orbindxSileSiesta¶
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class
sisl.io.siesta.
orbindxSileSiesta
(filename, mode='r', comment=None, *args, **kwargs)[source]¶ Orbital information file
Attributes
base_file
File of the current Sile file
File of the current Sile Methods
__init__
(filename[, mode, comment])Initialize self. dir_file
([filename])File of the current Sile exist
()Query whether the file exists read
(*args, **kwargs)Generic read method which should be overloaded in child-classes read_basis
()Returns a set of atoms corresponding to the basis-sets in the ORB_INDX file read_supercell_nsc
()Reads the supercell number of supercell information write
(*args, **kwargs)Generic write method which should be overloaded in child-classes -
base_file
¶ File of the current Sile
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dir_file
(filename=None)¶ File of the current Sile
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exist
()¶ Query whether the file exists
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file
¶ File of the current Sile
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read
(*args, **kwargs)¶ Generic read method which should be overloaded in child-classes
Parameters: - kwargs :
keyword arguments will try and search for the attribute
read_<>
and call it with the remaining**kwargs
as arguments.
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read_basis
()[source]¶ Returns a set of atoms corresponding to the basis-sets in the ORB_INDX file
The specie names have a short field in the ORB_INDX file, hence the name may not necessarily be the same as provided in the species block
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write
(*args, **kwargs)¶ Generic write method which should be overloaded in child-classes
Parameters: - **kwargs :
keyword arguments will try and search for the attribute write_ and call it with the remaining
**kwargs
as arguments.
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