Slater_Koster_From_TB_Hopping_Parameter Class Reference

Associate Orbitals to Slater-Koster matrix elements. More...

#include <Slater_Koster_From_TB_Hopping_Parameter.h>

Public Types
typedef double(*	fct_type) (const TB_Hopping_Parameter *, double, double, double, double)
typedef double(*	fct_type_noHarrison) (const TB_Hopping_Parameter *, double, double, double)

Static Public Member Functions
static double	s_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	s_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	s_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	sstar_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	sstar_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_s_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_s (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_sstar_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_sstar (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	px_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	px_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	py_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	py_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	pz_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	pz_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_px_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_px (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_py_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_py (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_pz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_pz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxy_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxy_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dyz_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dyz_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dxz_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dxz_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dx2y2_dz2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dx2y2_dz2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_dxy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_dxy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_dyz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_dyz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_dxz_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_dxz (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dz2_dx2y2_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static double	dz2_dx2y2 (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dummy (const TB_Hopping_Parameter *par_typ, double L, double M, double N, double d0overd)
static double	dummy_noHarrison (const TB_Hopping_Parameter *par_typ, double L, double M, double N)
static fct_type	get_hopping (size_t o0, size_t o1)
static fct_type_noHarrison	get_hopping_noHarrison (size_t o0, size_t o1)

Static Public Attributes
static const fct_type	hoppings [20][20]
static const fct_type_noHarrison	hoppings_noHarrison [20][20]

Detailed Description

Associate Orbitals to Slater-Koster matrix elements.

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The documentation for this class was generated from the following files:

• /home/moritz/QNANO_PRODUCTION/qnano_new/include/tightbinding/Slater_Koster_From_TB_Hopping_Parameter.h
• /home/moritz/QNANO_PRODUCTION/qnano_new/sources/tightbinding/Slater_Koster_From_TB_Hopping_Parameter.cc