Inheritance diagram for YlmRealTest:

Collaboration diagram for YlmRealTest:

Protected Member Functions
double	norm (const double &x, const double &y, const double &z)

double	y00 (const double &x, const double &y, const double &z)

double	y10 (const double &x, const double &y, const double &z)

double	y11 (const double &x, const double &y, const double &z)

double	y1m1 (const double &x, const double &y, const double &z)

double	y20 (const double &x, const double &y, const double &z)

double	y21 (const double &x, const double &y, const double &z)

double	y2m1 (const double &x, const double &y, const double &z)

double	y22 (const double &x, const double &y, const double &z)

double	y2m2 (const double &x, const double &y, const double &z)

double	y30 (const double &x, const double &y, const double &z)

double	y31 (const double &x, const double &y, const double &z)

double	y3m1 (const double &x, const double &y, const double &z)

double	y32 (const double &x, const double &y, const double &z)

double	y3m2 (const double &x, const double &y, const double &z)

double	y33 (const double &x, const double &y, const double &z)

double	y3m3 (const double &x, const double &y, const double &z)

double	y40 (const double &x, const double &y, const double &z)

double	y41 (const double &x, const double &y, const double &z)

double	y4m1 (const double &x, const double &y, const double &z)

double	y42 (const double &x, const double &y, const double &z)

double	y4m2 (const double &x, const double &y, const double &z)

double	y43 (const double &x, const double &y, const double &z)

double	y4m3 (const double &x, const double &y, const double &z)

double	y44 (const double &x, const double &y, const double &z)

double	y4m4 (const double &x, const double &y, const double &z)

void	SetUp ()

void	TearDown ()

Protected Attributes
int	lmax = 7

int	ng = 4

int	nylm = 64

ModuleBase::matrix	ylm

ModuleBase::matrix *	dylm

ModuleBase::Vector3< double > *	g

double *	ref

double *	rly

double(*	rlgy )[3]

std::vector< double >	rlyvector

ModuleBase::Array_Pool< double >	rlgyvector

double	rlgyref [4][64][3]

Detailed Description

For lmax <5 cases, the reference values are calculated by the formula from https://formulasearchengine.com/wiki/Table_of_spherical_harmonics. Note, these formula lack of the Condon–Shortley phase (-1)^m, and in this unit test, item (-1)^m is multiplied. For lmax >=5, the reference values are calculated by YlmReal::Ylm_Real.

Tested functions of class YlmReal
- Ylm_Real
- Ylm_Real2
- rlylm
- YlmRealTemplate (double and float)
Tested functions of class Ylm
- get_ylm_real
- sph_harm
- rl_sph_harm
- grad_rl_sph_harm
- equality_value_test: test the eqaulity of Ylm function between rl_sph_harm (spherical input) and get_ylm_real (Cartesian input)
- equality_gradient_test:test the eqaulity of Ylm gradient function between grad_rl_sph_harm(spherical input) and rlylm (Cartesian input)

Member Function Documentation

◆ norm()

double YlmRealTest::norm	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the caller graph for this function:

◆ SetUp()

void YlmRealTest::SetUp ( )

inlineprotected

Here is the call graph for this function:

◆ TearDown()

void YlmRealTest::TearDown ( )

inlineprotected

◆ y00()

double YlmRealTest::y00	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the caller graph for this function:

◆ y10()

double YlmRealTest::y10	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y11()

double YlmRealTest::y11	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y1m1()

double YlmRealTest::y1m1	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y20()

double YlmRealTest::y20	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y21()

double YlmRealTest::y21	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y22()

double YlmRealTest::y22	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y2m1()

double YlmRealTest::y2m1	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y2m2()

double YlmRealTest::y2m2	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y30()

double YlmRealTest::y30	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y31()

double YlmRealTest::y31	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y32()

double YlmRealTest::y32	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y33()

double YlmRealTest::y33	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y3m1()

double YlmRealTest::y3m1	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y3m2()

double YlmRealTest::y3m2	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y3m3()

double YlmRealTest::y3m3	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y40()

double YlmRealTest::y40	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y41()

double YlmRealTest::y41	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y42()

double YlmRealTest::y42	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y43()

double YlmRealTest::y43	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y44()

double YlmRealTest::y44	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y4m1()

double YlmRealTest::y4m1	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y4m2()

double YlmRealTest::y4m2	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y4m3()

double YlmRealTest::y4m3	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

◆ y4m4()

double YlmRealTest::y4m4	(	const double &	x,
		const double &	y,
		const double &	z
	)

inlineprotected

Here is the call graph for this function:

Here is the caller graph for this function:

Member Data Documentation

◆ dylm

ModuleBase::matrix* YlmRealTest::dylm

protected

◆ g

ModuleBase::Vector3<double>* YlmRealTest::g

protected

◆ lmax

int YlmRealTest::lmax = 7

protected

◆ ng

int YlmRealTest::ng = 4

protected

◆ nylm

int YlmRealTest::nylm = 64

protected

◆ ref

double* YlmRealTest::ref

protected

◆ rlgy

double(* YlmRealTest::rlgy)[3]

protected

◆ rlgyref

double YlmRealTest::rlgyref[4][64][3]

protected

◆ rlgyvector

ModuleBase::Array_Pool<double> YlmRealTest::rlgyvector

protected

◆ rly

double* YlmRealTest::rly

protected

◆ rlyvector

std::vector<double> YlmRealTest::rlyvector

protected

◆ ylm

ModuleBase::matrix YlmRealTest::ylm

protected

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

/home/runner/work/abacus-develop/abacus-develop/source/source_base/test/math_ylmreal_test.cpp

Protected Member Functions

Protected Attributes

Detailed Description

Member Function Documentation

◆ norm()

◆ SetUp()

◆ TearDown()

◆ y00()

◆ y10()

◆ y11()

◆ y1m1()

◆ y20()

◆ y21()

◆ y22()

◆ y2m1()

◆ y2m2()

◆ y30()

◆ y31()

◆ y32()

◆ y33()

◆ y3m1()

◆ y3m2()

◆ y3m3()

◆ y40()

◆ y41()

◆ y42()

◆ y43()

◆ y44()

◆ y4m1()

◆ y4m2()

◆ y4m3()

◆ y4m4()

Member Data Documentation

◆ dylm

◆ g

◆ lmax

◆ ng

◆ nylm

◆ ref

◆ rlgy

◆ rlgyref

◆ rlgyvector

◆ rly

◆ rlyvector

◆ ylm