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25 // 25 //
26 // 26 //
27 // Author: Luciano Pandola 27 // Author: Luciano Pandola
28 // on base of G4LowEnergyIonisation de 28 // on base of G4LowEnergyIonisation developed by A.Forti and V.Ivanchenko
29 // 29 //
30 // History: 30 // History:
31 // -------- 31 // --------
32 // 12 Jan 2009 L Pandola Migration from p 32 // 12 Jan 2009 L Pandola Migration from process to model
33 // 03 Mar 2009 L Pandola Bug fix (release 33 // 03 Mar 2009 L Pandola Bug fix (release memory in the destructor)
34 // 15 Apr 2009 V Ivanchenko Cleanup initiali 34 // 15 Apr 2009 V Ivanchenko Cleanup initialisation and generation of secondaries:
35 // - apply internal high-ener 35 // - apply internal high-energy limit only in constructor
36 // - do not apply low-energy 36 // - do not apply low-energy limit (default is 0)
37 // - simplify sampling of dee 37 // - simplify sampling of deexcitation by using cut in energy
38 // - set activation of Auger 38 // - set activation of Auger "false"
39 // - remove initialisation of 39 // - remove initialisation of element selectors
40 // 19 May 2009 L Pandola Explicitely set 40 // 19 May 2009 L Pandola Explicitely set to zero pointers deleted in
41 // Initialise(), si 41 // Initialise(), since they might be checked later on
42 // 23 Oct 2009 L Pandola 42 // 23 Oct 2009 L Pandola
43 // - atomic deexcitation mana 43 // - atomic deexcitation managed via G4VEmModel::DeexcitationFlag() is
44 // set as "true" (default w 44 // set as "true" (default would be false)
45 // 12 Oct 2010 L Pandola 45 // 12 Oct 2010 L Pandola
46 // - add debugging informatio 46 // - add debugging information about energy in
47 // SampleDeexcitationAlongS 47 // SampleDeexcitationAlongStep()
48 // - generate fluorescence Sa 48 // - generate fluorescence SampleDeexcitationAlongStep() only above
49 // the cuts. 49 // the cuts.
50 // 01 Jun 2011 V Ivanchenko general cleanup 50 // 01 Jun 2011 V Ivanchenko general cleanup - all old deexcitation code removed
51 // 51 //
52 52
53 #include "G4LivermoreIonisationModel.hh" 53 #include "G4LivermoreIonisationModel.hh"
54 #include "G4PhysicalConstants.hh" 54 #include "G4PhysicalConstants.hh"
55 #include "G4SystemOfUnits.hh" 55 #include "G4SystemOfUnits.hh"
56 #include "G4ParticleDefinition.hh" 56 #include "G4ParticleDefinition.hh"
57 #include "G4MaterialCutsCouple.hh" 57 #include "G4MaterialCutsCouple.hh"
58 #include "G4ProductionCutsTable.hh" 58 #include "G4ProductionCutsTable.hh"
59 #include "G4DynamicParticle.hh" 59 #include "G4DynamicParticle.hh"
60 #include "G4Element.hh" 60 #include "G4Element.hh"
61 #include "G4ParticleChangeForLoss.hh" 61 #include "G4ParticleChangeForLoss.hh"
62 #include "G4Electron.hh" 62 #include "G4Electron.hh"
63 #include "G4CrossSectionHandler.hh" 63 #include "G4CrossSectionHandler.hh"
64 #include "G4VEMDataSet.hh" 64 #include "G4VEMDataSet.hh"
65 #include "G4eIonisationCrossSectionHandler.hh" 65 #include "G4eIonisationCrossSectionHandler.hh"
66 #include "G4eIonisationSpectrum.hh" 66 #include "G4eIonisationSpectrum.hh"
67 #include "G4VEnergySpectrum.hh" 67 #include "G4VEnergySpectrum.hh"
68 #include "G4SemiLogInterpolation.hh" 68 #include "G4SemiLogInterpolation.hh"
69 #include "G4AtomicTransitionManager.hh" 69 #include "G4AtomicTransitionManager.hh"
70 #include "G4AtomicShell.hh" 70 #include "G4AtomicShell.hh"
71 #include "G4DeltaAngle.hh" 71 #include "G4DeltaAngle.hh"
72 72
73 //....oooOO0OOooo........oooOO0OOooo........oo 73 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
74 74
75 75
76 G4LivermoreIonisationModel::G4LivermoreIonisat 76 G4LivermoreIonisationModel::G4LivermoreIonisationModel(const G4ParticleDefinition*,
