mod_rhocore_kkrimp Module
Subroutines
public subroutine RHOCORE(ISPIN, NSPIN, IATOM, NATOM, CELL, VISP, ZATOM, corestate, density, config, ITSCF)
- License
- Category
- core-electrons, KKRimp
D r i v e r
f o r
t h e
d e n s i t y
f r o m
c o r e
e l e c t r o n s .
Arguments
| Type | Intent | Optional | Attributes | Name | ||
|---|---|---|---|---|---|---|
| integer, | intent(in) | :: | ISPIN | |||
| integer, | intent(in) | :: | NSPIN | |||
| integer, | intent(in) | :: | IATOM | |||
| integer, | intent(in) | :: | NATOM | |||
| type(CELL_TYPE) | :: | CELL | ||||
| real(kind=DP), | intent(in) | :: | VISP(CELL%NRMAX) | |||
| real(kind=DP), | intent(in) | :: | ZATOM | |||
| type(corestate_type) | :: | corestate | ||||
| type(DENSITY_TYPE) | :: | density | ||||
| type(config_type) | :: | config | ||||
| integer | :: | ITSCF |