#include <G4MoleculeDefinition.hh>

Inheritance diagram for G4MoleculeDefinition:

Public Member Functions
	G4MoleculeDefinition (const G4String &name, G4double mass, G4int electronsNumber, G4int electronicLevels, G4double diffCoeff, G4int atomsNumber=-1, G4double radius=-1, G4double lifetime=-1, G4String aType="", G4MoleculeID ID=G4MoleculeID::Create())

virtual	~G4MoleculeDefinition ()

void	SetLevelOccupation (G4int, G4int eNb=2)

void	SetDiffusionCoefficient (G4double)

G4double	GetDiffusionCoefficient () const

void	SetAtomsNumber (G4int)

G4int	GetAtomsNumber () const

void	SetVanDerVaalsRadius (G4double)

G4double	GetVanDerVaalsRadius () const

void	AddExcitedState (const G4String &)

const G4String &	GetExcitedState (const G4ElectronOccupancy *) const

void	AddDecayChannel (const G4String &, const G4MolecularDecayChannel *)

void	AddeConfToExcitedState (const G4String &, const G4ElectronOccupancy &, double decayTime=0.)

const std::vector< const G4MolecularDecayChannel * > *	GetDecayChannels (const G4ElectronOccupancy *) const

const std::vector< const G4MolecularDecayChannel * > *	GetDecayChannels (const G4String &) const

const G4ElectronOccupancy *	GetGroundStateElectronOccupancy () const

const G4String &	GetName () const

G4double	GetMass () const

const G4String &	GetType () const

G4int	GetNbElectrons () const

G4int	GetNbMolecularShells () const

const G4MolecularDecayTable *	GetDecayTable () const

G4MolecularDecayTable *	GetDecayTable ()

G4double	GetDecayTime () const

Public Member Functions inherited from G4ParticleDefinition
	G4ParticleDefinition (const G4String &aName, G4double mass, G4double width, G4double charge, G4int iSpin, G4int iParity, G4int iConjugation, G4int iIsospin, G4int iIsospinZ, G4int gParity, const G4String &pType, G4int lepton, G4int baryon, G4int encoding, G4bool stable, G4double lifetime, G4DecayTable *decaytable, G4bool shortlived=false, const G4String &subType="", G4int anti_encoding=0, G4double magneticMoment=0.0)

virtual	~G4ParticleDefinition ()

const G4String &	GetParticleName () const

G4double	GetPDGMass () const

G4double	GetPDGWidth () const

G4double	GetPDGCharge () const

G4double	GetPDGSpin () const

G4int	GetPDGiSpin () const

G4int	GetPDGiParity () const

G4int	GetPDGiConjugation () const

G4double	GetPDGIsospin () const

G4double	GetPDGIsospin3 () const

G4int	GetPDGiIsospin () const

G4int	GetPDGiIsospin3 () const

G4int	GetPDGiGParity () const

G4double	GetPDGMagneticMoment () const

void	SetPDGMagneticMoment (G4double mageticMoment)

G4double	CalculateAnomaly () const

const G4String &	GetParticleType () const

const G4String &	GetParticleSubType () const

G4int	GetLeptonNumber () const

G4int	GetBaryonNumber () const

G4int	GetPDGEncoding () const

G4int	GetAntiPDGEncoding () const

void	SetAntiPDGEncoding (G4int aEncoding)

G4int	GetQuarkContent (G4int flavor) const

G4int	GetAntiQuarkContent (G4int flavor) const

G4bool	IsShortLived () const

G4bool	GetPDGStable () const

void	SetPDGStable (const G4bool aFlag)

G4double	GetPDGLifeTime () const

void	SetPDGLifeTime (G4double aLifeTime)

G4DecayTable *	GetDecayTable () const

void	SetDecayTable (G4DecayTable *aDecayTable)

G4ProcessManager *	GetProcessManager () const

void	SetProcessManager (G4ProcessManager *aProcessManager)

G4ParticleTable *	GetParticleTable () const

void	DumpTable () const

G4int	GetAtomicNumber () const

G4int	GetAtomicMass () const

void	SetVerboseLevel (G4int value)

G4int	GetVerboseLevel () const

G4int	operator== (const G4ParticleDefinition &right) const

G4int	operator!= (const G4ParticleDefinition &right) const

void	SetApplyCutsFlag (G4bool)

G4bool	GetApplyCutsFlag () const

Protected Member Functions
	G4MoleculeDefinition ()

