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Dump Class Reference

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

#include <Dump.h>

Inheritance diagram for Dump:

Public Member Functions

void setup (const Everything &)
 
void operator() (DumpFrequency freq, int iter)
 
string getFilename (string varName) const
 Get the dump filename corresponding to a particular variable name.
 
bool checkInterval (DumpFrequency freq, int iter) const
 Check whether to dump at given frequency and iteration:
 

Public Attributes

std::shared_ptr< class DOSdos
 density-of-states calculator
 
std::shared_ptr< struct
Polarizability
polarizability
 electronic polarizability calculator
 
std::shared_ptr< struct
ElectronScattering
electronScattering
 electron-electron scattering calculator
 
std::vector< std::pair< double,
double > > 
densityErange
 energy ranges for energy-resolved density output
 
std::vector< double > fermiDensityLevels
 energies at which to evaluate fermi-dirac derivative
 
std::shared_ptr< struct
SlabEpsilon
slabEpsilon
 slab dielectric function calculator
 
std::shared_ptr< struct
BulkEpsilon
bulkEpsilon
 bulk dielectric constant calculator
 
std::shared_ptr< struct
ChargedDefect
chargedDefect
 charged defect correction calculator
 
std::shared_ptr< struct BGWparamsbgwParams
 parameters for BGW claculation if any
 
bool potentialSubtraction
 whether to subtract neutral-atom potentials in Dvac and Dtot output
 
matrix3< int > Munfold
 transformation matrix for band structure unfolding
 
- Public Attributes inherited from std::set< K >
keys
 STL member.
 

Friends

class Phonon
 
struct CommandDump
 
struct CommandDumpName
 
struct CommandDumpInterval
 

Detailed Description

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

Member Function Documentation

void Dump::operator() ( DumpFrequency  freq,
int  iter 
)

Dump all variables that should be dumped at the given DumpFrequency type (End/Gummel/Ionic) at the iter'th iteration at that frequency


The documentation for this class was generated from the following file: