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Dump.h File Reference
#include <core/matrix.h>
#include <core/ScalarField.h>
#include <set>
#include <memory>

Classes

class  Dump
 Stores list of what to output and when, and implements functions to do so. More...
 

Enumerations

enum  DumpFrequency {
  DumpFreq_End, DumpFreq_Init, DumpFreq_Electronic, DumpFreq_Fluid,
  DumpFreq_Ionic, DumpFreq_Gummel, DumpFreq_Delim
}
 Dump frequency options: More...
 
enum  DumpVariable {
  DumpNone, DumpState, DumpIonicPositions, DumpForces,
  DumpLattice, DumpIonicDensity, DumpElecDensity, DumpElecDensityAccum,
  DumpCoreDensity, DumpKEdensity, DumpFluidDensity, DumpDvac,
  DumpDfluid, DumpDtot, DumpVcavity, DumpVfluidTot,
  DumpVlocps, DumpVscloc, DumpBandEigs, DumpEigStats,
  DumpFillings, DumpRhoAtom, DumpBandUnfold, DumpEcomponents,
  DumpExcCompare, DumpBoundCharge, DumpSolvationRadii, DumpQMC,
  DumpOcean, DumpBGW, DumpRealSpaceWfns, DumpFluidDebug,
  DumpSlabEpsilon, DumpBulkEpsilon, DumpChargedDefect, DumpDOS,
  DumpPolarizability, DumpElectronScattering, DumpSIC, DumpDipole,
  DumpStress, DumpExcitations, DumpSpin, DumpMomenta,
  DumpSymmetries, DumpKpoints, DumpGvectors, DumpOrbitalDep,
  DumpXCanalysis, DumpEresolvedDensity, DumpFermiDensity, DumpDelim
}
 Dump variable selection options:
 

Detailed Description

Selection of output quantities