77 const G4String& nam) : 77 const G4String& nam) :
78 G4VEmModel(nam), fParticleChange(nullptr), << 78 G4VEmModel(nam), fParticleChange(0),
79 crossSectionHandler(nullptr), energySpectrum << 79 isInitialised(false),
80 isInitialised(false) << 80 crossSectionHandler(0), energySpectrum(0)
81 { 81 {
82 fIntrinsicLowEnergyLimit = 12.*eV; 82 fIntrinsicLowEnergyLimit = 12.*eV;
83 fIntrinsicHighEnergyLimit = 100.0*GeV; 83 fIntrinsicHighEnergyLimit = 100.0*GeV;
84 84
85 verboseLevel = 0; 85 verboseLevel = 0;
86 SetAngularDistribution(new G4DeltaAngle()); 86 SetAngularDistribution(new G4DeltaAngle());
87 87
88 transitionManager = G4AtomicTransitionManage 88 transitionManager = G4AtomicTransitionManager::Instance();
89 } 89 }
90 90
91 //....oooOO0OOooo........oooOO0OOooo........oo 91 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
92 92
93 G4LivermoreIonisationModel::~G4LivermoreIonisa 93 G4LivermoreIonisationModel::~G4LivermoreIonisationModel()
94 { 94 {
95 delete energySpectrum; 95 delete energySpectrum;
96 delete crossSectionHandler; 96 delete crossSectionHandler;
97 } 97 }
98 98
99 //....oooOO0OOooo........oooOO0OOooo........oo 99 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
100 100
101 void G4LivermoreIonisationModel::Initialise(co 101 void G4LivermoreIonisationModel::Initialise(const G4ParticleDefinition* particle,
102 const G4DataVector& cuts) 102 const G4DataVector& cuts)
103 { 103 {
104 //Check that the Livermore Ionisation is NOT 104 //Check that the Livermore Ionisation is NOT attached to e+
105 if (particle != G4Electron::Electron()) 105 if (particle != G4Electron::Electron())
106 { 106 {
107 G4Exception("G4LivermoreIonisationModel: 107 G4Exception("G4LivermoreIonisationModel::Initialise",
108 "em0002",FatalException, 108 "em0002",FatalException,
109 "Livermore Ionisation Model is applicabl 109 "Livermore Ionisation Model is applicable only to electrons");
110 } 110 }
>> 111
111 transitionManager->Initialise(); 112 transitionManager->Initialise();
112 113
113 //Read energy spectrum 114 //Read energy spectrum
114 if (energySpectrum) 115 if (energySpectrum)
115 { 116 {
116 delete energySpectrum; 117 delete energySpectrum;
117 energySpectrum = nullptr; << 118 energySpectrum = 0;
118 } 119 }
119 energySpectrum = new G4eIonisationSpectrum() 120 energySpectrum = new G4eIonisationSpectrum();
120 if (verboseLevel > 3) 121 if (verboseLevel > 3)
121 G4cout << "G4VEnergySpectrum is initialize 122 G4cout << "G4VEnergySpectrum is initialized" << G4endl;
122 123
123 //Initialize cross section handler 124 //Initialize cross section handler
124 if (crossSectionHandler) 125 if (crossSectionHandler)
125 { 126 {
126 delete crossSectionHandler; 127 delete crossSectionHandler;
127 crossSectionHandler = nullptr; << 128 crossSectionHandler = 0;
128 } 129 }
129 130
130 const size_t nbins = 20; 131 const size_t nbins = 20;
131 G4double emin = LowEnergyLimit(); 132 G4double emin = LowEnergyLimit();
132 G4double emax = HighEnergyLimit(); 133 G4double emax = HighEnergyLimit();
133 G4int ndec = G4int(std::log10(emax/emin) + 0 134 G4int ndec = G4int(std::log10(emax/emin) + 0.5);
134 if(ndec <= 0) { ndec = 1; } 135 if(ndec <= 0) { ndec = 1; }
135 136
136 G4VDataSetAlgorithm* interpolation = new G4S 137 G4VDataSetAlgorithm* interpolation = new G4SemiLogInterpolation();
137 crossSectionHandler = 138 crossSectionHandler =
138 new G4eIonisationCrossSectionHandler(energ 139 new G4eIonisationCrossSectionHandler(energySpectrum,interpolation,
139 emin,emax,nbins*ndec); 140 emin,emax,nbins*ndec);
