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votca 2025.1-dev
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This is the complete list of members for votca::xtp::DFTcoupling, including all inherited members.
| Addoutput(tools::Property &type_summary, const Orbitals &orbitalsA, const Orbitals &orbitalsB) const override | votca::xtp::DFTcoupling | virtual |
| CalculateCouplings(const Orbitals &orbitalsA, const Orbitals &orbitalsB, const Orbitals &orbitalsAB) override | votca::xtp::DFTcoupling | virtual |
| CalculateOverlapMatrix(const Orbitals &orbitalsAB) const | votca::xtp::CouplingBase | protected |
| CheckAtomCoordinates(const Orbitals &orbitalsA, const Orbitals &orbitalsB, const Orbitals &orbitalsAB) const | votca::xtp::CouplingBase | protected |
| degeneracy_ | votca::xtp::DFTcoupling | private |
| DetermineRangeOfStates(const Orbitals &orbital, Index numberofstates) const | votca::xtp::DFTcoupling | private |
| getCouplingElement(Index levelA, Index levelB, const Orbitals &orbitalsA, const Orbitals &orbitalsB) const | votca::xtp::DFTcoupling | private |
| Identify() const | votca::xtp::DFTcoupling | inline |
| Initialize(tools::Property &) override | votca::xtp::DFTcoupling | virtual |
| JAB | votca::xtp::DFTcoupling | private |
| numberofstatesA_ | votca::xtp::DFTcoupling | private |
| numberofstatesB_ | votca::xtp::DFTcoupling | private |
| pLog_ | votca::xtp::CouplingBase | protected |
| Range_orbA | votca::xtp::DFTcoupling | private |
| Range_orbB | votca::xtp::DFTcoupling | private |
| setLogger(Logger *pLog) | votca::xtp::CouplingBase | inline |
| WriteToProperty(tools::Property &type_summary, const Orbitals &orbitalsA, const Orbitals &orbitalsB, Index a, Index b) const | votca::xtp::DFTcoupling | private |