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Atomic-orbital Based Ab-initio Computation at UStc
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print_info.h
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1#ifndef PRINT_INFO_H
2#define PRINT_INFO_H
3
4#include "source_base/timer.h"
6#include "source_cell/klist.h"
9
10namespace ModuleIO
11{
12// print out to screen about the readin parameters
14 const UnitCell& ucell,
15 K_Vectors& kv,
16 const Input_para& inp);
17
18void print_time(time_t& time_start, time_t& time_finish);
19
20void print_screen(const int& stress_step, const int& force_step, const int& istep);
21
24 ModulePW::PW_Basis* pw_rho,
26 std::ofstream& ofs);
27
28void print_wfcfft(const Input_para& inp, ModulePW::PW_Basis_K& pw_wfc, std::ofstream& ofs);
29
30void print_kpar(const int &nks, const int &kpar_lcao);
31
32} // namespace ModuleIO
33
34#endif
Definition klist.h:13
Definition pw_basis_big.h:16
Special pw_basis class. It includes different k-points.
Definition pw_basis_k.h:57
A class which can convert a function of "r" to the corresponding linear superposition of plane waves ...
Definition pw_basis.h:56
Definition unitcell.h:17
Definition cal_dos.h:9
void print_kpar(const int &nks, const int &kpar_lcao)
Definition print_info.cpp:391
void print_screen(const int &stress_step, const int &force_step, const int &istep)
Definition print_info.cpp:348
void print_wfcfft(const Input_para &inp, ModulePW::PW_Basis_K &pw_wfc, std::ofstream &ofs)
Definition print_info.cpp:306
void print_parameters(const UnitCell &ucell, K_Vectors &kv, const Input_para &inp)
Definition print_info.cpp:10
void print_rhofft(ModulePW::PW_Basis *pw_rhod, ModulePW::PW_Basis *pw_rho, ModulePW::PW_Basis_Big *pw_big, std::ofstream &ofs)
Print charge density using FFT.
Definition print_info.cpp:200
void print_time(time_t &time_start, time_t &time_finish)
Definition print_info.cpp:180
Definition input_parameter.h:13