ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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radial.h
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1#ifndef GRID_RADIAL_H
2#define GRID_RADIAL_H
3
4#include <vector>
5
6namespace Grid {
7namespace Radial {
8
36void baker(int nbase, double R, double* r, double* w, int mult = 1);
37void baker(int nbase, double R, std::vector<double>& r,
38 std::vector<double>& w, int mult = 1);
39
40
46void murray(int n, double R, double* r, double* w);
47
48
56void treutler_m4(int n, double R, double* r, double* w, double alpha = 0.6);
57
58
65void mura(int n, double R, double* r, double* w);
66
67} // end of namespace Radial
68} // end of namespace Grid
69
70#endif
void treutler_m4(int n, double R, double *r, double *w, double alpha)
Definition radial.cpp:37
void murray(int n, double R, double *r, double *w)
Definition radial.cpp:27
void baker(int nbase, double R, double *r, double *w, int mult)
Radial quadratures.
Definition radial.cpp:8
void mura(int n, double R, double *r, double *w)
Definition radial.cpp:53
Definition batch.h:6