gridSileSiesta¶
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class
sisl.io.siesta.
gridSileSiesta
(filename, mode='r', *args, **kwargs)[source]¶ Binary real-space grid file
Attributes
base_file
File of the current Sile file
File of the current Sile Methods
__init__
(filename[, mode])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_grid
([spin])Read grid contained in the Grid file read_supercell
(*args, **kwargs)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_grid
(spin=0, *args, **kwargs)[source]¶ Read grid contained in the Grid file
Parameters: - spin : int or array_like, optional
the spin-index for retrieving one of the components. If a vector is passed it refers to the fraction per indexed component. I.e.
[0.5, 0.5]
will return sum of half the first two components. Default to the first component.
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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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