Module rest::dft

Modules

gen_grids 🔒

Describe me …

libxc 🔒

Structs

DFA4REST

Grids

Enums

DFAFamily

Functions

contract_vxc_0

numerical_density

par_numerical_density

prepare_tabulated_sigma 🔒

Prepare sigma[0] = rhop_u dot rhop_u => sigma_uu sigma[1] = rhop_u dot rhop_d => sigma_ud sigma[2] = rhop_d dot rhop_d => sigma_dd

prepare_tabulated_sigma_rayon 🔒

Rayon parallel version to prepare sigma[0] = rhop_u dot rhop_u => sigma_uu sigma[1] = rhop_u dot rhop_d => sigma_ud sigma[2] = rhop_d dot rhop_d => sigma_dd