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Atomic-orbital Based Ab-initio Computation at UStc
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dftu_pw.h
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1#ifndef DFTU_PW_H
2#define DFTU_PW_H
3
6
7struct Input_para;
8class Plus_U;
9
10namespace pw
11{
12
13void iter_init_dftu_pw(const int iter,
14 const int istep,
15 Plus_U& dftu,
16 const void* psi,
17 const ModuleBase::matrix& wg,
18 const UnitCell& ucell,
19 const Input_para& inp);
20
21}
22
23#endif
Definition matrix.h:18
Definition dftu.h:19
Definition unitcell.h:15
Definition exx_lip.h:23
Definition deltaspin_pw.cpp:7
void iter_init_dftu_pw(const int iter, const int istep, Plus_U &dftu, const void *psi, const ModuleBase::matrix &wg, const UnitCell &ucell, const Input_para &inp)
Definition dftu_pw.cpp:8
Definition input_parameter.h:12
Plus_U dftu
Definition test_dftu.cpp:14