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Atomic-orbital Based Ab-initio Computation at UStc
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dftu_pw.h File Reference
#include "source_cell/unitcell.h"
#include "source_base/matrix.h"
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Namespaces

namespace  pw
 

Functions

void pw::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)