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Atomic-orbital Based Ab-initio Computation at UStc
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source
source_base
module_grid
delley.h
Go to the documentation of this file.
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#ifndef GRID_ANGULAR_DELLEY_H
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#define GRID_ANGULAR_DELLEY_H
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#include <vector>
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namespace
Grid
{
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namespace
Angular {
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int
ngrid_delley
(
int
& lmax);
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int
delley
(
int
& lmax,
double
* grid,
double
* weight);
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// a handy wrapper doing the same as above
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int
delley
(
int
& lmax, std::vector<double>& grid, std::vector<double>& weight);
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}
// end of namespace Angular
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}
// end of namespace Grid
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#endif
Grid::Angular::ngrid_delley
int ngrid_delley(int &lmax)
Number of Delley's grid points for a certain order of accuracy.
Definition
delley.cpp:352
Grid::Angular::delley
int delley(int &lmax, double *grid, double *weight)
Delley's quadrature grid and weights.
Definition
delley.cpp:358
Grid
Definition
batch.h:6
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