ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
Loading...
Searching...
No Matches
nscf_fermi_surf.h
Go to the documentation of this file.
1#ifndef NSCF_FERMI_SURF_H
2#define NSCF_FERMI_SURF_H
3
5#include "source_cell/klist.h"
8
9namespace ModuleIO
10{
11void nscf_fermi_surface(const std::string& out_band_dir,
12 const int& nband,
13 const double& ef,
14 const K_Vectors& kv,
15 const UnitCell& ucell,
16 const ModuleBase::matrix& ekb);
17}
18#endif
19
Definition klist.h:13
Definition matrix.h:19
Definition unitcell.h:16
This class has two functions: restart psi from the previous calculation, and write psi to the disk.
Definition cal_dos.h:9
void nscf_fermi_surface(const std::string &out_band_dir, const int &nband, const double &ef, const K_Vectors &kv, const UnitCell &ucell, const ModuleBase::matrix &ekb)
Definition nscf_fermi_surf.cpp:11