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 16:57:39       -9.738375        20.114674
BFGS:    1 16:57:39      -11.744651        11.780974
BFGS:    2 16:57:39      -13.612396        10.265469
BFGS:    3 16:57:39      -14.357722         1.554158
BFGS:    4 16:57:40      -14.368986         0.398728
BFGS:    5 16:57:40      -14.369804         0.006728
BFGS:    6 16:57:40      -14.369804         0.000034
BFGS:    7 16:57:40      -14.369804         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.2490891027049356e-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, 2.0859791464549517e-32, -1.2219554479964401e-32], [2.9665934669428446e-32, 3.6062512186473934, -5.2887629473929065e-17], [-2.0086797642610827e-32, -5.2887629473929046e-17, 3.6062512186473934]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.24908910e-10 -1.24908910e-10 -1.24908910e-10  6.51265714e-29
 -3.21814380e-44  1.35617308e-58]
energy per atom =  -7.184901975347249
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0