Vector3 Class Reference

#include <linalg3.h>

List of all members.

Public Member Functions
	Vector3 ()
double	operator[] (int i) const
double &	operator[] (int i)
	Vector3 (double a, double b, double c)
	Vector3 (const double a[])
Vector3	operator+ (const Vector3 &a) const
Vector3	operator- (Vector3 &a) const
Vector3	operator* (double b) const
Vector3	operator/ (double b) const
void	add (Vector3 &a, Vector3 &b)
void	subtract (Vector3 &a, Vector3 &b)
void	addnv (double a, const Vector3 &b)
void	invert ()
void	subint ()
double	norm2 () const
double	norm () const
void	clear ()
double	operator* (const Vector3 &a) const
void	operator+= (double b)
void	operator-= (double b)
void	operator*= (double b)
void	operator/= (double b)
void	operator+= (const Vector3 &a)
void	operator-= (const Vector3 &a)
void	operator*= (const Vector3 &a)
void	operator/= (const Vector3 &a)
void	set (const double a, const double b, const double c)
void	set (const double a[])
void	add (const double a, const double b, const double c)
void	copytoarray (double a[]) const
Vector3	sq () const
Vector3	sqroot () const
Vector3 &	orth (Vector3 &a)
Vector3 &	proj (Vector3 &a)
Public Attributes
double	x
double	y
double	z
Friends
double	dot (Vector3 &a, Vector3 &b)
Vector3	cross (Vector3 &a, Vector3 &b)
Vector3	schmidt (Vector3 &a, Vector3 &b)
LOStream &	operator<< (LOStream &os, const Vector3 &a)
LIStream &	operator>> (LIStream &is, Vector3 &a)

---

Detailed Description

Definition at line 18 of file linalg3.h.

---

Constructor & Destructor Documentation

Vector3::Vector3

(

)

[inline]

Definition at line 22 of file linalg3.h.

Vector3::Vector3	(	double	a,
		double	b,
		double	c
	)			[inline]

Definition at line 25 of file linalg3.h.

Vector3::Vector3

(

const double

a[]

)

[inline]

Definition at line 26 of file linalg3.h.

References x, y, and z.

---

Member Function Documentation

void Vector3::add	(	const double	a,
		const double	b,
		const double	c
	)			[inline]

Definition at line 71 of file linalg3.h.

References x, y, and z.

void Vector3::add	(	Vector3 &	a,
		Vector3 &	b
	)			[inline]

Definition at line 37 of file linalg3.h.

References x, y, and z.

void Vector3::addnv	(	double	a,
		const Vector3 &	b
	)			[inline]

Definition at line 39 of file linalg3.h.

References x, y, and z.

Referenced by SWFrame::stillinger_weber().

void Vector3::clear

(

)

[inline]

Definition at line 44 of file linalg3.h.

References x, y, and z.

Referenced by ALGLUEFrame::al_glue(), BKSFrame::bks_mod(), BMBFrame::born_meyer_buckingham(), MDFrame::CE_Real(), MDFrame::CE_Rec(), SIEDIPFrame::edip(), FSFrame::finnis_sinclair(), XGeo::getlineendpoints(), XGeo::getxline(), XGeo::getxpoint(), LJFrame::lennard_jones(), LJ2Frame::lennard_jones_2(), LJBONDFrame::lennard_jones_bond(), LJDIMERFrame::lennard_jones_dimer(), MDFrame::PME_Rec(), proj(), EAMFrame::rhoeam(), MEAMFrame::rhoMEAM(), RODSFrame::rods_potential(), UnitCell::set(), SWFrame::stillinger_weber(), SWFrame::stillinger_weber_energyonly(), TersoffFrame::tersoff(), and UnitCell::UnitCell().

void Vector3::copytoarray

(

double

a[]

)

const [inline]

Definition at line 72 of file linalg3.h.

References x, y, and z.

void Vector3::invert

(

)

[inline]

Definition at line 40 of file linalg3.h.

References x, y, and z.

double Vector3::norm

(

)

const [inline]

Definition at line 43 of file linalg3.h.

References x, y, and z.

Referenced by MDFrame::calcrystalorder(), RODSFrame::connect_nodes(), MDFrame::DFS(), MDFrame::DFS1(), XGeo::drawBox(), XGeo::drawVectors(), Matrix33::height(), LJDIMERFrame::lennard_jones_dimer_constrained(), LJBONDFrame::makelipids(), Matrix33::reorient(), and Converter::writepdb().

double Vector3::norm2

(

)

const [inline]

Definition at line 42 of file linalg3.h.

References x, y, and z.