140 crossSectionHandler->Clear(); 141 crossSectionHandler->Clear();
141 crossSectionHandler->LoadShellData("ioni/ion 142 crossSectionHandler->LoadShellData("ioni/ion-ss-cs-");
142 //This is used to retrieve cross section val 143 //This is used to retrieve cross section values later on
143 G4VEMDataSet* emdata = 144 G4VEMDataSet* emdata =
144 crossSectionHandler->BuildMeanFreePathForM 145 crossSectionHandler->BuildMeanFreePathForMaterials(&cuts);
145 //The method BuildMeanFreePathForMaterials() 146 //The method BuildMeanFreePathForMaterials() is required here only to force
146 //the building of an internal table: the out 147 //the building of an internal table: the output pointer can be deleted
147 delete emdata; 148 delete emdata;
148 149
149 if (verboseLevel > 0) 150 if (verboseLevel > 0)
150 { 151 {
151 G4cout << "Livermore Ionisation model is 152 G4cout << "Livermore Ionisation model is initialized " << G4endl
152 << "Energy range: " 153 << "Energy range: "
153 << LowEnergyLimit() / keV << " keV - " 154 << LowEnergyLimit() / keV << " keV - "
154 << HighEnergyLimit() / GeV << " GeV" 155 << HighEnergyLimit() / GeV << " GeV"
155 << G4endl; 156 << G4endl;
156 } 157 }
157 158
158 if (verboseLevel > 3) 159 if (verboseLevel > 3)
159 { 160 {
160 G4cout << "Cross section data: " << G4en 161 G4cout << "Cross section data: " << G4endl;
161 crossSectionHandler->PrintData(); 162 crossSectionHandler->PrintData();
162 G4cout << "Parameters: " << G4endl; 163 G4cout << "Parameters: " << G4endl;
163 energySpectrum->PrintData(); 164 energySpectrum->PrintData();
164 } 165 }
165 166
166 if(isInitialised) { return; } 167 if(isInitialised) { return; }
167 fParticleChange = GetParticleChangeForLoss() 168 fParticleChange = GetParticleChangeForLoss();
168 isInitialised = true; 169 isInitialised = true;
169 } 170 }
170 171
171 //....oooOO0OOooo........oooOO0OOooo........oo 172 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
172 173
173 G4double 174 G4double
174 G4LivermoreIonisationModel::ComputeCrossSectio 175 G4LivermoreIonisationModel::ComputeCrossSectionPerAtom(
175 const G4ParticleDe 176 const G4ParticleDefinition*,
176 G4double energy, 177 G4double energy,
177 G4double Z, G4double, 178 G4double Z, G4double,
178 G4double cutEnergy, 179 G4double cutEnergy,
179 G4double) 180 G4double)
180 { 181 {
181 G4int iZ = G4int(Z); << 182 G4int iZ = (G4int) Z;
182 if (!crossSectionHandler) 183 if (!crossSectionHandler)
183 { 184 {
184 G4Exception("G4LivermoreIonisationModel: 185 G4Exception("G4LivermoreIonisationModel::ComputeCrossSectionPerAtom",
185 "em1007",FatalException, 186 "em1007",FatalException,
186 "The cross section handler is not correc 187 "The cross section handler is not correctly initialized");
187 return 0; 188 return 0;
188 } 189 }
189 190
190 //The cut is already included in the crossSe 191 //The cut is already included in the crossSectionHandler
191 G4double cs = 192 G4double cs =
192 crossSectionHandler->GetCrossSectionAboveT 193 crossSectionHandler->GetCrossSectionAboveThresholdForElement(energy,
193 cutEnergy, 194 cutEnergy,
194 iZ); 195 iZ);
195 196
196 if (verboseLevel > 1) 197 if (verboseLevel > 1)
197 { 198 {
198 G4cout << "G4LivermoreIonisationModel " 199 G4cout << "G4LivermoreIonisationModel " << G4endl;
199 G4cout << "Cross section for delta emiss 200 G4cout << "Cross section for delta emission > "
200 << cutEnergy/keV << " keV at " 201 << cutEnergy/keV << " keV at "
201 << energy/keV << " keV and Z = " << iZ 202 << energy/keV << " keV and Z = " << iZ << " --> "
202 << cs/barn << " barn" << G4endl; 203 << cs/barn << " barn" << G4endl;
203 } 204 }
204 return cs; 205 return cs;
205 } 206 }
206 207
