QMCPACK
EshdfFile Member List

This is the complete list of members for EshdfFile, including all inherited members.

EshdfFile(const EshdfFile &f)EshdfFileprivate
EshdfFile(const std::string &hdfFileName)EshdfFile
getIntsOnly(const std::string &str) constEshdfFileprivate
getNumElectrons(std::vector< std::vector< double >> &occupations, std::vector< double > &weights, int &nup, int &ndn, int spinpol, int ncol)EshdfFileprivate
getOccupation(const XmlNode *nd) constEshdfFileprivate
getPtvs(const XmlNode &qeXml)EshdfFileprivate
handleDensity(const XmlNode &qeXml, const std::string &dir_name, int spinpol)EshdfFileprivate
handleKpt(int kpt_num, const std::string &dir_name, KPoint &kpt, const std::vector< double > &eigenvalues, double weight, int spinpol, int noncol, const momap_t &moref)EshdfFileprivate
handleSpinGroup(const XmlNode *nd, double &nocc, FftContainer &cont)EshdfFileprivate
momap_t typedefEshdfFileprivate
mopair_t typedefEshdfFileprivate
openHdfFileForRead(const std::string &fname)EshdfFileprivate
operator=(const EshdfFile &f)EshdfFileprivate
outfile_EshdfFileprivate
processKPts(const XmlNode &band_structure_xml, const std::vector< double > &ptvs, std::vector< std::vector< double >> &eigenvals, std::vector< std::vector< double >> &occupations, std::vector< KPoint > &kpts, std::vector< double > &weights, std::vector< int > &ngvecs)EshdfFileprivate
readInEigFcn(const XmlNode &nd, FftContainer &cont)EshdfFileprivate
readKptGvecs(int kpt_num, const std::string &dir_name, int spinpol, momap_t &morefmap)EshdfFileprivate
wrapped(int i, int size) constEshdfFileprivate
writeApplication(const std::string &appName, int major, int minor, int sub)EshdfFileprivate
writeCreator()EshdfFileprivate
writeFormat()EshdfFileprivate
writeQboxAtoms(const XmlNode &qboxSample)EshdfFile
writeQboxBoilerPlate(const XmlNode &qboxSample)EshdfFile
writeQboxElectrons(const XmlNode &qboxSample)EshdfFile
writeQboxSupercell(const XmlNode &qboxSample)EshdfFile
writeQEAtoms(const XmlNode &qeXml)EshdfFile
writeQEBoilerPlate(const XmlNode &qeXml)EshdfFile
writeQEElectrons(const XmlNode &qeXml, const std::string &dir_name)EshdfFile
writeQESupercell(const XmlNode &qeXml)EshdfFile
writeVersion()EshdfFileprivate
~EshdfFile()EshdfFile