ASE2SPRKKR
Contents
How to use the package
More about the package installation
Philosophy of the package (for developers)
Changelog
Hastily written ASE2SPRKKR slides
Examples
Links
ASE2SPRKKR homepage
ASE - atomic simulation environment
SPR-KKR
GitHub repository
PyPI package
SPR-KKR manual
Class documentation
ase2sprkkr
ase
asr
bindings
common
configuration
examples
input_parameters
output_files
outputs
physics
lattice_data
international_numbers_to_AP
LatticeData
Pearson
winger_seitz_radii
potentials
sprkkr
tools
version
visualise
ASE2SPRKKR
ase2sprkkr
physics
lattice_data
LatticeData
View page source
LatticeData
class
ase2sprkkr.physics.lattice_data.
LatticeData
(
atoms
)
[source]
Class hierarchy
Constructor
__init__
(
atoms
)
[source]
property
bravais_number
property
shoenflies_symbol