normcoeff_so_spinflux Subroutine
- Guillaume Géranton
-
- physical-observables, KKRhost
- 148 statements
- Source File
public subroutine normcoeff_so_spinflux(natom, ircut, lmmax0d, pns, ksra, drdi, mode)
Uses
-
- mod_constants
- global_variables
- mod_datatypes
- mod_types
- mod_mympi
Calculates the KKR matrix elements for the spin flux operator, i.e.,
Note
Details are in http://arxiv.org/pdf/1602.03417v1.pdf
This subroutine was adapted from NORMCOEFF_SO.
Arguments
| Type | Intent | Optional | Attributes | Name | ||
|---|---|---|---|---|---|---|
| integer, | intent(in) | :: | natom | |||
| integer, | intent(in), | dimension(0:ipand, natypd) | :: | ircut |
R points of panel borders |
|
| integer, | intent(in) | :: | lmmax0d |
(LMAX+1)^2 |
||
| complex(kind=dp), | intent(in), | dimension(nspind*lmmax0d, nspind*lmmax0d, irmd, 2, natom) | :: | pns | ||
| integer, | intent(in) | :: | ksra | |||
| real(kind=dp), | intent(in), | dimension(irmd, natypd) | :: | drdi |
Derivative dr/di |
|
| integer, | intent(in) | :: | mode |