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
bindings
version
config
sprkkr
tools
input_parameters
outputs
potentials
physics
ase
asr
visualise
output_files
common
no_output
directory
formats
alternative_types
backward_compatibility
debug
decorators
doc
init_tests
lazy_string
misc
section_adaptors
tools
unique_values
warnings
yaml
subprocess
parsing_results
dict_from_parsed
ArrayKey
DefDictKey
DictKey
IgnoredKey
Key
RepeatedKey
Result
SubKey
ValidateKey
Values
container_definitions
grammar
process_output_reader
configuration
configuration_containers
configuration_definitions
generated_configuration_definitions
options
repeated_configuration_containers
value_definitions
test
grammar_types
examples
ASE2SPRKKR
ase2sprkkr
common
parsing_results
ArrayKey
View page source
ArrayKey
class
ase2sprkkr.common.parsing_results.
ArrayKey
(
key
,
sub
)
[source]
Class hierarchy
Constructor
__init__
(
key
,
sub
)
class
ResultClass
[source]
NOT_SET
=
<object
object>
result
(
)
[source]
add
(
too
,
val
)
[source]