Geant4 10.7.0
Toolkit for the simulation of the passage of particles through matter
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Public Member Functions | Static Public Member Functions | Protected Member Functions | List of all members
G4MoleculeDefinition Class Reference

#include <G4MoleculeDefinition.hh>

+ Inheritance diagram for G4MoleculeDefinition:

Public Member Functions

 G4MoleculeDefinition (const G4String &name, G4double mass, G4double diffCoeff, G4int charge=0, G4int electronicLevels=0, G4double radius=-1, G4int atomsNumber=-1, G4double lifetime=-1, G4String aType="", G4FakeParticleID ID=G4FakeParticleID::Create())
 
virtual ~G4MoleculeDefinition ()
 
 G4MoleculeDefinition (const G4MoleculeDefinition &)=delete
 
G4MoleculeDefinition & operator= (const G4MoleculeDefinition &)=delete
 
void SetLevelOccupation (G4int, G4int eNb=2)
 
void SetDiffusionCoefficient (G4double)
 
G4double GetDiffusionCoefficient () const
 
void SetAtomsNumber (G4int)
 
G4int GetAtomsNumber () const
 
void SetVanDerVaalsRadius (G4double)
 
G4double GetVanDerVaalsRadius () const
 
G4MolecularConfiguration * NewConfiguration (const G4String &excitedStateLabel)
 
G4MolecularConfiguration * NewConfigurationWithElectronOccupancy (const G4String &excitedStateLabel, const G4ElectronOccupancy &, double decayTime=0.)
 
G4MolecularConfiguration * GetConfigurationWithLabel (const G4String &molecularConfLabel)
 
void AddDecayChannel (const G4MolecularConfiguration *molConf, const G4MolecularDissociationChannel *channel)
 
void AddDecayChannel (const G4String &molecularConfLabel, const G4MolecularDissociationChannel *channel)
 
const std::vector< const G4MolecularDissociationChannel * > * GetDecayChannels (const G4MolecularConfiguration *) const
 
const std::vector< const G4MolecularDissociationChannel * > * GetDecayChannels (const G4String &) const
 
const G4MolecularDissociationTable * GetDecayTable () const
 
G4MolecularDissociationTable * GetDecayTable ()
 
G4double GetDecayTime () const
 
const G4ElectronOccupancy * GetGroundStateElectronOccupancy () const
 
G4int GetCharge () const
 
const G4String & GetName () const
 
G4double GetMass () const
 
const G4String & GetType () const
 
G4int GetNbElectrons () const
 
G4int GetNbMolecularShells () const
 
const G4String & GetFormatedName () const
 
void SetFormatedName (const G4String &name)
 
void Finalize ()
 
void Serialize (std::ostream &)
 
- 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 ()
 
 G4ParticleDefinition (const G4ParticleDefinition &)=delete
 
G4ParticleDefinition & operator= (const G4ParticleDefinition &)=delete
 
G4bool operator== (const G4ParticleDefinition &right) const
 
G4bool operator!= (const G4ParticleDefinition &right) const
 
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)
 
G4double GetIonLifeTime () const
 
G4DecayTable * GetDecayTable () const
 
void SetDecayTable (G4DecayTable *aDecayTable)
 
G4ProcessManager * GetProcessManager () const
 
void SetProcessManager (G4ProcessManager *aProcessManager)
 
G4ParticleTable * GetParticleTable () const
 
G4int GetAtomicNumber () const
 
G4int GetAtomicMass () const
 
void DumpTable () const
 
void SetVerboseLevel (G4int value)
 
G4int GetVerboseLevel () const
 
void SetApplyCutsFlag (G4bool)
 
G4bool GetApplyCutsFlag () const
 
G4bool IsGeneralIon () const
 
G4bool IsMuonicAtom () const
 
G4ProcessManager * GetMasterProcessManager () const
 
void SetMasterProcessManager (G4ProcessManager *aNewPM)
 
G4int GetInstanceID () const
 
void SetParticleDefinitionID (G4int id=-1)
 
G4int GetParticleDefinitionID () const
 

Static Public Member Functions

static G4MoleculeDefinition * Load (std::istream &)
 
