000
BFGS:   14 17:55:32      -43.010873        0.0000
Minimization converged after 14 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6660173151178104e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.641651244471525, -1.5784673119350233e-32, -4.640532446267973e-33], [-4.3890569984659574e-33, 2.641651244471525, 4.2828724893919125e-17], [7.736170509797453e-33, 4.2828724893919125e-17, 2.641651244471525]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [1.66601732e-10 1.66601732e-10 1.66601732e-10 1.76289377e-27
 4.71018788e-33 1.89420327e-50]
energy per atom =  -21.50543635246155
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0