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Atomic-orbital Based Ab-initio Computation at UStc
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Namespaces | Functions
cal_ddpsir_ylm.cpp File Reference
#include "gint_tools.h"
#include "source_base/timer.h"
#include "source_base/ylm.h"
Include dependency graph for cal_ddpsir_ylm.cpp:

Namespaces

namespace  Gint_Tools
 

Functions

void Gint_Tools::cal_ddpsir_ylm (const Grid_Technique &gt, const int bxyz, const int na_grid, const int grid_index, const double delta_r, const int *const block_index, const int *const block_size, const bool *const *const cal_flag, double *const *const ddpsir_ylm_xx, double *const *const ddpsir_ylm_xy, double *const *const ddpsir_ylm_xz, double *const *const ddpsir_ylm_yy, double *const *const ddpsir_ylm_yz, double *const *const ddpsir_ylm_zz)