- Static Public Member Functions inherited from G4ParticleDefinition
static const G4PDefManager & GetSubInstanceManager ()
 
static void Clean ()
 

Protected Member Functions

 G4MoleculeDefinition ()
 
- Protected Member Functions inherited from G4ParticleDefinition
 G4ParticleDefinition ()
 
G4int FillQuarkContents ()
 
void SetParticleSubType (const G4String &subtype)
 
void SetAtomicNumber (G4int)
 
void SetAtomicMass (G4int)
 

Additional Inherited Members

- Protected Types inherited from G4ParticleDefinition
enum  { NumberOfQuarkFlavor = 6 }
 
- Protected Attributes inherited from G4ParticleDefinition
G4int theQuarkContent [NumberOfQuarkFlavor]
 
G4int theAntiQuarkContent [NumberOfQuarkFlavor]
 
G4bool isGeneralIon = false
 
G4bool isMuonicAtom = false
 

Detailed Description

Definition at line 76 of file G4MoleculeDefinition.hh.

Constructor & Destructor Documentation

◆ G4MoleculeDefinition() [1/3]

G4MoleculeDefinition::G4MoleculeDefinition ( const G4String &  name,
G4double  mass,
G4double  diffCoeff,
G4int  charge = 0,
G4int  electronicLevels = 0,
G4double  radius = -1,
G4int  atomsNumber = -1,
G4double  lifetime = -1,
G4String  aType = "",
G4FakeParticleID  ID = G4FakeParticleID::Create() 
)

Definition at line 45 of file G4MoleculeDefinition.cc.

54 :
55 G4ParticleDefinition(name, mass, 0., charge, 0, 0, 0, 0, 0, 0, "Molecule",
56 0, 0, ID, false, lifetime, NULL, false, aType, 0, 0.0),
57 fDiffusionCoefficient(diffCoeff),
58 fAtomsNb(atomsNumber),
59 fVanDerVaalsRadius(radius)
60
61{
62 fCharge = charge;
63 if(electronicLevels)
64 {
65 fElectronOccupancy = new G4ElectronOccupancy(electronicLevels);
66 }
67 else
68 {
69 fElectronOccupancy = 0;
70 }
71 fDecayTable = NULL;
72 G4MoleculeTable::Instance()->Insert(this);
73}
G4MoleculeTable::Insert
void Insert(G4MoleculeDefinition *)
Definition: G4MoleculeTable.cc:138
G4MoleculeTable::Instance
static G4MoleculeTable * Instance()
Definition: G4MoleculeTable.cc:53

◆ ~G4MoleculeDefinition()

G4MoleculeDefinition::~G4MoleculeDefinition ( )
virtual

Definition at line 130 of file G4MoleculeDefinition.cc.

131{
132 if (fElectronOccupancy)
133 {
134 delete fElectronOccupancy;
135 fElectronOccupancy = 0;
136 }
137 if (fDecayTable)
138 {
139 delete fDecayTable;
140 fDecayTable = 0;
141 }
142}

◆ G4MoleculeDefinition() [2/3]

G4MoleculeDefinition::G4MoleculeDefinition ( const G4MoleculeDefinition &  )
delete

◆ G4MoleculeDefinition() [3/3]

G4MoleculeDefinition::G4MoleculeDefinition ( )
protected

Referenced by G4DamagedDeoxyribose::Definition(), G4DamagedAdenine::Definition(), G4DamagedGuanine::Definition(), G4DamagedThymine::Definition(), G4DamagedCytosine::Definition(), G4Deoxyribose::Definition(), G4Phosphate::Definition(), G4Adenine::Definition(), G4Guanine::Definition(), G4Thymine::Definition(), G4Cytosine::Definition(), G4ModifiedHistone::Definition(), G4Histone::Definition(), G4Electron_aq::Definition(), G4FakeMolecule::Definition(), G4H2::Definition(), G4H2O::Definition(), G4H2O2::Definition(), G4H3O::Definition(), G4HO2::Definition(), G4Hydrogen::Definition(), G4O2::Definition(), G4O3::Definition(), G4OH::Definition(), G4Oxygen::Definition(), and Load().

