ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
Loading...
Searching...
No Matches
Namespaces | Functions | Variables
partition.cpp File Reference
#include "source_base/module_grid/partition.h"
#include "source_base/constants.h"
#include <cmath>
#include <functional>
#include <numeric>
#include <algorithm>
#include <vector>
#include <cassert>
Include dependency graph for partition.cpp:

Namespaces

namespace  Grid
 
namespace  Grid::Partition
 

Functions

double Grid::Partition::w_becke (int nR0, const double *drR, const double *dRR, int nR, const int *iR, int c)
 Becke's partition weight.
 
double Grid::Partition::s_becke (double mu)
 
double Grid::Partition::w_stratmann (int nR0, const double *drR, const double *dRR, const double *drR_thr, int nR, int *iR, int c)
 Becke's partition weight with Stratmann's scheme.
 
double Grid::Partition::s_stratmann (double mu)
 

Variables

const double Grid::Partition::stratmann_a = 0.64