ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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write_init.h
Go to the documentation of this file.
1#ifndef WRITE_INIT_H
2#define WRITE_INIT_H
3
5#include "source_estate/module_charge/charge.h" // use chg
6#include "source_estate/fp_energy.h" // use efermi
7#include "source_estate/elecstate.h" // use pelec
8
9namespace ModuleIO
10{
11
13 const UnitCell& ucell,
14 const Parallel_Grid &para_grid,
15 const Charge &chr,
17 const int istep,
18 const Input_para& inp);
19
21 const UnitCell& ucell,
22 const Parallel_Grid &para_grid,
24 const int istep,
25 const Input_para& inp);
26
27}
28
29
30#endif
Definition charge.h:17
Definition parallel_grid.h:7
Definition unitcell.h:15
Definition elecstate.h:15
This file contains all energies about first-principle calculations.
Definition input_help.cpp:10
void write_chg_init(const UnitCell &ucell, const Parallel_Grid &para_grid, const Charge &chr, const elecstate::Efermi &efermi, const int istep, const Input_para &inp)
Definition write_init.cpp:7
void write_pot_init(const UnitCell &ucell, const Parallel_Grid &para_grid, elecstate::ElecState *pelec, const int istep, const Input_para &inp)
Definition write_init.cpp:67
Definition input_parameter.h:12
Fermi energies.
Definition fp_energy.h:64