Member Function Documentation

◆ AddDecayChannel() [1/2]

void G4MoleculeDefinition::AddDecayChannel ( const G4MolecularConfiguration *  molConf,
const G4MolecularDissociationChannel *  channel 
)

Definition at line 223 of file G4MoleculeDefinition.cc.

225{
226 if (!fDecayTable)
227 {
228 fDecayTable = new G4MolecularDissociationTable();
229 }
230 fDecayTable->AddChannel(molConf, channel);
231}
G4MolecularDissociationTable::AddChannel
void AddChannel(const G4MolecularConfiguration *molConf, const G4MolecularDissociationChannel *channel)
Definition: G4MolecularDissociationTable.cc:132

Referenced by G4EmDNAChemistry::ConstructDissociationChannels(), G4EmDNAChemistry_option1::ConstructDissociationChannels(), G4EmDNAChemistry_option3::ConstructDissociationChannels(), and G4EmDNAChemistry_option2::ConstructDissociationChannels().

◆ AddDecayChannel() [2/2]

void G4MoleculeDefinition::AddDecayChannel ( const G4String &  molecularConfLabel,
const G4MolecularDissociationChannel *  channel 
)

Definition at line 208 of file G4MoleculeDefinition.cc.

210{
211 if(!fDecayTable)
212 {
213 fDecayTable = new G4MolecularDissociationTable();
214 }
215
216 fDecayTable->AddChannel(G4MolecularConfiguration::GetMolecularConfiguration(this,
217 molecularConfLabel),
218 channel);
219}
G4MolecularConfiguration::GetMolecularConfiguration
static G4MolecularConfiguration * GetMolecularConfiguration(const G4MoleculeDefinition *, const G4String &label)
Definition: G4MolecularConfiguration.cc:988

◆ Finalize()

void G4MoleculeDefinition::Finalize ( )

Definition at line 284 of file G4MoleculeDefinition.cc.

285{
286 G4MoleculeTable::Instance()->Finalize(this);
287}
G4MoleculeTable::Finalize
void Finalize(G4MoleculeDefinition *)
Definition: G4MoleculeTable.hh:112

◆ GetAtomsNumber()

G4int G4MoleculeDefinition::GetAtomsNumber ( ) const
inline

Definition at line 225 of file G4MoleculeDefinition.hh.

226{
227 return fAtomsNb;
228}

Referenced by G4MolecularConfiguration::GetAtomsNumber().

◆ GetCharge()

G4int G4MoleculeDefinition::GetCharge ( ) const
inline

Definition at line 210 of file G4MoleculeDefinition.hh.

211{
212 return fCharge;
213}

Referenced by G4MolecularConfiguration::CreateMolecularConfiguration(), G4MolecularConfiguration::G4MolecularConfiguration(), and G4MolecularConfiguration::GetOrCreateMolecularConfiguration().

◆ GetConfigurationWithLabel()

G4MolecularConfiguration * G4MoleculeDefinition::GetConfigurationWithLabel ( const G4String &  molecularConfLabel)

Definition at line 160 of file G4MoleculeDefinition.cc.

161{
162 return G4MolecularConfiguration::GetMolecularConfiguration(this,
163 molecularConfLabel);
164}

◆ GetDecayChannels() [1/2]

const vector< const G4MolecularDissociationChannel * > * G4MoleculeDefinition::GetDecayChannels ( const G4MolecularConfiguration *  conf) const

Definition at line 259 of file G4MoleculeDefinition.cc.

261{
262 if(fDecayTable)
263 {
264 const vector<const G4MolecularDissociationChannel*>* output =
265 fDecayTable->GetDecayChannels(conf);
266 return output;
267 }
268// else
269// {
270// G4ExceptionDescription errMsg;
271// errMsg << ": no Excited States and Decays for"
272// << GetName()
273// << " are defined.";
274// G4Exception("G4MoleculeDefinition::GetDecayChannels",
275// "",
276// FatalErrorInArgument,
277// errMsg);
278// }
279 return 0;
280}
G4MolecularDissociationTable::GetDecayChannels
const std::vector< const G4MolecularDissociationChannel * > * GetDecayChannels(const G4MolecularConfiguration *) const
Definition: G4MolecularDissociationTable.cc:99

Referenced by G4MolecularConfiguration::GetDissociationChannels().

