ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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rho_tau_lcao.h
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1#ifndef RHO_TAU_LCAO_H
2#define RHO_TAU_LCAO_H
3
6
7// generate charge density from different basis or methods
8namespace LCAO_domain
9{
10 void dm2rho(std::vector<hamilt::HContainer<double>*> &dmr,
11 const int nspin,
12 Charge* chr);
13
14 void dm2tau(std::vector<hamilt::HContainer<double>*> &dmr,
15 const int nspin,
16 Charge* chr);
17}
18
19#endif
Definition charge.h:18
Definition hcontainer.h:144
Definition LCAO_allocate.cpp:8
void dm2tau(std::vector< hamilt::HContainer< double > * > &dmr, const int nspin, Charge *chr)
Definition rho_tau_lcao.cpp:34
void dm2rho(std::vector< hamilt::HContainer< double > * > &dmr, const int nspin, Charge *chr)
Definition rho_tau_lcao.cpp:5