SIRIUS 7.5.0
Electronic structure library and applications
mixer_functions.hpp
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19
20/** \file mixer_functions.hpp
21 *
22 * \brief Contains declarations of functions required for mixing.
23 */
24
25#ifndef __MIXER_FUNCTIONS_HPP__
26#define __MIXER_FUNCTIONS_HPP__
27
29#include "SDDK/memory.hpp"
30#include "mixer/mixer.hpp"
32#include "density/density_matrix.hpp"
33#include "density/density.hpp"
34
35namespace sirius {
36
37namespace mixer {
38
39FunctionProperties<Periodic_function<double>> periodic_function_property();
40
41FunctionProperties<Periodic_function<double>> periodic_function_property_modified(bool use_coarse_gvec__);
42
43FunctionProperties<density_matrix_t> density_function_property();
44
45FunctionProperties<PAW_density<double>> paw_density_function_property();
46
47FunctionProperties<Hubbard_matrix> hubbard_matrix_function_property();
48
49} // namespace mixer
50
51} // namespace sirius
52
53#endif
Contains definition and partial implementation of sirius::Density class.
Base class for Hubbard occupancy and potential matrices.
Memory management functions and classes.
Contains definition and implementation of sirius::Mixer base class.
FunctionProperties< Periodic_function< double > > periodic_function_property_modified(bool use_coarse_gvec__)
Only for the PP-PW case.
Namespace of the SIRIUS library.
Definition: sirius.f90:5
Contains declaration and partial implementation of sirius::Periodic_function class.