core_ppnl.F File Reference

#include "./base/base_uses.f90"

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Modules
module	core_ppnl
	Calculation of the non-local pseudopotential contribution to the core Hamiltonian <a|V(non-local)|b> = <a|p(l,i)>h(i,j)<p(l,j)|b>

Functions/Subroutines
subroutine, public	core_ppnl::build_core_ppnl (matrix_h, matrix_p, force, virial, calculate_forces, use_virial, nder, qs_kind_set, atomic_kind_set, particle_set, sab_orb, sap_ppnl, eps_ppnl, nimages, cell_to_index, basis_type, deltaR, matrix_l)
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