direct_ci_excit Derived Type

type, public :: direct_ci_excit


Components

Type Visibility Attributes Name Initial
integer, public, allocatable, dimension(:) :: excit_ind
integer, public, allocatable, dimension(:) :: par
integer, public, allocatable, dimension(:, :) :: orbs
integer, public :: nexcit

Source Code

    type direct_ci_excit
        ! The addresses of the excitations.
        integer, allocatable, dimension(:) :: excit_ind
        ! The corresponding parities for the excitations.
        integer, allocatable, dimension(:) :: par
        ! orb(1:2,i) holds the orbitals involved in excitation i.
        integer, allocatable, dimension(:, :) :: orbs
        ! The total number of excitations.
        integer :: nexcit
    end type direct_ci_excit