	G4MoleculeDefinition (const G4MoleculeDefinition &)

Protected Member Functions inherited from G4ParticleDefinition
G4int	FillQuarkContents ()

void	SetParticleSubType (const G4String &subtype)

void	SetAtomicNumber (G4int)

void	SetAtomicMass (G4int)

	G4ParticleDefinition (const G4ParticleDefinition &right)

	G4ParticleDefinition ()

Additional Inherited Members
Protected Types inherited from G4ParticleDefinition
enum	{ NumberOfQuarkFlavor = 6 }

Protected Attributes inherited from G4ParticleDefinition
G4int	theQuarkContent [NumberOfQuarkFlavor]

G4int	theAntiQuarkContent [NumberOfQuarkFlavor]

Detailed Description

Definition at line 59 of file G4MoleculeDefinition.hh.

Constructor & Destructor Documentation

◆ G4MoleculeDefinition() [1/3]

G4MoleculeDefinition::G4MoleculeDefinition	(	const G4String &	name,
		G4double	mass,
		G4int	electronsNumber,
		G4int	electronicLevels,
		G4double	diffCoeff,
		G4int	atomsNumber = `-1`,
		G4double	radius = `-1`,
		G4double	lifetime = `-1`,
		G4String	aType = `""`,
		G4MoleculeID	ID = `G4MoleculeID::Create()`
	)

Definition at line 45 of file G4MoleculeDefinition.cc.

                                            :
    G4ParticleDefinition(name, mass, 0., 0., 0, 0, 0, 0, 0, 0, "Molecule",
                         0, 0, ID, false, lifetime, NULL, false, aType, 0, 0.0),
    fMass(mass),
    fNbOfElectrons(electronsNumber), fNbOfMolecularShells(electronicLevels), fDiffusionCoefficient(diffCoeff),
    fAtomsNb(atomsNumber), fVanDerVaalsRadius(radius)
 
{
    fElectronOccupancy = new G4ElectronOccupancy(fNbOfMolecularShells);
    fDecayTable = NULL;
}

◆ ~G4MoleculeDefinition()

G4MoleculeDefinition::~G4MoleculeDefinition ( )

virtual

Definition at line 67 of file G4MoleculeDefinition.cc.

{
    if (fElectronOccupancy)
    {
        delete fElectronOccupancy;
        fElectronOccupancy = 0;
    }
    if (fDecayTable)
    {
        delete fDecayTable;
        fDecayTable = 0;
    }
    // fMolecularConfiguration = 0;
}

◆ G4MoleculeDefinition() [2/3]

G4MoleculeDefinition::G4MoleculeDefinition ( )

protected

Referenced by G4Electron_aq::Definition(), G4H2::Definition(), G4H2O::Definition(), G4H2O2::Definition(), G4H3O::Definition(), G4Hydrogen::Definition(), and G4OH::Definition().

◆ G4MoleculeDefinition() [3/3]

G4MoleculeDefinition::G4MoleculeDefinition ( const G4MoleculeDefinition & right )

protected

Definition at line 177 of file G4MoleculeDefinition.cc.

                                                                           :
    G4ParticleDefinition((const G4ParticleDefinition &)right),
    fMass(right.fMass),
    fNbOfElectrons (right.fNbOfElectrons),
    fNbOfMolecularShells(right.fNbOfMolecularShells),
    fDiffusionCoefficient( right.fDiffusionCoefficient),
    fAtomsNb( right.fAtomsNb),
    fVanDerVaalsRadius (right.fVanDerVaalsRadius)
{
    if(right.fElectronOccupancy!=0)
    {
        fElectronOccupancy= new G4ElectronOccupancy(*(right.fElectronOccupancy));
    }
    else fElectronOccupancy = 0;
 
    if(right.fDecayTable!=0)
    {
        fDecayTable = new G4MolecularDecayTable(*(right.fDecayTable));
    }
    else fDecayTable =0;
}

Member Function Documentation

◆ AddDecayChannel()

void G4MoleculeDefinition::AddDecayChannel	(	const G4String &	chanId,
		const G4MolecularDecayChannel *	chan
	)

Definition at line 133 of file G4MoleculeDefinition.cc.

{
    if (!fDecayTable)
    {
        fDecayTable = new G4MolecularDecayTable();
    }
    fDecayTable->AddDecayChannel(chanId, chan);
}

Referenced by G4EmDNAPhysicsChemistry::ConstructDecayChannels().