◆ GetDecayChannels() [2/2]

const vector< const G4MolecularDissociationChannel * > * G4MoleculeDefinition::GetDecayChannels ( const G4String &  ExState) const

Definition at line 236 of file G4MoleculeDefinition.cc.

237{
238 if (fDecayTable)
239 {
240 const vector<const G4MolecularDissociationChannel*>* output =
241 fDecayTable->GetDecayChannels(ExState);
242 return output;
243 }
244 else
245 {
246 G4ExceptionDescription errMsg;
247 errMsg << ": no Excited States and Decays for"
248 << GetName()
249 << " are defined.";
250 G4Exception("G4MoleculeDefinition::GetDecayChannels", "",
251 FatalErrorInArgument, errMsg);
252 }
253 return 0;
254}
FatalErrorInArgument
@ FatalErrorInArgument
Definition: G4ExceptionSeverity.hh:62
G4Exception
void G4Exception(const char *originOfException, const char *exceptionCode, G4ExceptionSeverity severity, const char *description)
Definition: G4Exception.cc:35
G4ExceptionDescription
std::ostringstream G4ExceptionDescription
Definition: G4Exception.hh:40
G4MoleculeDefinition::GetName
const G4String & GetName() const
Definition: G4MoleculeDefinition.hh:245

◆ GetDecayTable() [1/2]

G4MolecularDissociationTable * G4MoleculeDefinition::GetDecayTable ( )
inline

Definition at line 287 of file G4MoleculeDefinition.hh.

288{
289 return fDecayTable;
290}

◆ GetDecayTable() [2/2]

const G4MolecularDissociationTable * G4MoleculeDefinition::GetDecayTable ( ) const
inline

Definition at line 282 of file G4MoleculeDefinition.hh.

283{
284 return fDecayTable;
285}

◆ GetDecayTime()

G4double G4MoleculeDefinition::GetDecayTime ( ) const
inline

Definition at line 215 of file G4MoleculeDefinition.hh.

216{
217 return GetPDGLifeTime();
218}
G4ParticleDefinition::GetPDGLifeTime
G4double GetPDGLifeTime() const

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetDiffusionCoefficient()

G4double G4MoleculeDefinition::GetDiffusionCoefficient ( ) const
inline

Definition at line 205 of file G4MoleculeDefinition.hh.

206{
207 return fDiffusionCoefficient;
208}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetFormatedName()

const G4String & G4MoleculeDefinition::GetFormatedName ( ) const
inline

Definition at line 162 of file G4MoleculeDefinition.hh.

163 {
164 return fFormatedName;
165 }

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetGroundStateElectronOccupancy()

const G4ElectronOccupancy * G4MoleculeDefinition::GetGroundStateElectronOccupancy ( ) const
inline

Definition at line 240 of file G4MoleculeDefinition.hh.

241{
242 return fElectronOccupancy;
243}

Referenced by G4EmDNAChemistry::ConstructDissociationChannels(), G4EmDNAChemistry_option1::ConstructDissociationChannels(), G4EmDNAChemistry_option3::ConstructDissociationChannels(), G4EmDNAChemistry_option2::ConstructDissociationChannels(), G4MolecularConfiguration::CreateMolecularConfiguration(), G4Molecule::G4Molecule(), G4MolecularConfiguration::GetOrCreateMolecularConfiguration(), and G4MolecularConfiguration::PrintState().

◆ GetMass()

G4double G4MoleculeDefinition::GetMass ( ) const
inline

Definition at line 251 of file G4MoleculeDefinition.hh.

252{
253 return GetPDGMass();
254}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetName()

const G4String & G4MoleculeDefinition::GetName ( ) const
inline

Definition at line 245 of file G4MoleculeDefinition.hh.

