MPI-SCATCI 2.0
An MPI version of SCATCI
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SWEDEN_Module.F90 File Reference

Go to the source code of this file.

Data Types

type  SWEDEN_module::SWEDENIntegral

Modules

module  SWEDEN_module
 SWEDEN integral module.

Functions/Subroutines

integer function SWEDEN_module::count_num_pairs (this)
subroutine SWEDEN_module::generate_pairs (this)
subroutine SWEDEN_module::generate_pointer_table (this)
subroutine SWEDEN_module::generate_orbital_index (this)
subroutine SWEDEN_module::generate_pair_index (this)
subroutine SWEDEN_module::initialize_SWEDEN (this, option)
subroutine SWEDEN_module::finalize_SWEDEN (this)
subroutine SWEDEN_module::load_integrals_SWEDEN (this, iounit)
 This is just a copy from scatci_routines with only the relevant SWEDEN parts.
real(wp) function SWEDEN_module::get_integral_SWEDEN (this, i, j, k, l, m)
integer function SWEDEN_module::get_one_electron_index (this, i, j, pos)
integer function SWEDEN_module::get_two_electron_index (this, i, j, k, l, m)
subroutine SWEDEN_module::write_geometries_SWEDEN (this, iounit)
subroutine SWEDEN_module::destroy_integral_SWEDEN (this)