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
asr
bindings
common
configuration
examples
gui
input_parameters
output_files
outputs
output_definitions
readers
arpes
bsf
default
dos
jxc
scf
spec
sprkkr_output_reader
task_result
physics
potentials
sprkkr
tools
version
ASE2SPRKKR
ase2sprkkr
outputs
readers
scf
IterationValue
View page source
IterationValue
class
ase2sprkkr.outputs.readers.scf.
IterationValue
(
name
,
value
,
plot
)
[source]
Class hierarchy
Constructor
__init__
(
name
,
value
,
plot
)
[source]
plot
(
)
[source]
actions
(
)
[source]