TSHSSileSiesta

class sisl.io.siesta.TSHSSileSiesta(filename, mode='r')[source]

TranSiesta file object

Attributes

file File of the current Sile

Methods

__init__(filename[, mode]) Creates/Opens a SileBin
exist() Query whether the file exists
read(*args, **kwargs) Generic read method which should be overloaded in child-classes
read_geometry() Returns Geometry object from a siesta.TSHS file
read_hamiltonian(**kwargs) Returns the electronic structure from the siesta.TSHS file
read_supercell() Returns a SuperCell object from a siesta.TSHS file
write(*args, **kwargs) Generic write method which should be overloaded in child-classes
write_hamiltonian(H, **kwargs) Writes the Hamiltonian to a TSHS file
exist()

Query whether the file exists

file

File of the current Sile

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.

read_geometry()[source]

Returns Geometry object from a siesta.TSHS file

read_hamiltonian(**kwargs)[source]

Returns the electronic structure from the siesta.TSHS file

read_supercell()[source]

Returns a SuperCell object from a siesta.TSHS file

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.

write_hamiltonian(H, **kwargs)[source]

Writes the Hamiltonian to a TSHS file