ergo
compute_grid_for_box_params_struct Struct Reference

List of all members.

Public Member Functions

 compute_grid_for_box_params_struct (const BasisInfoStruct &bis_)

Public Attributes

const BasisInfoStructbis
DensitySpecStruct density
int noOfNonzeroBasisFuncs
int * nonZeroBasisFuncIndexList
int noOfNonzeroShells
int * nonZeroShellsIndexList
std::vector< reallocalFullDensityMatrix
GridGenerationParamsStruct gridGenerationParams
int nShlblocks
int(* listShlblocks_otherformat )[2]
DftIntegratorBldftIntegrator
realdmagao

Constructor & Destructor Documentation

compute_grid_for_box_params_struct::compute_grid_for_box_params_struct ( const BasisInfoStruct bis_)
inlineexplicit

Member Data Documentation

const BasisInfoStruct& compute_grid_for_box_params_struct::bis

Referenced by compute_grid_for_box().

DensitySpecStruct compute_grid_for_box_params_struct::density
DftIntegratorBl* compute_grid_for_box_params_struct::dftIntegrator
real* compute_grid_for_box_params_struct::dmagao
GridGenerationParamsStruct compute_grid_for_box_params_struct::gridGenerationParams
int(* compute_grid_for_box_params_struct::listShlblocks_otherformat)[2]
std::vector<real> compute_grid_for_box_params_struct::localFullDensityMatrix
int* compute_grid_for_box_params_struct::nonZeroBasisFuncIndexList
int* compute_grid_for_box_params_struct::nonZeroShellsIndexList
int compute_grid_for_box_params_struct::noOfNonzeroBasisFuncs
int compute_grid_for_box_params_struct::noOfNonzeroShells
int compute_grid_for_box_params_struct::nShlblocks

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