◆ AddeConfToExcitedState()

void G4MoleculeDefinition::AddeConfToExcitedState	(	const G4String &	exStId,
		const G4ElectronOccupancy &	conf,
		double	decayTime = `0.`
	)

Definition at line 82 of file G4MoleculeDefinition.cc.

{
    if (!fDecayTable)
    {
        fDecayTable = new G4MolecularDecayTable();
    }
    fDecayTable->AddeConfToExcitedState(exStId, conf);
    G4MolecularConfiguration::GetMolecularConfiguration(this,conf)->SetDecayTime(decayTime);
}

Referenced by G4EmDNAPhysicsChemistry::ConstructDecayChannels().

◆ AddExcitedState()

void G4MoleculeDefinition::AddExcitedState ( const G4String & val )

Definition at line 108 of file G4MoleculeDefinition.cc.

{
    if (!fDecayTable)
    {
        fDecayTable = new G4MolecularDecayTable();
    }
 
    fDecayTable->AddExcitedState(val);
 
}

Referenced by G4EmDNAPhysicsChemistry::ConstructDecayChannels().

◆ GetAtomsNumber()

G4int G4MoleculeDefinition::GetAtomsNumber ( ) const

inline

Definition at line 168 of file G4MoleculeDefinition.hh.

{
    return fAtomsNb;
}

Referenced by G4MolecularConfiguration::GetAtomsNumber().

◆ GetDecayChannels() [1/2]

const vector< const G4MolecularDecayChannel * > * G4MoleculeDefinition::GetDecayChannels ( const G4ElectronOccupancy * occ ) const

Definition at line 158 of file G4MoleculeDefinition.cc.

{
    if (fDecayTable)
    {
        const vector<const G4MolecularDecayChannel*>* output = fDecayTable->GetDecayChannels(occ);
        return output;
    }
    else
    {
        G4String const errMsg = ": no Excited States and Decays for"+ GetName() + " are defined.";
        G4Exception("G4MoleculeDefinition::GetDecayChannels","",FatalErrorInArgument,errMsg);
    }
    return 0;
}

◆ GetDecayChannels() [2/2]

const vector< const G4MolecularDecayChannel * > * G4MoleculeDefinition::GetDecayChannels ( const G4String & ExState ) const

Definition at line 143 of file G4MoleculeDefinition.cc.

{
    if (fDecayTable)
    {
        const vector<const G4MolecularDecayChannel*>* output = fDecayTable->GetDecayChannels(ExState);
        return output;
    }
    else
    {
        G4String const errMsg = ": no Excited States and Decays for"+ GetName() + " are defined.";
        G4Exception("G4MoleculeDefinition::GetDecayChannels","",FatalErrorInArgument,errMsg);
    }
    return 0;
}

◆ GetDecayTable() [1/2]

G4MolecularDecayTable * G4MoleculeDefinition::GetDecayTable ( )

inline

Definition at line 222 of file G4MoleculeDefinition.hh.

{
    return fDecayTable;
}

◆ GetDecayTable() [2/2]

const G4MolecularDecayTable * G4MoleculeDefinition::GetDecayTable ( ) const

inline

Definition at line 217 of file G4MoleculeDefinition.hh.

{
    return fDecayTable;
}

Referenced by G4MolecularConfiguration::PrintState().

◆ GetDecayTime()

G4double G4MoleculeDefinition::GetDecayTime ( ) const

inline

Definition at line 158 of file G4MoleculeDefinition.hh.

{
    return GetPDGLifeTime();
}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetDiffusionCoefficient()

G4double G4MoleculeDefinition::GetDiffusionCoefficient ( ) const

inline

Definition at line 153 of file G4MoleculeDefinition.hh.

{
    return fDiffusionCoefficient;
}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetExcitedState()

const G4String & G4MoleculeDefinition::GetExcitedState ( const G4ElectronOccupancy * occ ) const

Definition at line 119 of file G4MoleculeDefinition.cc.

{
    if (fDecayTable)
    {
        return fDecayTable->GetExcitedState(occ);
    }
    else
    {
        G4String const errMsg = ": no Excited States and Decays for"+ GetName() + " are defined.";
        G4Exception("G4MoleculeDefinition::GetExcitedState","",FatalErrorInArgument,errMsg);
    }
    return *(new G4String(""));
}

◆ GetGroundStateElectronOccupancy()

const G4ElectronOccupancy * G4MoleculeDefinition::GetGroundStateElectronOccupancy ( ) const

inline

Definition at line 183 of file G4MoleculeDefinition.hh.

