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: | |
Selection of output quantities