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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, DumpEcomponents, DumpExcCompare,
  DumpBoundCharge, DumpSolvationRadii, DumpQMC, DumpOcean,
  DumpBGW, DumpRealSpaceWfns, DumpFluidDebug, DumpSlabEpsilon,
  DumpBulkEpsilon, DumpChargedDefect, DumpDOS, DumpPolarizability,
  DumpElectronScattering, DumpSIC, DumpDipole, DumpStress,
  DumpExcitations, DumpMomenta, DumpSymmetries, DumpKpoints,
  DumpGvectors, DumpOrbitalDep, DumpXCanalysis, DumpEresolvedDensity,
  DumpFermiDensity, DumpDelim
}
 Dump variable selection options:
 

Detailed Description

Selection of output quantities