Referenced by ALGLUEFrame::al_glue(), BKSFrame::bks_mod(), BMBFrame::born_meyer_buckingham(), MDFrame::CE_Real(), MEAMFrame::dscreen(), MEAMFrame::dscrfor(), SIEDIPFrame::edip(), FSFrame::finnis_sinclair(), XGeo::getlineendpoints(), XGeo::getxline(), EAMFrame::kraeam(), MEAMFrame::kraMEAM(), LJFrame::lennard_jones(), LJ2Frame::lennard_jones_2(), LJBONDFrame::lennard_jones_bond(), LJDIMERFrame::lennard_jones_dimer(), orth(), proj(), EAMFrame::rhoeam(), MEAMFrame::rhoMEAM(), RODSFrame::rods_potential(), MEAMFrame::screen(), SWFrame::stillinger_weber(), SWFrame::stillinger_weber_energyonly(), TersoffFrame::tersoff(), and MDFrame::VVerlet_Get_Tinst().

double Vector3::operator*

(

const Vector3 &

a

)

const [inline]

Definition at line 46 of file linalg3.h.

References x, y, and z.

Vector3 Vector3::operator*

(

double

b

)

const [inline]

Definition at line 32 of file linalg3.h.

References x, y, and z.

void Vector3::operator*=

(

const Vector3 &

a

)

[inline]

Definition at line 65 of file linalg3.h.

References x, y, and z.

void Vector3::operator*=

(

double

b

)

[inline]

Definition at line 61 of file linalg3.h.

References x, y, and z.

Vector3 Vector3::operator+

(

const Vector3 &

a

)

const [inline]

Definition at line 28 of file linalg3.h.

References x, y, and z.

void Vector3::operator+=

(

const Vector3 &

a

)

[inline]

Definition at line 63 of file linalg3.h.

References x, y, and z.

void Vector3::operator+=

(

double

b

)

[inline]

Definition at line 59 of file linalg3.h.

References x, y, and z.

Vector3 Vector3::operator-

(

Vector3 &

a

)

const [inline]

Definition at line 30 of file linalg3.h.

References x, y, and z.

void Vector3::operator-=

(

const Vector3 &

a

)

[inline]

Definition at line 64 of file linalg3.h.

References x, y, and z.

void Vector3::operator-=

(

double

b

)

[inline]

Definition at line 60 of file linalg3.h.

References x, y, and z.

Vector3 Vector3::operator/

(

double

b

)

const [inline]

Definition at line 34 of file linalg3.h.

References x, y, and z.

void Vector3::operator/=

(

const Vector3 &

a

)

[inline]

Definition at line 66 of file linalg3.h.

References x, y, and z.

void Vector3::operator/=

(

double

b

)

[inline]

Definition at line 62 of file linalg3.h.

References x, y, and z.

double& Vector3::operator[]

(

int

i

)

[inline]

Definition at line 24 of file linalg3.h.

References x.

double Vector3::operator[]

(

int

i

)

const [inline]

Definition at line 23 of file linalg3.h.

References x.

Vector3& Vector3::orth

(

Vector3 &

a

)

[inline]

Definition at line 76 of file linalg3.h.

References norm2(), x, y, and z.

Vector3& Vector3::proj

(

Vector3 &

a

)

[inline]

Definition at line 87 of file linalg3.h.

References clear(), norm2(), x, y, and z.

void Vector3::set

(

const double

a[]

)

[inline]

Definition at line 70 of file linalg3.h.

References x, y, and z.

void Vector3::set	(	const double	a,
		const double	b,
		const double	c
	)			[inline]

Definition at line 69 of file linalg3.h.

References x, y, and z.

Referenced by XGeo::drawBox(), XGeo::drawLines(), XGeo::drawPlanes(), XGeo::drawVectors(), XGeo::drawXlines(), XGeo::drawXpoints(), SIEDIPFrame::edip(), RODSFrame::final_structure(), Matrix33::height(), RODSFrame::init_structure(), LJBONDFrame::makelipids(), MEAMFrame::MEAM(), UnitCell::operator*(), Matrix33::reorient(), MEAMFrame::rhoMEAM(), and Converter::writepdb().

Vector3 Vector3::sq

(

)

const [inline]

Definition at line 73 of file linalg3.h.

References x, y, and z.

Vector3 Vector3::sqroot

(

)

const [inline]

Definition at line 74 of file linalg3.h.

References x, y, and z.

void Vector3::subint

(

)

[inline]

Definition at line 41 of file linalg3.h.

References x, y, and z.