{
    return fElectronOccupancy;
}

Referenced by G4EmDNAPhysicsChemistry::ConstructDecayChannels(), G4Molecule::G4Molecule(), G4MolecularConfiguration::GetMolecularConfiguration(), and G4MolecularConfiguration::PrintState().

◆ GetMass()

G4double G4MoleculeDefinition::GetMass ( ) const

inline

Definition at line 194 of file G4MoleculeDefinition.hh.

{
    return fMass;
}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetName()

const G4String & G4MoleculeDefinition::GetName ( ) const

inline

Definition at line 188 of file G4MoleculeDefinition.hh.

{
 
    return GetParticleName();
}

Referenced by GetDecayChannels(), GetExcitedState(), and G4MolecularConfiguration::GetName().

◆ GetNbElectrons()

G4int G4MoleculeDefinition::GetNbElectrons ( ) const

inline

Definition at line 205 of file G4MoleculeDefinition.hh.

{
 
    return fNbOfElectrons;
}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetNbMolecularShells()

G4int G4MoleculeDefinition::GetNbMolecularShells ( ) const

inline

Definition at line 211 of file G4MoleculeDefinition.hh.

{
 
    return fNbOfMolecularShells;
}

◆ GetType()

const G4String & G4MoleculeDefinition::GetType ( ) const

inline

Definition at line 199 of file G4MoleculeDefinition.hh.

{
 
    return GetParticleSubType();
}

◆ GetVanDerVaalsRadius()

G4double G4MoleculeDefinition::GetVanDerVaalsRadius ( ) const

inline

Definition at line 178 of file G4MoleculeDefinition.hh.

{
    return fVanDerVaalsRadius;
}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ SetAtomsNumber()

void G4MoleculeDefinition::SetAtomsNumber ( G4int val )

inline

Definition at line 163 of file G4MoleculeDefinition.hh.

{
    fAtomsNb = val;
}

◆ SetDiffusionCoefficient()

void G4MoleculeDefinition::SetDiffusionCoefficient ( G4double value )

inline

Definition at line 148 of file G4MoleculeDefinition.hh.

{
    fDiffusionCoefficient = value;
}

◆ SetLevelOccupation()

void G4MoleculeDefinition::SetLevelOccupation	(	G4int	shell,
		G4int	eNb = `2`
	)

Definition at line 94 of file G4MoleculeDefinition.cc.

{
    G4int levelOccupancy = fElectronOccupancy->GetOccupancy(shell);
 
    if (levelOccupancy)
    {
 
        fElectronOccupancy->RemoveElectron(shell, levelOccupancy);
    }
 
    fElectronOccupancy->AddElectron(shell,eNb);
 
}

Referenced by G4Electron_aq::Definition(), G4H2::Definition(), and G4Hydrogen::Definition().

◆ SetVanDerVaalsRadius()

void G4MoleculeDefinition::SetVanDerVaalsRadius ( G4double val )

inline

Definition at line 173 of file G4MoleculeDefinition.hh.

{
    fVanDerVaalsRadius = val;
}

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

Public Member Functions

Protected Member Functions

Additional Inherited Members

Detailed Description

Constructor & Destructor Documentation

◆ G4MoleculeDefinition() [1/3]

◆ ~G4MoleculeDefinition()

◆ G4MoleculeDefinition() [2/3]

◆ G4MoleculeDefinition() [3/3]

Member Function Documentation

◆ AddDecayChannel()

◆ AddeConfToExcitedState()

◆ AddExcitedState()

◆ GetAtomsNumber()

◆ GetDecayChannels() [1/2]

◆ GetDecayChannels() [2/2]

◆ GetDecayTable() [1/2]

◆ GetDecayTable() [2/2]

◆ GetDecayTime()

◆ GetDiffusionCoefficient()

◆ GetExcitedState()

◆ GetGroundStateElectronOccupancy()

◆ GetMass()

◆ GetName()

◆ GetNbElectrons()

◆ GetNbMolecularShells()

◆ GetType()

◆ GetVanDerVaalsRadius()

◆ SetAtomsNumber()

◆ SetDiffusionCoefficient()

◆ SetLevelOccupation()

◆ SetVanDerVaalsRadius()