tblite
Light-weight tight-binding framework
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Public Member Functions
tblite_data_spin::get_spin_constant Interface Reference

Get spin constant for species. More...

Public Member Functions

elemental real(wp) function get_spin_constant_symbol (jang, iang, symbol)
 Get spin constant for species with a given symbol.
 
elemental real(wp) function get_spin_constant_number (jang, iang, number)
 Get spin constant for species with a given atomic number.
 

Detailed Description

Get spin constant for species.

Member Function/Subroutine Documentation

◆ get_spin_constant_number()

elemental real(wp) function tblite_data_spin::get_spin_constant::get_spin_constant_number ( integer, intent(in) jang,
integer, intent(in) iang,
integer, intent(in) number )

Get spin constant for species with a given atomic number.

Parameters
[in]jangAngular momentum of shells
[in]iangAngular momentum of shells
[in]numberAtomic number
Returns
Spin constant

◆ get_spin_constant_symbol()

elemental real(wp) function tblite_data_spin::get_spin_constant::get_spin_constant_symbol ( integer, intent(in) jang,
integer, intent(in) iang,
character(len=*), intent(in) symbol )

Get spin constant for species with a given symbol.

Parameters
[in]jangAngular momentum of shells
[in]iangAngular momentum of shells
[in]symbolElement symbol
Returns
Spin constant

The documentation for this interface was generated from the following file: