ASE2SPRKKR
Contents
How to use the package
More about the package installation
Philosophy of the package (for developers)
Changelog
Hastily written ASE2SPRKKR slides
Links
ASE2SPRKKR homepage
ASE - atomic simulation environment
SPR-KKR
GitHub repository
PyPI package
SPR-KKR manual
Class documentation
ase2sprkkr
bindings
xband
empty_spheres
add_empty_spheres
empty_spheres
empty_spheres_atoms
EmptySpheresResult
es_finder
spglib
config
version
sprkkr
tools
input_parameters
outputs
potentials
physics
ase
asr
visualise
output_files
common
ASE2SPRKKR
ase2sprkkr
bindings
empty_spheres
add_empty_spheres
View page source
add_empty_spheres
Full name:
ase2sprkkr.bindings.empty_spheres.add_empty_spheres
ase2sprkkr.bindings.empty_spheres.
add_empty_spheres
(
atoms
,
*
,
copy
=
False
,
**
kwargs
)
[source]