ASE2SPRKKR
Contents
How to use the package
More about the package installation
Philosophy of the package (for developers)
Changelog
Authors
Hastily written ASE2SPRKKR slides
Examples
Links
ASE2SPRKKR homepage
ASE - atomic simulation environment
SPR-KKR
GitHub repository
PyPI package
SPR-KKR manual
Class documentation
ase2sprkkr
promote_ase_atoms
ase
build
_ext_gcd
_fractional_inplane_period
_minimal_surface_layers
_surface_basis
aperiodic_times
flip
flip_around
rotate
shift
stack
io
pbc
register
symbols
visualise
asr
bindings
common
configuration
examples
gui
input_parameters
output_files
outputs
physics
potentials
sprkkr
tools
version
ASE2SPRKKR
ase2sprkkr
ase
build
_surface_basis
View page source
_surface_basis
Full name:
ase2sprkkr.ase.build._surface_basis
ase2sprkkr.ase.build.
_surface_basis
(
cell
,
indices
,
tol
=
1e-10
)
[source]