elecstate::PotEfield Class Reference

#include <efield.h>

Inheritance diagram for elecstate::PotEfield:

Collaboration diagram for elecstate::PotEfield:

Public Member Functions
	PotEfield (const ModulePW::PW_Basis *rho_basis_in, const UnitCell *ucell_in, const surchem *solvent_in, bool dipole)
void	cal_fixed_v (double *vl_pseudo) override
void	cal_v_eff (const Charge *chg, const UnitCell *ucell, ModuleBase::matrix &v_eff) override
Public Member Functions inherited from elecstate::PotBase
	PotBase ()
virtual	~PotBase ()

Private Attributes
const UnitCell *	ucell_ = nullptr
const surchem *	solvent_ = nullptr

Additional Inherited Members
Public Attributes inherited from elecstate::PotBase
bool	fixed_mode = 0
bool	dynamic_mode = 0
Protected Attributes inherited from elecstate::PotBase
const ModulePW::PW_Basis *	rho_basis_ = nullptr
const ModulePW::PW_Basis *	rho_basis_smooth_ = nullptr

Constructor & Destructor Documentation

PotEfield()

elecstate::PotEfield::PotEfield ( const ModulePW::PW_Basis *  rho_basis_in, const UnitCell *  ucell_in, const surchem *  solvent_in, bool  dipole  )

inline

Member Function Documentation

cal_fixed_v()

void elecstate::PotEfield::cal_fixed_v ( double *  vl_pseudo )

inlineoverridevirtual

Reimplemented from elecstate::PotBase.

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cal_v_eff()

void elecstate::PotEfield::cal_v_eff ( const Charge *  chg, const UnitCell *  ucell, ModuleBase::matrix &  v_eff  )

inlineoverridevirtual

Reimplemented from elecstate::PotBase.

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Member Data Documentation

solvent_

const surchem* elecstate::PotEfield::solvent_ = nullptr

private

ucell_

const UnitCell* elecstate::PotEfield::ucell_ = nullptr

private

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The documentation for this class was generated from the following file:

• /home/runner/work/abacus-develop/abacus-develop/source/source_estate/module_pot/efield.h