sisi4s
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sisi4s::BasisSetExtrapolation Member List

This is the complete list of members for sisi4s::BasisSetExtrapolation, including all inherited members.

Algorithm(std::vector< Argument > const &argumentList)sisi4s::Algorithm
allocateContainerArgument(std::string const &argumentName, C *container)sisi4s::Algorithm
allocatedTensorArgument(std::string const &argumentName, T *tensor)sisi4s::Algorithm
argumentssisi4s::Algorithm
BasisSetExtrapolation(std::vector< Argument > const &argumentList)sisi4s::BasisSetExtrapolation
calculateNewSF(int type, real gamma, Tensor< double > *coulombKernel, Tensor< double > *newSF, Tensor< double > *resNewSF)sisi4s::BasisSetExtrapolationprotected
checkArgumentsOrDie(const std::vector< std::string > args) constsisi4s::Algorithminline
dryRun()sisi4s::Algorithmvirtual
evaluateQGG(int orbitalPairStart, int orbtialPairEnd, int slice)sisi4s::BasisSetExtrapolationprotected
falliblesisi4s::Algorithm
fitF12(int type, real minG, real maxG)sisi4s::BasisSetExtrapolationprotected
getArgumentData(std::string const &argumentName)sisi4s::Algorithm
getBooleanArgument(std::string const &name)sisi4s::Algorithm
getBooleanArgument(std::string const &name, bool const &defaultValue)sisi4s::Algorithm
getContainerArgument(std::string const &argumentName)sisi4s::Algorithm
getGivenArgumentNames() constsisi4s::Algorithminline
getIntegerArgument(std::string const &argumentName)sisi4s::Algorithm
getIntegerArgument(std::string const &argumentName, int64_t const defaultValue)sisi4s::Algorithm
getName()sisi4s::BasisSetExtrapolationinlinevirtual
getRealArgument(std::string const &argumentName)sisi4s::Algorithm
getRealArgument(std::string const &argumentName, real const defaultValue)sisi4s::Algorithm
getRealArgumentFromInteger(IntegerData *data)sisi4s::Algorithm
getRealArgumentFromTensor(TensorData< real > *data)sisi4s::Algorithm
getTensorArgument(std::string const &argumentName)sisi4s::Algorithm
getTensorArgumentFromReal(RealData *realData)sisi4s::Algorithm
getTextArgument(std::string const &argumentName)sisi4s::Algorithm
getTextArgument(std::string const &argumentName, std::string const &defaultValue)sisi4s::Algorithm
invertQGG()sisi4s::BasisSetExtrapolationprotected
isArgumentGiven(std::string const &argumentName)sisi4s::Algorithm
notesisi4s::Algorithm
registrar_sisi4s::BasisSetExtrapolationstatic
run()sisi4s::BasisSetExtrapolationvirtual
setIntegerArgument(std::string const &argumentName, int const value)sisi4s::Algorithm
setRealArgument(std::string const &argumentName, real const value)sisi4s::Algorithm
~Algorithm()sisi4s::Algorithmvirtual
~BasisSetExtrapolation()sisi4s::BasisSetExtrapolationvirtual