dipelm_types::continuum Interface Reference
Holds set of continuum states. More...
Collaboration diagram for dipelm_types::continuum:
Public Member Functions | |
| procedure, pass | print => print_continuum |
| type(continuum) function | new_continuum (nsym, ni, nc, ne, nmc) |
Public Attributes | |
| integer, dimension(:), allocatable | stot |
| Spin of each component. More... | |
| integer, dimension(:), allocatable | mtot |
| Symmetry of each component. More... | |
| integer, dimension(:), allocatable | gutot |
| Gerade/ungerade character of each component. More... | |
| type(channels) | channels |
| Specifies the photoionizations channels. More... | |
| integer, dimension(:), allocatable | moment_components |
| The moment components that couple intial bound state of the neutral with each component present in the continuum states (size = 3 for dipoles, 5 for quadrupoles, 8 for both). More... | |
| real(idp), dimension(:), allocatable | energies |
| Energy of each continuum state (Hartree) More... | |
Detailed Description
Holds set of continuum states.
A continuum state with a particular energy is decomposed into one or more symmetry components labelled by the three arrays stot, mtot and gutot. Each components is further decomposed into partial wave channels. Currently
Member Function/Subroutine Documentation
◆ new_continuum()
| type(continuum) function dipelm_types::continuum::new_continuum | ( | integer | nsym, |
| integer, optional | ni, | ||
| integer, optional | nc, | ||
| integer, optional | ne, | ||
| integer, optional | nmc | ||
| ) |
◆ print()
| procedure, pass dipelm_types::continuum::print |
Here is the call graph for this function:
Member Data Documentation
◆ channels
| type(channels) dipelm_types::continuum::channels |
Specifies the photoionizations channels.
◆ energies
| real(idp), dimension(:), allocatable dipelm_types::continuum::energies |
Energy of each continuum state (Hartree)
◆ gutot
| integer, dimension(:), allocatable dipelm_types::continuum::gutot |
Gerade/ungerade character of each component.
◆ moment_components
| integer, dimension(:), allocatable dipelm_types::continuum::moment_components |
The moment components that couple intial bound state of the neutral with each component present in the continuum states (size = 3 for dipoles, 5 for quadrupoles, 8 for both).
- Todo:
- Perhaps this should be moved into the moments type
◆ mtot
| integer, dimension(:), allocatable dipelm_types::continuum::mtot |
Symmetry of each component.
◆ stot
| integer, dimension(:), allocatable dipelm_types::continuum::stot |
Spin of each component.
The documentation for this interface was generated from the following file:
- /home/jacob/Work/codes/UKRmol/gitlab/ukrmol-out/source/dipelm/dipelm_types.f90
