| 4 |
|
call module_setESM(the_ESM) |
| 5 |
|
end subroutine setElectrostaticSummationMethod |
| 6 |
|
|
| 7 |
+ |
subroutine setScreeningMethod(the_SM) |
| 8 |
+ |
use electrostatic_module, ONLY : module_setSM => setScreeningMethod |
| 9 |
+ |
integer,intent(inout) :: the_SM |
| 10 |
+ |
call module_setSM(the_SM) |
| 11 |
+ |
end subroutine setScreeningMethod |
| 12 |
+ |
|
| 13 |
|
subroutine setElectrostaticCutoffRadius(the_rcut, the_rsw) |
| 14 |
|
use electrostatic_module, ONLY : module_setECR => setElectrostaticCutoffRadius |
| 15 |
|
use definitions, ONLY : dp |
| 18 |
|
call module_setECR(the_rcut, the_rsw) |
| 19 |
|
end subroutine setElectrostaticCutoffRadius |
| 20 |
|
|
| 21 |
< |
subroutine setDampedWolfAlpha(the_alpha) |
| 22 |
< |
use electrostatic_module, ONLY : module_setDWA => setDampedWolfAlpha |
| 21 |
> |
subroutine setDampingAlpha(the_alpha) |
| 22 |
> |
use electrostatic_module, ONLY : module_setDA => setDampingAlpha |
| 23 |
|
use definitions, ONLY : dp |
| 24 |
|
real(kind=dp),intent(inout) :: the_alpha |
| 25 |
< |
call module_setDWA(the_alpha) |
| 26 |
< |
end subroutine setDampedWolfAlpha |
| 25 |
> |
call module_setDA(the_alpha) |
| 26 |
> |
end subroutine setDampingAlpha |
| 27 |
|
|
| 28 |
|
subroutine setReactionFieldDielectric(the_dielectric) |
| 29 |
|
use electrostatic_module, ONLY : module_setRFD => setReactionFieldDielectric |
