CP2K 2.4 (Revision 12889)
Namespaces | Functions | Variables

hfx_libint_wrapper.f90 File Reference

#include "cp_common_uses.h"
Include dependency graph for hfx_libint_wrapper.f90:

Go to the source code of this file.

Namespaces

namespace  hfx_libint_wrapper
 

Interface to the Libint-Library or a c++ wrapper.


Functions

subroutine, public hfx_libint_wrapper::initialize_libint (lib, max_am, error)
subroutine, public hfx_libint_wrapper::initialize_libderiv (deriv, max_am, error)
subroutine, public hfx_libint_wrapper::terminate_libint (lib)
subroutine, public hfx_libint_wrapper::terminate_libderiv (deriv)
subroutine, public hfx_libint_wrapper::get_eris (n_d, n_c, n_b, n_a, lib, prim, p_work, a_mysize)
subroutine, public hfx_libint_wrapper::get_derivs (n_d, n_c, n_b, n_a, deriv, prim, work_forces, a_mysize)

Variables

CHARACTER(len=*), parameter,
private 
hfx_libint_wrapper::moduleN = 'hfx_libint_wrapper'