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SHRotate.h File Reference

SphericalHarmonics::SHRotate. More...

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Namespaces

namespace  ZFXMath
namespace  ZFXMath::SphericalHarmonics

Functions

int delta (const int m, const int n)
template<class PrecisionType> void uvw (const int l, const int m, const int n, PrecisionType &u, PrecisionType &v, PrecisionType &w)
template<class PrecisionType, class FuncValueType> PrecisionType M (const int l, const int m, const int n, const TRotateMatrix< PrecisionType, FuncValueType > &M)
template<class PrecisionType, class FuncValueType> PrecisionType P (const int i, const int l, const int a, const int b, const TRotateMatrix< PrecisionType, FuncValueType > &M)
template<class PrecisionType, class FuncValueType> PrecisionType U (const int l, const int m, const int n, const TRotateMatrix< PrecisionType, FuncValueType > &M)
template<class PrecisionType, class FuncValueType> PrecisionType V (const int l, const int m, const int n, const TRotateMatrix< PrecisionType, FuncValueType > &M)
template<class PrecisionType, class FuncValueType> PrecisionType W (const int l, const int m, const int n, const TRotateMatrix< PrecisionType, FuncValueType > &M)
template<class PrecisionType, class FuncValueType> void SHRotate (TRotateMatrix< PrecisionType, FuncValueType > &shrm, const TMatrix3x3< PrecisionType > &rotation)
 fill an SHRotateMatrix by an ordinary 4x4-Matrix


Detailed Description

Rotation Matrices for Real Spherical Harmonics. Direct Determination by Recursion Joseph Ivanic and Klaus Ruedenberg J. Phys. Chem. 1996, 100, 6342-5347

Additions and Corrections (to previous paper) Joseph Ivanic and Klaus Ruedenberg J. Phys. Chem. A, 1998, Vol. 102, No. 45, 9099

SHRotate: Function to create an SH-Matrix based on an ordinary 4x4-Matrix


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