eigenvalSileVASP¶
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class
sisl.io.vasp.eigenvalSileVASP(filename, mode='r', comment=None, *args, **kwargs)[source]¶ VASP eigenvalue output
Attributes
base_fileFile of the current Sile fileFile 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_data()Read eigenvalues, as calculated and written by VASP 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**kwargsas arguments.
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read_data()[source]¶ Read eigenvalues, as calculated and written by VASP
Returns: - numpy.ndarray : all eigenvalues, shape
(ns, nk, nb) where
nsnumber of spin-components,nknumber of k-points andnbnumber of bands
- numpy.ndarray : all eigenvalues, shape
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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
**kwargsas arguments.
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