BaseIntegral_module.f90 File Reference

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Data Types
type	BaseIntegral_module::BaseIntegral
interface	BaseIntegral_module::generic_initialize
interface	BaseIntegral_module::generic_finalize
interface	BaseIntegral_module::generic_load
interface	BaseIntegral_module::generic_get
interface	BaseIntegral_module::generic_geometries
interface	BaseIntegral_module::generic_destroy

Modules
module	BaseIntegral_module
	Base integral module.

Functions/Subroutines
subroutine	BaseIntegral_module::initialize_base (this, option, num_orbitals, mapping)
	Initialize the class.
subroutine	BaseIntegral_module::finalize_base (this)
	Finalize the class.
subroutine	BaseIntegral_module::base_write_header (this, matrix_io, matrix_size)
	Write data file header.
real(wp) function	BaseIntegral_module::get_integralf (this, integral)
	Retrieve integral value.
real(wp) function	BaseIntegral_module::get_core_energy (this)
	Retrieve integral value.
integer function	BaseIntegral_module::get_num_nuclei (this)
	Retrieve integral value.