v_ks_oct_m::v_ks_t Type Reference

Detailed Description

Definition at line 222 of file v_ks.F90.

Public Attributes
integer, public	theory_level = -1
logical, public	frozen_hxc = .false.
	For RPA and SAE calculations. More...
integer, public	xc_family = 0
	the XC stuff More...
integer, public	xc_flags = 0
	the XC flags More...
integer, public	xc_photon = 0
	selected QEDFT xc functional More...
type(xc_t), public	xc
type(xc_photons_t), public	xc_photons
type(xc_oep_t), public	oep
type(xc_oep_photon_t), public	oep_photon
type(xc_ks_inversion_t), public	ks_inversion
type(xc_sic_t), public	sic
type(xc_vdw_t), public	vdw
type(grid_t), pointer, public	gr
logical, public	has_photons = .false.
real(real64), dimension(3, 3), public	stress_xc_gga
	Beyond LDA contribution to the xc stress tensor. More...
type(photon_mode_t), pointer, public	pt => null()
type(mf_t), public	pt_mx

Private Attributes
type(v_ks_calc_t)	calc
logical	calculate_current = .false.
type(current_t)	current_calculator
logical	include_td_field = .false.
logical	xc_photon_include_hartree = .true.

Member Data Documentation

theory_level

integer, public v_ks_oct_m::v_ks_t::theory_level = -1

Definition at line 224 of file v_ks.F90.

frozen_hxc

logical, public v_ks_oct_m::v_ks_t::frozen_hxc = .false.

For RPA and SAE calculations.

Definition at line 225 of file v_ks.F90.

xc_family

integer, public v_ks_oct_m::v_ks_t::xc_family = 0

the XC stuff

Definition at line 227 of file v_ks.F90.

xc_flags

integer, public v_ks_oct_m::v_ks_t::xc_flags = 0

the XC flags

Definition at line 228 of file v_ks.F90.

xc_photon

integer, public v_ks_oct_m::v_ks_t::xc_photon = 0

selected QEDFT xc functional

Definition at line 229 of file v_ks.F90.

xc

type(xc_t), public v_ks_oct_m::v_ks_t::xc

Definition at line 230 of file v_ks.F90.

xc_photons

type(xc_photons_t), public v_ks_oct_m::v_ks_t::xc_photons

Definition at line 231 of file v_ks.F90.

oep

type(xc_oep_t), public v_ks_oct_m::v_ks_t::oep

Definition at line 232 of file v_ks.F90.

oep_photon

type(xc_oep_photon_t), public v_ks_oct_m::v_ks_t::oep_photon

Definition at line 233 of file v_ks.F90.

ks_inversion

type(xc_ks_inversion_t), public v_ks_oct_m::v_ks_t::ks_inversion

Definition at line 234 of file v_ks.F90.

sic

type(xc_sic_t), public v_ks_oct_m::v_ks_t::sic

Definition at line 235 of file v_ks.F90.

vdw

type(xc_vdw_t), public v_ks_oct_m::v_ks_t::vdw

Definition at line 236 of file v_ks.F90.

gr

type(grid_t), pointer, public v_ks_oct_m::v_ks_t::gr

Definition at line 237 of file v_ks.F90.

calc

type(v_ks_calc_t) v_ks_oct_m::v_ks_t::calc

private

Definition at line 238 of file v_ks.F90.

calculate_current

logical v_ks_oct_m::v_ks_t::calculate_current = .false.

private

Definition at line 239 of file v_ks.F90.

current_calculator

type(current_t) v_ks_oct_m::v_ks_t::current_calculator

private

Definition at line 240 of file v_ks.F90.

include_td_field

logical v_ks_oct_m::v_ks_t::include_td_field = .false.

private

Definition at line 241 of file v_ks.F90.

has_photons

logical, public v_ks_oct_m::v_ks_t::has_photons = .false.

Definition at line 242 of file v_ks.F90.

xc_photon_include_hartree

logical v_ks_oct_m::v_ks_t::xc_photon_include_hartree = .true.

private

Definition at line 243 of file v_ks.F90.

stress_xc_gga

real(real64), dimension(3, 3), public v_ks_oct_m::v_ks_t::stress_xc_gga

Beyond LDA contribution to the xc stress tensor.

Definition at line 245 of file v_ks.F90.

pt

type(photon_mode_t), pointer, public v_ks_oct_m::v_ks_t::pt => null()

Definition at line 246 of file v_ks.F90.

pt_mx

type(mf_t), public v_ks_oct_m::v_ks_t::pt_mx

Definition at line 247 of file v_ks.F90.

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The documentation for this type was generated from the following file:

• electrons/v_ks.F90