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:
MEAM_LAMMPS_KimShinLee_2008_Ge__MO_657096500078_001
==== 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 16:21:20      -13.284218         0.889213
BFGS:    1 16:21:20      -13.315669         0.760298
BFGS:    2 16:21:20      -13.388067         0.186764
BFGS:    3 16:21:20      -13.392079         0.024648
BFGS:    4 16:21:20      -13.392147         0.000665
BFGS:    5 16:21:20      -13.392147         0.000002
BFGS:    6 16:21:20      -13.392147         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.129472860059988e-11 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 1.84312178e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.84312178e-34]]
cellpar =  Cell([[4.179712837903284, -3.81706006256754e-33, 2.6123189084899917e-33], [3.765695122444168e-33, 4.179712837903284, 9.794102864086123e-18], [-7.6054548133638425e-34, 9.794102864086137e-18, 4.179712837903284]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.12947286e-11 -1.12947286e-11 -1.12947286e-11  2.78741046e-27
  5.87958026e-35 -1.40883582e-50]
energy per atom =  -3.3480367520261707
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0