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Atomic-orbital Based Ab-initio Computation at UStc
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source
source_lcao
module_ri
exx_abfs-jle.h
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#ifndef EXX_ABFS_JLE_H
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#define EXX_ABFS_JLE_H
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#include "
exx_abfs.h
"
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#include "../../source_hamilt/module_xc/exx_info.h"
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#include "../../source_basis/module_ao/ORB_atomic_lm.h"
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#include <vector>
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class
LCAO_Orbitals
;
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class
UnitCell
;
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class
Exx_Abfs::Jle
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{
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public
:
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static
std::vector<std::vector<std::vector<Numerical_Orbital_Lm>>>
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init_jle
(
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const
Exx_Info::Exx_Info_Opt_ABFs
&info,
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const
double
kmesh_times
,
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const
UnitCell
& ucell,
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const
LCAO_Orbitals
& orb);
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};
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#endif
// EXX_ABFS_JLE_H
Exx_Abfs::Jle
Definition
exx_abfs-jle.h:14
Exx_Abfs::Jle::init_jle
static std::vector< std::vector< std::vector< Numerical_Orbital_Lm > > > init_jle(const Exx_Info::Exx_Info_Opt_ABFs &info, const double kmesh_times, const UnitCell &ucell, const LCAO_Orbitals &orb)
Definition
exx_abfs-jle.cpp:10
Exx_Abfs::kmesh_times
int kmesh_times
Definition
exx_abfs.h:25
LCAO_Orbitals
Definition
ORB_read.h:19
UnitCell
Definition
unitcell.h:16
exx_abfs.h
Exx_Info::Exx_Info_Opt_ABFs
Definition
exx_info.h:81
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