This is the complete list of members for votca::xtp::PolarSite, including all inherited members.
| CalculateCartesianMultipole() const | votca::xtp::StaticSite | |
| CalculateSphericalMultipole(const Eigen::Matrix3d &quad_cart) | votca::xtp::StaticSite | static |
| deltaQ_V_ext() const | votca::xtp::PolarSite | inline |
| DipoleChange() const | votca::xtp::PolarSite | |
| eigendamp_invsqrt_ | votca::xtp::PolarSite | private |
| element_ | votca::xtp::StaticSite | protected |
| getCharge() const | votca::xtp::StaticSite | inline |
| getDipole() const final | votca::xtp::PolarSite | virtual |
| getElement() const | votca::xtp::StaticSite | inline |
| getId() const | votca::xtp::StaticSite | inline |
| getPInv() const | votca::xtp::PolarSite | inline |
| getpolarization() const | votca::xtp::PolarSite | inline |
| getPos() const | votca::xtp::StaticSite | inline |
| getRank() const | votca::xtp::StaticSite | inline |
| getSqrtInvEigenDamp() const | votca::xtp::PolarSite | inline |
| id_ | votca::xtp::StaticSite | protected |
| identify() const final | votca::xtp::PolarSite | inlinevirtual |
| Induced_Dipole() const | votca::xtp::PolarSite | inline |
| induced_dipole_ | votca::xtp::PolarSite | private |
| InternalEnergy() const | votca::xtp::PolarSite | inline |
| operator<<(std::ostream &out, const PolarSite &site) | votca::xtp::PolarSite | friend |
| pinv_ | votca::xtp::PolarSite | private |
| PolarSite(Index id, std::string element, Eigen::Vector3d pos) | votca::xtp::PolarSite | |
| PolarSite(Index id, std::string element) | votca::xtp::PolarSite | inline |
| PolarSite(const data &d) | votca::xtp::PolarSite | |
| pos_ | votca::xtp::StaticSite | protected |
| Q() const | votca::xtp::StaticSite | inline |
| Q_ | votca::xtp::StaticSite | protected |
| rank_ | votca::xtp::StaticSite | protected |
| ReadData(StaticSite::data &d)=delete | votca::xtp::PolarSite | |
| ReadData(const data &d) | votca::xtp::PolarSite | |
| votca::xtp::StaticSite::ReadData(const data &d) | votca::xtp::StaticSite | |
| Reset() | votca::xtp::PolarSite | inline |
| Rotate(const Eigen::Matrix3d &R, const Eigen::Vector3d &ref_pos) final | votca::xtp::PolarSite | inlinevirtual |
| setCharge(double q) | votca::xtp::StaticSite | inline |
| setInduced_Dipole(const Eigen::Vector3d &induced_dipole) | votca::xtp::PolarSite | inline |
| setMultipole(const Vector9d &multipole, Index rank) | votca::xtp::StaticSite | inline |
| setpolarization(const Eigen::Matrix3d &pol) final | votca::xtp::PolarSite | virtual |
| setPos(const Eigen::Vector3d &position) | votca::xtp::StaticSite | inline |
| SetupCptTable(CptTable &table) | votca::xtp::PolarSite | static |
| StaticSite(Index id, std::string element, Eigen::Vector3d pos) | votca::xtp::StaticSite | inline |
| StaticSite(Index id, std::string element) | votca::xtp::StaticSite | inline |
| StaticSite(const data &d) | votca::xtp::StaticSite | inline |
| StaticSite(const QMAtom &atom, double charge) | votca::xtp::StaticSite | inline |
| StaticSite()=default | votca::xtp::StaticSite | protected |
| Translate(const Eigen::VectorXd &shift) | votca::xtp::StaticSite | |
| V() const | votca::xtp::PolarSite | inline |
| V() | votca::xtp::PolarSite | inline |
| V_ | votca::xtp::PolarSite | private |
| V_noE() const | votca::xtp::PolarSite | inline |
| V_noE() | votca::xtp::PolarSite | inline |
| V_noE_ | votca::xtp::PolarSite | private |
| WriteData(StaticSite::data &d) const =delete | votca::xtp::PolarSite | |
| WriteData(data &d) const | votca::xtp::PolarSite | |
| WriteMpsLine(std::string unit="bohr") const | votca::xtp::StaticSite | |
| writepolarization() const final | votca::xtp::PolarSite | privatevirtual |
| ~PolarSite() final=default | votca::xtp::PolarSite | |
| ~StaticSite()=default | votca::xtp::StaticSite | virtual |
1.12.0