AnalyzeTwists2(const int twist_num_inp, const TinyVector< double, OHMMS_DIM > &twist_inp) | EinsplineSetBuilder | protected |
AtomicCentersInfo | EinsplineSetBuilder | |
bcastSortBands(int splin, int N, bool root) | EinsplineSetBuilder | protected |
BroadcastOrbitalInfo() | EinsplineSetBuilder | |
CheckLattice() | EinsplineSetBuilder | |
ClassName | MPIObjectBase | protected |
clear_states(int index=0) | SPOSetBuilder | inline |
ComplexType typedef | QMCTraits | |
createRotatedSPOSet(xmlNodePtr cur) | SPOSetBuilder | |
createSPOSet(xmlNodePtr cur, SPOSetInputInfo &input_info) override | EinsplineSetBuilder | virtual |
qmcplusplus::SPOSetBuilder::createSPOSet(xmlNodePtr cur) | SPOSetBuilder | |
createSPOSetFromXML(xmlNodePtr cur) override | EinsplineSpinorSetBuilder | virtual |
DIM enum value | QMCTraits | |
DIM_VGL enum value | QMCTraits | |
DistinctTwists | EinsplineSetBuilder | |
eigenstatesGroup | EinsplineSetBuilder | |
EinsplineSetBuilder(ParticleSet &p, const PSetMap &psets, Communicate *comm, xmlNodePtr cur) | EinsplineSetBuilder | |
EinsplineSpinorSetBuilder(ParticleSet &p, const PSetMap &psets, Communicate *comm, xmlNodePtr cur) | EinsplineSpinorSetBuilder | inline |
energies_t typedef | SPOSetBuilder | |
ESHDF enum value | EinsplineSetBuilder | |
Format | EinsplineSetBuilder | |
FormatType enum name | EinsplineSetBuilder | |
FullBands | EinsplineSetBuilder | |
FullPrecRealType typedef | QMCTraits | |
FullPrecValueType typedef | QMCTraits | |
getCommRef() const | MPIObjectBase | inline |
getCommunicator() const | MPIObjectBase | inline |
getGroupID() const | MPIObjectBase | inline |
getMPI() const | MPIObjectBase | inline |
getName() const | MPIObjectBase | inline |
getTypeName() const | SPOSetBuilder | inline |
GGt | EinsplineSetBuilder | |
GradType typedef | QMCTraits | |
Gvecs | EinsplineSetBuilder | |
H5File | EinsplineSetBuilder | |
H5FileName | EinsplineSetBuilder | |
HaveOrbDerivs | EinsplineSetBuilder | |
IncludeTwists | EinsplineSetBuilder | |
IndexType typedef | QMCTraits | |
indices_t typedef | SPOSetBuilder | |
IonPos | EinsplineSetBuilder | |
ionsGroup | EinsplineSetBuilder | |
IonTypes | EinsplineSetBuilder | |
is_manager() const | MPIObjectBase | inline |
LastSpinSet | EinsplineSetBuilder | |
Lattice | EinsplineSetBuilder | |
LatticeInv | EinsplineSetBuilder | |
legacy | SPOSetBuilder | |
makeRotations | EinsplineSetBuilder | |
MakeTwoCopies | EinsplineSetBuilder | |
MatchingTol | EinsplineSetBuilder | |
MaxNumGvecs | EinsplineSetBuilder | |
MeshFactor | EinsplineSetBuilder | |
MeshSize | EinsplineSetBuilder | |
MixedSplineReader | EinsplineSetBuilder | |
modify_states(int index=0) | SPOSetBuilder | inline |
mpi_comm_type typedef | MPIObjectBase | |
MPIObjectBase(Communicate *c) | MPIObjectBase | |
myComm | MPIObjectBase | protected |
myName | MPIObjectBase | protected |
NumBands | EinsplineSetBuilder | |
NumDistinctOrbitals | EinsplineSetBuilder | |
NumElectrons | EinsplineSetBuilder | |
NumOrbitalsRead | EinsplineSetBuilder | |
NumSpins | EinsplineSetBuilder | |
NumTwists | EinsplineSetBuilder | |
Occ | EinsplineSetBuilder | |
occ_format | EinsplineSetBuilder | |
OccupyBands(int spin, int sortBands, int numOrbs, bool skipChecks=false) | EinsplineSetBuilder | |
OccupyBands_ESHDF(int spin, int sortBands, int numOrbs) | EinsplineSetBuilder | |
OrbitalPath(int ti, int bi) | EinsplineSetBuilder | |
parameterGroup | EinsplineSetBuilder | |
particle_hole_pairs | EinsplineSetBuilder | |
ParticleSets | EinsplineSetBuilder | |
PosType typedef | QMCTraits | |
PrimCell | EinsplineSetBuilder | |
primcell_kpoints | EinsplineSetBuilder | |
PrimCellInv | EinsplineSetBuilder | |
PropertySetType typedef | QMCTraits | |
PSetMap typedef | EinsplineSpinorSetBuilder | private |
PtclGrpIndexes typedef | QMCTraits | |
QMCPACK enum value | EinsplineSetBuilder | |
QTBase typedef | QMCTraits | |
QTFull typedef | QMCTraits | |
rank() const | MPIObjectBase | inline |
ReadGvectors_ESHDF() | EinsplineSetBuilder | |
ReadOrbitalInfo(bool skipChecks=false) | EinsplineSetBuilder | |
ReadOrbitalInfo_ESHDF(bool skipChecks=false) | EinsplineSetBuilder | |
RealType typedef | QMCTraits | |
RecipLattice | EinsplineSetBuilder | |
reserve_states(int nsets=1) | SPOSetBuilder | |
set_metadata(int numOrbs, int twist_num_inp, const TinyVector< double, OHMMS_DIM > &twist_inp, bool skipChecks=false) | EinsplineSetBuilder | protected |
setName(const std::string &aname) | MPIObjectBase | inline |
SourcePtcl | EinsplineSetBuilder | |
SPOSetBuilder(const std::string &type_name, Communicate *comm) | SPOSetBuilder | |
SPOSetMap | EinsplineSetBuilder | |
states | SPOSetBuilder | |
Super2Prim | EinsplineSetBuilder | |
SuperCell | EinsplineSetBuilder | |
SuperLattice | EinsplineSetBuilder | |
TargetPtcl | EinsplineSetBuilder | |
TensorType typedef | QMCTraits | |
TileIons() | EinsplineSetBuilder | |
TileMatrix | EinsplineSetBuilder | |
TWIST_NO_INPUT | EinsplineSetBuilder | protectedstatic |
twist_num_ | EinsplineSetBuilder | |
TwistMap | EinsplineSetBuilder | |
TWISTNUM_NO_INPUT | EinsplineSetBuilder | protectedstatic |
TwistPair(PosType a, PosType b) const | EinsplineSetBuilder | |
type_name_ | SPOSetBuilder | protected |
UnitCellType typedef | EinsplineSetBuilder | |
use_real_splines_ | EinsplineSetBuilder | |
UseTwists | EinsplineSetBuilder | |
ValueType typedef | QMCTraits | |
Version | EinsplineSetBuilder | |
XMLRoot | EinsplineSetBuilder | |
~EinsplineSetBuilder() override | EinsplineSetBuilder | |
~EinsplineSpinorSetBuilder() override | EinsplineSpinorSetBuilder | inline |
~SPOSetBuilder() | SPOSetBuilder | inlinevirtual |