votca 2025.1-dev
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votca::xtp::Orb2Fchk Member List

This is the complete list of members for votca::xtp::Orb2Fchk, including all inherited members.

basename_votca::xtp::Orb2Fchkprivate
Calculator()=defaultvotca::tools::Calculator
diff2gs_votca::xtp::Orb2Fchkprivate
Evaluate()votca::xtp::QMTool
Identify() constvotca::xtp::Orb2Fchkinlinevirtual
Initialize(const tools::Property &options) finalvotca::xtp::QMToolvirtual
job_name_votca::xtp::QMToolprotected
log_votca::xtp::Orb2Fchkprivate
maverick_votca::tools::Calculatorprotected
nThreads_votca::tools::Calculatorprotected
Orb2Fchk()=defaultvotca::xtp::Orb2Fchk
orbfile_votca::xtp::Orb2Fchkprivate
Package() const finalvotca::xtp::QMToolinlinevirtual
ParseOptions(const tools::Property &options)votca::xtp::Orb2Fchkprotectedvirtual
QMTool()=defaultvotca::xtp::QMTool
Run()votca::xtp::Orb2Fchkprotectedvirtual
setnThreads(Index nThreads)votca::tools::Calculatorinline
state_votca::xtp::Orb2Fchkprivate
~Calculator()=defaultvotca::tools::Calculatorvirtual
~Orb2Fchk()=defaultvotca::xtp::Orb2Fchk
~QMTool() override=defaultvotca::xtp::QMTool