gint_vl_gpu.h File Reference

#include "gint.h"
#include "grid_technique.h"
#include "kernels/cuda/cuda_tools.cuh"

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Namespaces
namespace	GintKernel

Functions
void	GintKernel::gint_vl_gpu (hamilt::HContainer< double > *hRGint, const double *vlocal, const double *ylmcoef_now, const double dr, const double *rcut, const Grid_Technique &gridt, const UnitCell &ucell)
void	GintKernel::gtask_vlocal (const Grid_Technique &gridt, const UnitCell &ucell, const int grid_index_ij, const int nczp, const double vfactor, const double *vlocal_global_value, int &atoms_per_z, int *atoms_num_info, uint8_t *atoms_type, double *dr_part, double *vldr3)
void	GintKernel::alloc_mult_vlocal (const hamilt::HContainer< double > *hRGint, const Grid_Technique &gridt, const UnitCell &ucell, const int grid_index_ij, const int max_atom, double *const psi, double *const psi_vldr3, double *const grid_vlocal_g, int *mat_m, int *mat_n, int *mat_k, int *mat_lda, int *mat_ldb, int *mat_ldc, double **mat_A, double **mat_B, double **mat_C, int &atom_pair_num, int &max_m, int &max_n)