JDFTx  1.7.0
ElecInfo Member List

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

BzElecInfo
CommandElecInitialCharge (defined in ElecInfo)ElecInfofriend
CommandElecInitialFillings (defined in ElecInfo)ElecInfofriend
CommandElecInitialMagnetization (defined in ElecInfo)ElecInfofriend
CommandInitialState (defined in ElecInfo)ElecInfofriend
CommandKpointFolding (defined in ElecInfo)ElecInfofriend
DefectSupercell (defined in ElecInfo)ElecInfofriend
dumpFCI(const Everything &e, const char *filename)ElecInfofriend
ElecInfo() (defined in ElecInfo)ElecInfo
ElecVars (defined in ElecInfo)ElecInfofriend
Everything (defined in ElecInfo)ElecInfofriend
FillingsConst enum valueElecInfo
FillingsHsub enum valueElecInfo
fillingsUpdateElecInfo
FillingsUpdate enum nameElecInfo
findHOMO(int q) constElecInfo
findMu(const std::vector< diagMatrix > &eps, double nElectrons, double &Bz) constElecInfo
hasU (defined in ElecInfo)ElecInfo
initialFillingsFilenameElecInfo
isMine(int q) constElecInfoinline
isNoncollinear() const (defined in ElecInfo)ElecInfoinline
kFoldingCount() const (defined in ElecInfo)ElecInfoinline
kpointPrint(FILE *fp, int q, bool printSpin=false) constElecInfo
kpointsPrint(FILE *fp, bool printSpin=false) constElecInfo
LCAOminimizer (defined in ElecInfo)ElecInfofriend
muElecInfo
muEff(double mu, double Bz, int q) constElecInfoinline
muLoopElecInfo
nBands (defined in ElecInfo)ElecInfo
nDensities (defined in ElecInfo)ElecInfo
nElectronsElecInfo
nElectronsCalc(double mu, const std::vector< diagMatrix > &eps, double &Bz) constElecInfo
nSpins() const (defined in ElecInfo)ElecInfoinline
nStatesElecInfo
Phonon (defined in ElecInfo)ElecInfofriend
printFillings(FILE *fp) const (defined in ElecInfo)ElecInfo
qnumsElecInfo
qStart (defined in ElecInfo)ElecInfo
qStartOther(int iProc) constElecInfoinline
qStopElecInfo
qStopOther(int iProc) constElecInfoinline
qWeightSumElecInfo
read(std::vector< diagMatrix > &, const char *fname, int nRowsOverride=0) constElecInfo
read(std::vector< matrix > &, const char *fname, int nRowsOverride=0, int nColsOverride=0) constElecInfo
read(std::vector< class ColumnBundle > &, const char *fname, const ColumnBundleReadConversion *conversion=0) constElecInfo
scalarFillingsElecInfo
setup(const Everything &e, std::vector< diagMatrix > &F, Energies &ener)ElecInfo
smear(double mu, double eps) constElecInfo
smear(double mu, const diagMatrix &eps) constElecInfo
smearEntropy(double mu, double eps) constElecInfo
smearEntropy(double mu, const diagMatrix &eps) constElecInfo
smearGrad(double mu, const diagMatrix &eps, const matrix &gradF) constElecInfo
SmearingCold enum valueElecInfo
SmearingFermi enum valueElecInfo
SmearingGauss enum valueElecInfo
SmearingMP1 enum valueElecInfo
SmearingType enum nameElecInfo
smearingTypeElecInfo
smearingWidthElecInfo
smearPrime(double mu, double eps) constElecInfo
smearPrime(double mu, const diagMatrix &eps) constElecInfo
smearReport(const double *muOverride=0) const (defined in ElecInfo)ElecInfo
spinorLength() const (defined in ElecInfo)ElecInfoinline
spinTypeElecInfo
spinWeight (defined in ElecInfo)ElecInfo
updateFillingsEnergies(const std::vector< diagMatrix > &eps, Energies &) constElecInfo
whose(int q) constElecInfoinline
write(const std::vector< diagMatrix > &, const char *fname, int nRowsOverride=0) constElecInfo
write(const std::vector< matrix > &, const char *fname, int nRowsOverride=0, int nColsOverride=0) constElecInfo
write(const std::vector< class ColumnBundle > &, const char *fname) constElecInfo