ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
Loading...
Searching...
No Matches
Namespaces | Functions
init_orb.cpp File Reference
#include "gint_tools.h"
#include "source_base/memory.h"
#include "source_basis/module_ao/ORB_read.h"
#include "source_cell/unitcell.h"
Include dependency graph for init_orb.cpp:

Namespaces

namespace  Gint_Tools
 

Functions

void Gint_Tools::init_orb (double &dr_uniform, std::vector< double > &rcuts, UnitCell &ucell, const LCAO_Orbitals &orb, std::vector< std::vector< double > > &psi_u, std::vector< std::vector< double > > &dpsi_u, std::vector< std::vector< double > > &d2psi_u)