207 208
208 //....oooOO0OOooo........oooOO0OOooo........oo 209 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
209 210
210 G4double 211 G4double
211 G4LivermoreIonisationModel::ComputeDEDXPerVolu 212 G4LivermoreIonisationModel::ComputeDEDXPerVolume(const G4Material* material,
212 const G4ParticleDefinition*, 213 const G4ParticleDefinition*,
213 G4double kineticEnergy, 214 G4double kineticEnergy,
214 G4double cutEnergy) 215 G4double cutEnergy)
215 { 216 {
216 G4double sPower = 0.0; 217 G4double sPower = 0.0;
217 218
218 const G4ElementVector* theElementVector = ma 219 const G4ElementVector* theElementVector = material->GetElementVector();
219 size_t NumberOfElements = material->GetNumbe 220 size_t NumberOfElements = material->GetNumberOfElements() ;
220 const G4double* theAtomicNumDensityVector = 221 const G4double* theAtomicNumDensityVector =
221 material->GetAtomicNumDens 222 material->GetAtomicNumDensityVector();
222 223
223 // loop for elements in the material 224 // loop for elements in the material
224 for (size_t iel=0; iel<NumberOfElements; iel 225 for (size_t iel=0; iel<NumberOfElements; iel++ )
225 { 226 {
226 G4int iZ = (G4int)((*theElementVector)[i 227 G4int iZ = (G4int)((*theElementVector)[iel]->GetZ());
227 G4int nShells = transitionManager->Numbe 228 G4int nShells = transitionManager->NumberOfShells(iZ);
228 for (G4int n=0; n<nShells; n++) 229 for (G4int n=0; n<nShells; n++)
229 { 230 {
230 G4double e = energySpectrum->AverageEnergy 231 G4double e = energySpectrum->AverageEnergy(iZ, 0.0,cutEnergy,
231 kineticEnergy, n); 232 kineticEnergy, n);
232 G4double cs= crossSectionHandler->FindValu 233 G4double cs= crossSectionHandler->FindValue(iZ,kineticEnergy, n);
233 sPower += e * cs * theAtomicNumDensityVe 234 sPower += e * cs * theAtomicNumDensityVector[iel];
234 } 235 }
235 G4double esp = energySpectrum->Excitatio 236 G4double esp = energySpectrum->Excitation(iZ,kineticEnergy);
236 sPower += esp * theAtomicNumDensityVec 237 sPower += esp * theAtomicNumDensityVector[iel];
237 } 238 }
238 239
239 if (verboseLevel > 2) 240 if (verboseLevel > 2)
240 { 241 {
241 G4cout << "G4LivermoreIonisationModel " 242 G4cout << "G4LivermoreIonisationModel " << G4endl;
242 G4cout << "Stopping power < " << cutEner 243 G4cout << "Stopping power < " << cutEnergy/keV
243 << " keV at " << kineticEnergy/keV << " 244 << " keV at " << kineticEnergy/keV << " keV = "
244 << sPower/(keV/mm) << " keV/mm" << G4en 245 << sPower/(keV/mm) << " keV/mm" << G4endl;
245 } 246 }
246 247
247 return sPower; 248 return sPower;
248 } 249 }
249 250
250 //....oooOO0OOooo........oooOO0OOooo........oo 251 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
251 252
252 void G4LivermoreIonisationModel::SampleSeconda 253 void G4LivermoreIonisationModel::SampleSecondaries(
253 std::vector<G 254 std::vector<G4DynamicParticle*>* fvect,
254 const G4MaterialCutsCouple* couple, 255 const G4MaterialCutsCouple* couple,
255 const G4DynamicParticle* aDynamicPart 256 const G4DynamicParticle* aDynamicParticle,
256 G4double cutE, 257 G4double cutE,
257 G4double maxE) 258 G4double maxE)
258 { 259 {
259 260
260 G4double kineticEnergy = aDynamicParticle->G 261 G4double kineticEnergy = aDynamicParticle->GetKineticEnergy();
261 262
262 if (kineticEnergy <= fIntrinsicLowEnergyLimi 263 if (kineticEnergy <= fIntrinsicLowEnergyLimit)
263 { 264 {
264 fParticleChange->SetProposedKineticEnerg 265 fParticleChange->SetProposedKineticEnergy(0.);
265 fParticleChange->ProposeLocalEnergyDepos 266 fParticleChange->ProposeLocalEnergyDeposit(kineticEnergy);
266 return; 267 return;
267 } 268 }
268 269
269 // Select atom and shell 270 // Select atom and shell
