TABLE OF CONTENTS
- pw.x input
- ::pwtk::pwi
- ::pwtk::pwi::aA
- ::pwtk::pwi::abc2celldm
- ::pwtk::pwi::alat
- ::pwtk::pwi::ATOMIC_POSITIONS_fromCRD
- ::pwtk::pwi::ATOMIC_POSITIONS_fromPWO
- ::pwtk::pwi::ATOMIC_POSITIONS_fromXSF
- ::pwtk::pwi::cC
- ::pwtk::pwi::CELL_PARAMETERS_and_ATOMIC_POSITIONS_fromPWO
- ::pwtk::pwi::CELL_PARAMETERS_and_ATOMIC_POSITIONS_fromXSF
- ::pwtk::pwi::CELL_PARAMETERS_fromPWO
- ::pwtk::pwi::CELL_PARAMETERS_fromXSF
- ::pwtk::pwi::celldm3
- ::pwtk::pwi::clear
- ::pwtk::pwi::deleteAtoms
- ::pwtk::pwi::deleteAtoms1st
- ::pwtk::pwi::deleteAtomsLast
- ::pwtk::pwi::deleteAtomsRange
- ::pwtk::pwi::dipoleCorr
- ::pwtk::pwi::disableDipoleCorr
- ::pwtk::pwi::displaceAtoms
- ::pwtk::pwi::filterAtomicSpecies
- ::pwtk::pwi::fixAtoms
- ::pwtk::pwi::fixAtoms1st
- ::pwtk::pwi::fixAtomsLast
- ::pwtk::pwi::fixAtomsRange
- ::pwtk::pwi::fprint
- ::pwtk::pwi::get
- ::pwtk::pwi::getAllAtomicLabels
- ::pwtk::pwi::getAtmPos
- ::pwtk::pwi::getAtmPosSegment
- ::pwtk::pwi::getAtmPosUnit
- ::pwtk::pwi::getAtmSymbList
- ::pwtk::pwi::getAtomicLabels
- ::pwtk::pwi::getNAtoms
- ::pwtk::pwi::getNTyp
- ::pwtk::pwi::getPrimVec
- ::pwtk::pwi::getXSF
- ::pwtk::pwi::getXSFPrimCoor
- ::pwtk::pwi::getXSFPrimVec
- ::pwtk::pwi::ibrav
- ::pwtk::pwi::incrVacuum
- ::pwtk::pwi::insertAtoms
- ::pwtk::pwi::load_fromPWI
- ::pwtk::pwi::reduceConvThr
- ::pwtk::pwi::replaceCoor
- ::pwtk::pwi::setNAtoms
- ::pwtk::pwi::substituteAtmType
- ::pwtk::pwi::substituteAtom
- ::pwtk::pwi::substituteAtoms
- ::pwtk::pwi::supercell
- ::pwtk::pwi::supercell_fccHKL
- ::pwtk::pwi::supercell_slab
- ::pwtk::pwi::tabulateStructs
- ::pwtk::pwi::visualize
pw.x input
DESCRIPTION
Handling of the pw.x input. For further details, see ::pwtk::pwi.