votca 2024.2-dev
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This is the complete list of members for votca::xtp::QMCalculator, including all inherited members.
Calculator()=default | votca::tools::Calculator | |
Evaluate(Topology &top)=0 | votca::xtp::QMCalculator | protectedpure virtual |
EvaluateFrame(Topology &top) | votca::xtp::QMCalculator | |
Identify() const override=0 | votca::xtp::QMCalculator | pure virtual |
Initialize(const tools::Property &opt) final | votca::xtp::QMCalculator | virtual |
maverick_ | votca::tools::Calculator | protected |
nThreads_ | votca::tools::Calculator | protected |
Package() const final | votca::xtp::QMCalculator | inlinevirtual |
ParseOptions(const tools::Property &opt)=0 | votca::xtp::QMCalculator | protectedpure virtual |
QMCalculator()=default | votca::xtp::QMCalculator | |
setnThreads(Index nThreads) | votca::tools::Calculator | inline |
WriteToStateFile() const =0 | votca::xtp::QMCalculator | pure virtual |
~Calculator()=default | votca::tools::Calculator | virtual |
~QMCalculator() override=default | votca::xtp::QMCalculator |