ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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delley.h
Go to the documentation of this file.
1#ifndef GRID_ANGULAR_DELLEY_H
2#define GRID_ANGULAR_DELLEY_H
3
4#include <vector>
5
6namespace Grid {
7namespace Angular {
8
21int ngrid_delley(int& lmax);
22
23
43int delley(int& lmax, double* grid, double* weight);
44
45// a handy wrapper doing the same as above
46int delley(int& lmax, std::vector<double>& grid, std::vector<double>& weight);
47
48} // end of namespace Angular
49} // end of namespace Grid
50
51#endif
int ngrid_delley(int &lmax)
Number of Delley's grid points for a certain order of accuracy.
Definition delley.cpp:352
int delley(int &lmax, double *grid, double *weight)
Delley's quadrature grid and weights.
Definition delley.cpp:358
Definition batch.h:6