core_ppl.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	core_ppl
	Calculation of the local pseudopotential contribution to the core Hamiltonian <a|V(local)|b> = <a|Sum e^a*rc**2|b>

Functions/Subroutines
subroutine, public	core_ppl::build_core_ppl (matrix_h, matrix_p, force, virial, calculate_forces, use_virial, nder, qs_kind_set, atomic_kind_set, particle_set, sab_orb, sac_ppl, nimages, cell_to_index, basis_type, deltar, atcore)
	...
subroutine, public	core_ppl::build_core_ppl_ri (lri_ppl_coef, force, virial, calculate_forces, use_virial, qs_kind_set, atomic_kind_set, particle_set, sac_ppl, basis_type)
	...