246{
247
248 return GetParticleName();
249}
G4ParticleDefinition::GetParticleName
const G4String & GetParticleName() const
Definition: G4ParticleDefinition.hh:108

Referenced by G4MolecularConfiguration::CheckElectronOccupancy(), G4MolecularConfiguration::CreateMolecularConfiguration(), G4MolecularConfiguration::G4MolecularConfiguration(), GetDecayChannels(), G4MolecularConfiguration::GetOrCreateMolecularConfiguration(), G4MoleculeTable::Insert(), NewConfiguration(), NewConfigurationWithElectronOccupancy(), and G4MolecularConfiguration::Serialize().

◆ GetNbElectrons()

G4int G4MoleculeDefinition::GetNbElectrons ( ) const
inline

Definition at line 261 of file G4MoleculeDefinition.hh.

262{
263 if (fElectronOccupancy)
264 {
265 return fElectronOccupancy->GetTotalOccupancy();
266 }
267
268 return 0;
269 // return fNbOfElectrons;
270}
G4ElectronOccupancy::GetTotalOccupancy
G4int GetTotalOccupancy() const
Definition: G4ElectronOccupancy.hh:120

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ GetNbMolecularShells()

G4int G4MoleculeDefinition::GetNbMolecularShells ( ) const
inline

Definition at line 272 of file G4MoleculeDefinition.hh.

273{
274 if (fElectronOccupancy)
275 {
276 return fElectronOccupancy->GetSizeOfOrbit();
277 }
278
279 return 0;
280}

◆ GetType()

const G4String & G4MoleculeDefinition::GetType ( ) const
inline

Definition at line 256 of file G4MoleculeDefinition.hh.

257{
258 return GetParticleSubType();
259}
G4ParticleDefinition::GetParticleSubType
const G4String & GetParticleSubType() const
Definition: G4ParticleDefinition.hh:130

◆ GetVanDerVaalsRadius()

G4double G4MoleculeDefinition::GetVanDerVaalsRadius ( ) const
inline

Definition at line 235 of file G4MoleculeDefinition.hh.

236{
237 return fVanDerVaalsRadius;
238}

Referenced by G4MolecularConfiguration::G4MolecularConfiguration().

◆ Load()

G4MoleculeDefinition * G4MoleculeDefinition::Load ( std::istream &  in)
static

Definition at line 75 of file G4MoleculeDefinition.cc.

76{
77 G4String name;
78 G4double mass;
79 G4double diffCoeff;
80 G4int charge;
81 G4int electronicLevels;
82 G4double radius;
83 G4int atomsNumber;
84 G4double lifetime;
85 G4String aType;
86
87 READ(in,name);
88 READ(in,mass);
89 READ(in,diffCoeff);
90 READ(in,charge);
91 READ(in,electronicLevels);
92 READ(in,radius);
93 READ(in,atomsNumber);
94 READ(in,lifetime);
95 READ(in,aType);
96
97 return new G4MoleculeDefinition(name,
98 mass,
99 diffCoeff,
100 charge,
101 electronicLevels,
102 radius,
103 atomsNumber,
104 lifetime,
105 aType);
106}
READ
void READ(std::istream &in, T &toBeSaved)
Definition: G4Serialize.hh:49
G4double
double G4double
Definition: G4Types.hh:83
G4int
int G4int
Definition: G4Types.hh:85
G4InuclParticleNames::name
const char * name(G4int ptype)
Definition: G4InuclParticleNames.hh:76

◆ NewConfiguration()

G4MolecularConfiguration * G4MoleculeDefinition::NewConfiguration ( const G4String &  excitedStateLabel)

Definition at line 147 of file G4MoleculeDefinition.cc.

148{
149 bool alreadyExist(false);
150 return G4MolecularConfiguration::CreateMolecularConfiguration(GetName()+"_"+
151 molConfLabel,
152 this,
153 molConfLabel,
154 alreadyExist);
155}
G4MolecularConfiguration::CreateMolecularConfiguration
static G4MolecularConfiguration * CreateMolecularConfiguration(const G4String &userIdentifier, const G4MoleculeDefinition *, bool &wasAlreadyCreated)
Definition: G4MolecularConfiguration.cc:1098

◆ NewConfigurationWithElectronOccupancy()

G4MolecularConfiguration * G4MoleculeDefinition::NewConfigurationWithElectronOccupancy ( const G4String &  excitedStateLabel,
const G4ElectronOccupancy &  elecConf,
double  decayTime = 0. 
)

Definition at line 169 of file G4MoleculeDefinition.cc.