Referenced by ALGLUEFrame::al_glue(), BKSFrame::bks_mod(), BMBFrame::born_meyer_buckingham(), MDFrame::calcrystalorder(), MDFrame::CE_Real(), MDFrame::DFS(), MDFrame::DFS1(), MEAMFrame::dscreen(), MEAMFrame::dscrfor(), SIEDIPFrame::edip(), FSFrame::finnis_sinclair(), EAMFrame::kraeam(), MEAMFrame::kraMEAM(), LJFrame::lennard_jones(), LJ2Frame::lennard_jones_2(), LJBONDFrame::lennard_jones_bond(), LJDIMERFrame::lennard_jones_dimer(), LJDIMERFrame::lennard_jones_dimer_constrained(), RODSFrame::plot(), EAMFrame::rhoeam(), MEAMFrame::rhoMEAM(), MEAMFrame::screen(), SWFrame::stillinger_weber(), SWFrame::stillinger_weber_energyonly(), TersoffFrame::tersoff(), and Converter::writepdb().

void Vector3::subtract	(	Vector3 &	a,
		Vector3 &	b
	)			[inline]

Definition at line 38 of file linalg3.h.

References x, y, and z.

Referenced by SWFrame::stillinger_weber(), SWFrame::stillinger_weber_energyonly(), and TersoffFrame::tersoff().

---

Friends And Related Function Documentation

Vector3 cross	(	Vector3 &	a,
		Vector3 &	b
	)			[friend]

Definition at line 105 of file linalg3.h.

double dot	(	Vector3 &	a,
		Vector3 &	b
	)			[friend]

Definition at line 99 of file linalg3.h.

LOStream& operator<<	(	LOStream &	os,
		const Vector3 &	a
	)			[friend]

Definition at line 133 of file linalg3.h.

LIStream& operator>>	(	LIStream &	is,
		Vector3 &	a
	)			[friend]

Definition at line 138 of file linalg3.h.

Vector3 schmidt	(	Vector3 &	a,
		Vector3 &	b
	)			[friend]

Definition at line 113 of file linalg3.h.

---

Member Data Documentation

double Vector3::x

Definition at line 21 of file linalg3.h.

Referenced by add(), addnv(), Matrix33::addnvv(), MDFrame::calcrystalorder(), MDFrame::CE_Rec(), clear(), copytoarray(), MEAMFrame::dscrfor(), SIEDIPFrame::edip(), invert(), MEAMFrame::MEAM(), Matrix33::multiply(), norm(), norm2(), UnitCell::operator*(), Matrix33::operator*(), operator*(), operator*=(), operator+(), operator+=(), operator-(), operator-=(), operator/(), operator/=(), operator[](), orth(), RODSFrame::plot(), MDFrame::PME_Rec(), proj(), UnitCell::set(), set(), sq(), sqroot(), SWFrame::stillinger_weber(), subint(), subtract(), UnitCell::UnitCell(), Vector3(), Converter::writepdb(), and RODSFrame::zero_com_rotation().

double Vector3::y

Definition at line 21 of file linalg3.h.

Referenced by add(), addnv(), Matrix33::addnvv(), MDFrame::calcrystalorder(), MDFrame::CE_Rec(), clear(), copytoarray(), MEAMFrame::dscrfor(), SIEDIPFrame::edip(), invert(), MEAMFrame::MEAM(), Matrix33::multiply(), norm(), norm2(), UnitCell::operator*(), Matrix33::operator*(), operator*(), operator*=(), operator+(), operator+=(), operator-(), operator-=(), operator/(), operator/=(), orth(), RODSFrame::plot(), MDFrame::PME_Rec(), proj(), UnitCell::set(), set(), sq(), sqroot(), SWFrame::stillinger_weber(), subint(), subtract(), UnitCell::UnitCell(), Vector3(), Converter::writepdb(), and RODSFrame::zero_com_rotation().

double Vector3::z

Definition at line 21 of file linalg3.h.

Referenced by add(), addnv(), Matrix33::addnvv(), MDFrame::calcrystalorder(), MDFrame::CE_Rec(), clear(), copytoarray(), MEAMFrame::dscrfor(), SIEDIPFrame::edip(), invert(), MEAMFrame::MEAM(), Matrix33::multiply(), norm(), norm2(), UnitCell::operator*(), Matrix33::operator*(), operator*(), operator*=(), operator+(), operator+=(), operator-(), operator-=(), operator/(), operator/=(), orth(), RODSFrame::plot(), MDFrame::PME_Rec(), proj(), UnitCell::set(), set(), sq(), sqroot(), SWFrame::stillinger_weber(), subint(), subtract(), UnitCell::UnitCell(), Vector3(), Converter::writepdb(), and RODSFrame::zero_com_rotation().

---

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

• My Documents/Codes/MD++.svn/trunk/src/linalg3.h