hamiltonian Directory Reference

Files
file	check_wave_functions.hpp [code]
	Check orthogonality of wave-functions and their residuals.
file	davidson.hpp [code]
	Davidson iterative solver implementation.
file	diagonalize.hpp [code]
	Entry point for Hamiltonain diagonalization.
file	diagonalize_fp.hpp [code]
	Diagonalize full-potential LAPW Hamiltonian.
file	diagonalize_pp.hpp [code]
	Diagonalize pseudo-potential Hamiltonian.
file	generate_subspace_matrix.hpp [code]
	Generate subspace-matrix in the auxiliary basis |phi>
file	hamiltonian.cpp [code]
	Contains definition of sirius::Hamiltonian0 class.
file	hamiltonian.hpp [code]
	Contains declaration and definition of sirius::Hamiltonian class.
file	hamiltonian_k.cpp [code]
	Contains definition of sirius::Hamiltonian_k class.
file	initialize_subspace.hpp [code]
	Create intial subspace from atomic-like wave-functions.
file	local_operator.cpp [code]
	Implementation of sirius::Local_operator class.
file	local_operator.hpp [code]
	Declaration of sirius::Local_operator class.
file	non_local_operator.cpp [code]
	Contains implementation of sirius::Non_local_operator class.
file	non_local_operator.hpp [code]
	Contains declaration of sirius::Non_local_operator class.
file	non_local_operator_base.hpp [code]
	Contains definition of sirius::Non_local_operator class.
file	pseudopotential_hmatrix.hpp [code]
file	residuals.hpp [code]
	Compute residuals from the eigen-vectors and basis functions.
file	s_u_operator.cpp [code]