173{
174 bool alreadyExist(false);
175 G4MolecularConfiguration* conf =
176 G4MolecularConfiguration::CreateMolecularConfiguration(GetName()+"_"+
177 exStId,
178 this,
179 exStId,
180 elecConf,
181 alreadyExist);
182
183 conf->SetDecayTime(decayTime);
184
185 return conf;
186}

Referenced by G4EmDNAChemistry::ConstructDissociationChannels(), G4EmDNAChemistry_option1::ConstructDissociationChannels(), G4EmDNAChemistry_option3::ConstructDissociationChannels(), and G4EmDNAChemistry_option2::ConstructDissociationChannels().

◆ operator=()

G4MoleculeDefinition & G4MoleculeDefinition::operator= ( const G4MoleculeDefinition &  )
delete

◆ Serialize()

void G4MoleculeDefinition::Serialize ( std::ostream &  out)

Definition at line 108 of file G4MoleculeDefinition.cc.

109{
110 WRITE(out,this->G4ParticleDefinition::GetParticleName());
111 WRITE(out,this->G4ParticleDefinition::GetPDGMass());
112 WRITE(out,this->G4ParticleDefinition::GetPDGLifeTime());
113 WRITE(out,this->G4ParticleDefinition::GetParticleType());
114 WRITE(out,fDiffusionCoefficient);
115 WRITE(out,fCharge);
116 if(fElectronOccupancy)
117 {
118 WRITE(out,fElectronOccupancy->GetSizeOfOrbit());
119 }
120 else
121 {
122 WRITE(out,(int) 0);
123 }
124 WRITE(out,fVanDerVaalsRadius);
125 WRITE(out,fAtomsNb);
126}
WRITE
void WRITE(std::ostream &out, const T &toBeSaved)
Definition: G4Serialize.hh:41
G4ParticleDefinition::GetParticleType
const G4String & GetParticleType() const
Definition: G4ParticleDefinition.hh:129

◆ SetAtomsNumber()

void G4MoleculeDefinition::SetAtomsNumber ( G4int  val)
inline

Definition at line 220 of file G4MoleculeDefinition.hh.

221{
222 fAtomsNb = val;
223}

◆ SetDiffusionCoefficient()

void G4MoleculeDefinition::SetDiffusionCoefficient ( G4double  value)
inline

Definition at line 200 of file G4MoleculeDefinition.hh.

201{
202 fDiffusionCoefficient = value;
203}

◆ SetFormatedName()

void G4MoleculeDefinition::SetFormatedName ( const G4String &  name)
inline

Definition at line 168 of file G4MoleculeDefinition.hh.

169 {
170 fFormatedName = name;
171 }

◆ SetLevelOccupation()

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

Definition at line 190 of file G4MoleculeDefinition.cc.

191{
192 if(fElectronOccupancy)
193 {
194 G4int levelOccupancy = fElectronOccupancy->GetOccupancy(shell);
195
196 if(levelOccupancy)
197 {
198
199 fElectronOccupancy->RemoveElectron(shell, levelOccupancy);
200 }
201
202 fElectronOccupancy->AddElectron(shell, eNb);
203 }
204}
G4ElectronOccupancy::AddElectron
G4int AddElectron(G4int orbit, G4int number=1)
Definition: G4ElectronOccupancy.cc:139
G4ElectronOccupancy::RemoveElectron
G4int RemoveElectron(G4int orbit, G4int number=1)
Definition: G4ElectronOccupancy.cc:161
G4ElectronOccupancy::GetOccupancy
G4int GetOccupancy(G4int orbit) const
Definition: G4ElectronOccupancy.hh:126

◆ SetVanDerVaalsRadius()

void G4MoleculeDefinition::SetVanDerVaalsRadius ( G4double  val)
inline

Definition at line 230 of file G4MoleculeDefinition.hh.

231{
232 fVanDerVaalsRadius = val;
233}
The documentation for this class was generated from the following files: