GBTOlib: library for evaluation of molecular integrals in mixed Gaussian / B-spline basis  111
Data Types | Modules | Functions/Subroutines
bto_gto_test_routines_mod.f90 File Reference

Modules

module  bto_gto_test_routines_mod
 

Functions/Subroutines

subroutine, public bto_gto_test_routines_mod::calc_2el_integral_BB_GG (density_1, density_2, max_l_legendre, integral)
 
subroutine, public bto_gto_test_routines_mod::calc_2el_integral_BG_BG (density_1, density_2, max_l_legendre, integral)
 
subroutine, public bto_gto_test_routines_mod::calc_2el_integral_BG_GG (density_1, density_2, max_l_legendre, integral)
 
subroutine bto_gto_test_routines_mod::init_GG_density (this, max_l_pw)
 
real(ep1) function bto_gto_test_routines_mod::ep_eval_BB_density (data, x)
 
real(ep1) function bto_gto_test_routines_mod::ep_eval_BG_density (data, x)