allocate_soc Subroutine
- Jonathan Chico
-
- profiling, profiling, spin-orbit-coupling, KKRhost
- 38 statements
- Source File
public subroutine allocate_soc(flag, krel, natyp, lmax, socscale, cscl, socscl)
Subroutine handling the allocation/deallocation of arrays that describe the spin-orbit coupling (SOC)
Arguments
| Type | Intent | Optional | Attributes | Name | ||
|---|---|---|---|---|---|---|
| integer, | intent(in) | :: | flag | |||
| integer, | intent(in) | :: | krel | |||
| integer, | intent(in) | :: | natyp |
number of kinds of atoms in unit cell |
||
| integer, | intent(in) | :: | lmax |
Maximum l component in wave function expansion |
||
| real(kind=dp), | intent(inout), | dimension (:), allocatable | :: | socscale |
Spin-orbit scaling |
|
| real(kind=dp), | intent(inout), | dimension (:, :), allocatable | :: | cscl |
Speed of light scaling |
|
| real(kind=dp), | intent(inout), | dimension (:, :), allocatable | :: | socscl |