pwdft
0.1
PW-DFT code for education
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Go to the source code of this file.
Modules | |
module | rho_v |
Functions/Subroutines | |
subroutine | rho_v::init_rho_v () |
Initialize rho, Vps, Vks. More... | |
subroutine | rho_v::generate_vps () |
Pseudopotential Vps is computed. More... | |
subroutine | rho_v::hartree_pot (Vloc) |
Add Hartree potential. More... | |
subroutine | rho_v::xc_pot (Vloc) |
Add XC potential (LDA) More... | |
Variables | |
real(8), dimension(:), allocatable | rho_v::vks |
(g_rhnr) Kohn-Sham potential [Htr] More... | |
real(8), dimension(:), allocatable | rho_v::vps |
(g_rhnr) Pseudopotential [Htr] More... | |
real(8), dimension(:), allocatable | rho_v::rho |
(g_rhnr) Charge density More... | |