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:
EDIP_BelkoGusakovDorozhkin_2010_Ge__MO_129433059219_001
==== 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 17:55:21       -9.738375       20.1147
BFGS:    1 17:55:21      -11.744651       11.7810
BFGS:    2 17:55:21      -13.612396       10.2655
BFGS:    3 17:55:21      -14.357722        1.5542
BFGS:    4 17:55:21      -14.368986        0.3987
BFGS:    5 17:55:21      -14.369804        0.0067
BFGS:    6 17:55:21      -14.369804        0.0000
BFGS:    7 17:55:21      -14.369804        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.24909248899364e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ge', 'Ge']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.6062512186473934, 1.6306009534274944e-32, -1.274721034314923e-32], [3.536678818927598e-32, 3.6062512186473934, -5.289027151123545e-17], [-2.674263640557605e-32, -5.289027151123542e-17, 3.6062512186473934]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.24909249e-10 -1.24909249e-10 -1.24909249e-10  4.63329190e-27
 -2.03027222e-59  2.64593538e-58]
energy per atom =  -7.18490197534725
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0