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
arr_testfce
assertDictEqual
assertListEqual
assert_almost_equals
assert_equals
patch_package
run_sprkkr
testfce
TestCase
extdict
lazy_string
misc
section_adaptors
tools
unique_values
warnings
yaml
subprocess
parsing_results
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
init_tests
assert_almost_equals
View page source
assert_almost_equals
Full name:
ase2sprkkr.common.init_tests.assert_almost_equals
ase2sprkkr.common.init_tests.
assert_almost_equals
(
a
,
b
,
msg
=
''
,
**
kwar
)