Scine::Sparrow  3.1.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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Scine::Sparrow::AnalyticalDipoleIntegralOverGTOsCalculator Class Reference
Collaboration diagram for Scine::Sparrow::AnalyticalDipoleIntegralOverGTOsCalculator:
Collaboration graph

Public Member Functions

 AnalyticalDipoleIntegralOverGTOsCalculator (int angularMomentumA, int angulatMomentumB, double expA, double expB, const Eigen::Vector3d &Ra, const Eigen::Vector3d &Rb, const Eigen::Vector3d &evaluationCoordinate)
 
std::array< double, 3 > calculateAnalyticalDipoleElement ()
 
The documentation for this class was generated from the following files: