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Atomic-orbital Based Ab-initio Computation at UStc
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ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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This is the complete list of members for Gint_Gamma, including all inherited members.
| bx | Gint | protected |
| bxyz | Gint | protected |
| by | Gint | protected |
| bz | Gint | protected |
| cal_env(const double *wfc, double *rho, const UnitCell &ucell) | Gint_Gamma | |
| cal_gint(Gint_inout *inout) | Gint | |
| cal_meshball_force(const int grid_index, const int na_grid, const int *const block_size, const int *const block_index, const double *const *const psir_vlbr3_DMR, const double *const *const dpsir_x, const double *const *const dpsir_y, const double *const *const dpsir_z, ModuleBase::matrix *force) | Gint | protected |
| cal_meshball_rho(const int na_grid, const int *const block_index, const int *const vindex, const double *const *const psir_ylm, const double *const *const psir_DMR, double *const rho) | Gint | protected |
| cal_meshball_stress(const int na_grid, const int *const block_index, const double *const psir_vlbr3_DMR, const double *const dpsirr, ModuleBase::matrix *stress) | Gint | protected |
| cal_meshball_tau(const int na_grid, int *block_index, int *vindex, double **dpsix, double **dpsiy, double **dpsiz, double **dpsix_dm, double **dpsiy_dm, double **dpsiz_dm, double *rho) | Gint | protected |
| cal_meshball_vlocal(const int na_grid, const int LD_pool, const int *const block_size, const int *const block_index, const int grid_index, const bool *const *const cal_flag, const double *const *const psir_ylm, const double *const *const psir_vlbr3, hamilt::HContainer< double > *hR) | Gint | protected |
| cal_vlocal(Gint_inout *inout, const bool new_e_iteration) | Gint_Gamma | |
| DM | Gint_Gamma | private |
| DMRGint | Gint | protected |
| DMRGint_full | Gint | protected |
| get_DMRGint() const | Gint | inline |
| get_hRGint() const | Gint | inline |
| get_ncxyz() const | Gint | inline |
| gint_kernel_dvlocal(Gint_inout *inout) | Gint | protected |
| gint_kernel_force(Gint_inout *inout) | Gint | protected |
| gint_kernel_force(const int na_grid, const int grid_index, const double delta_r, double *vldr3, const int is, const bool isforce, const bool isstress, ModuleBase::matrix *fvl_dphi, ModuleBase::matrix *svl_dphi, const UnitCell &ucell) | Gint | protected |
| gint_kernel_force_meta(Gint_inout *inout) | Gint | protected |
| gint_kernel_force_meta(const int na_grid, const int grid_index, const double delta_r, double *vldr3, double *vkdr3, const int is, const bool isforce, const bool isstress, ModuleBase::matrix *fvl_dphi, ModuleBase::matrix *svl_dphi, const UnitCell &ucell) | Gint | protected |
| gint_kernel_rho(Gint_inout *inout) | Gint | protected |
| gint_kernel_rho(const int na_grid, const int grid_index, const double delta_r, int *vindex, const int LD_pool, const UnitCell &ucell, Gint_inout *inout) | Gint | protected |
| gint_kernel_tau(Gint_inout *inout) | Gint | protected |
| gint_kernel_tau(const int na_grid, const int grid_index, const double delta_r, int *vindex, const int LD_pool, Gint_inout *inout, const UnitCell &ucell) | Gint | protected |
| gint_kernel_vlocal(Gint_inout *inout) | Gint | protected |
| gint_kernel_vlocal_meta(Gint_inout *inout) | Gint | protected |
| gpu_force_interface(Gint_inout *inout) | Gint | protected |
| gpu_rho_interface(Gint_inout *inout) | Gint | protected |
| gpu_vlocal_interface(Gint_inout *inout) | Gint | protected |
| gridt | Gint | |
| hRGint | Gint | protected |
| hRGint_tmp | Gint | protected |
| hRGintCd | Gint | protected |
| initialize_pvpR(const UnitCell &unitcell, const Grid_Driver *gd, const int &nspin) | Gint | |
| nbx | Gint | protected |
| nbxx | Gint | protected |
| nby | Gint | protected |
| nbz | Gint | protected |
| nbz_start | Gint | protected |
| ncxyz | Gint | protected |
| nplane | Gint | protected |
| ny | Gint | protected |
| operator=(Gint_Gamma &&rhs) | Gint_Gamma | |
| Gint::operator=(Gint &&rhs) | Gint | |
| prep_grid(const Grid_Technique >, const int &nbx_in, const int &nby_in, const int &nbz_in, const int &nbz_start_in, const int &ncxyz_in, const int &bx_in, const int &by_in, const int &bz_in, const int &bxyz_in, const int &nbxx_in, const int &ny_in, const int &nplane_in, const int &startz_current_in, const UnitCell *ucell_in, const LCAO_Orbitals *orb_in) | Gint | |
| psir_func_1 | Gint | |
| psir_func_2 | Gint | |
| pvdpRx_reduced | Gint | protected |
| pvdpRy_reduced | Gint | protected |
| pvdpRz_reduced | Gint | protected |
| reset_DMRGint(const int &nspin) | Gint | |
| startz_current | Gint | protected |
| T_psir_func typedef | Gint | |
| transfer_DM2DtoGrid(std::vector< hamilt::HContainer< double > * > DM2D) | Gint | |
| transfer_pvpR(hamilt::HContainer< double > *hR, const UnitCell *ucell) | Gint_Gamma | |
| ucell | Gint | |
| ~Gint() | Gint |
1.9.8