270 G4int Z = crossSectionHandler->SelectRandomA 271 G4int Z = crossSectionHandler->SelectRandomAtom(couple, kineticEnergy);
271 G4int shellIndex = crossSectionHandler->Sele 272 G4int shellIndex = crossSectionHandler->SelectRandomShell(Z, kineticEnergy);
272 const G4AtomicShell* shell = transitionManag 273 const G4AtomicShell* shell = transitionManager->Shell(Z,shellIndex);
273 G4double bindingEnergy = shell->BindingEnerg 274 G4double bindingEnergy = shell->BindingEnergy();
274 275
275 // Sample delta energy using energy interval 276 // Sample delta energy using energy interval for delta-electrons
276 G4double energyMax = 277 G4double energyMax =
277 std::min(maxE,energySpectrum->MaxEnergyOfS 278 std::min(maxE,energySpectrum->MaxEnergyOfSecondaries(kineticEnergy));
278 G4double energyDelta = energySpectrum->Sampl 279 G4double energyDelta = energySpectrum->SampleEnergy(Z, cutE, energyMax,
279 kineticEnergy, shellIndex); 280 kineticEnergy, shellIndex);
280 281
281 if (energyDelta == 0.) //nothing happens 282 if (energyDelta == 0.) //nothing happens
282 { return; } 283 { return; }
283 284
284 const G4ParticleDefinition* electron = G4Ele 285 const G4ParticleDefinition* electron = G4Electron::Electron();
285 G4DynamicParticle* delta = new G4DynamicPart 286 G4DynamicParticle* delta = new G4DynamicParticle(electron,
286 GetAngularDistribution()->SampleDirectionF 287 GetAngularDistribution()->SampleDirectionForShell(aDynamicParticle, energyDelta,
287 Z, shellIndex, 288 Z, shellIndex,
288 289 couple->GetMaterial()),
289 290 energyDelta);
290 291
291 fvect->push_back(delta); 292 fvect->push_back(delta);
292 293
293 // Change kinematics of primary particle 294 // Change kinematics of primary particle
294 G4ThreeVector direction = aDynamicParticle-> 295 G4ThreeVector direction = aDynamicParticle->GetMomentumDirection();
295 G4double totalMomentum = std::sqrt(kineticEn 296 G4double totalMomentum = std::sqrt(kineticEnergy*(kineticEnergy + 2*electron_mass_c2));
296 297
297 G4ThreeVector finalP = totalMomentum*directi 298 G4ThreeVector finalP = totalMomentum*direction - delta->GetMomentum();
298 finalP = finalP.unit(); 299 finalP = finalP.unit();
299 300
300 //This is the amount of energy available for 301 //This is the amount of energy available for fluorescence
301 G4double theEnergyDeposit = bindingEnergy; 302 G4double theEnergyDeposit = bindingEnergy;
302 303
303 // fill ParticleChange 304 // fill ParticleChange
304 // changed energy and momentum of the actual 305 // changed energy and momentum of the actual particle
305 G4double finalKinEnergy = kineticEnergy - en 306 G4double finalKinEnergy = kineticEnergy - energyDelta - theEnergyDeposit;
306 if(finalKinEnergy < 0.0) 307 if(finalKinEnergy < 0.0)
307 { 308 {
308 theEnergyDeposit += finalKinEnergy; 309 theEnergyDeposit += finalKinEnergy;
309 finalKinEnergy = 0.0; 310 finalKinEnergy = 0.0;
310 } 311 }
311 else 312 else
312 { 313 {
313 fParticleChange->ProposeMomentumDirectio 314 fParticleChange->ProposeMomentumDirection(finalP);
314 } 315 }
315 fParticleChange->SetProposedKineticEnergy(fi 316 fParticleChange->SetProposedKineticEnergy(finalKinEnergy);
316 317
317 if (theEnergyDeposit < 0) 318 if (theEnergyDeposit < 0)
318 { 319 {
319 G4cout << "G4LivermoreIonisationModel: 320 G4cout << "G4LivermoreIonisationModel: Negative energy deposit: "
320 << theEnergyDeposit/eV << " eV" << G4en 321 << theEnergyDeposit/eV << " eV" << G4endl;
321 theEnergyDeposit = 0.0; 322 theEnergyDeposit = 0.0;
322 } 323 }
323 324
324 //Assign local energy deposit 325 //Assign local energy deposit
325 fParticleChange->ProposeLocalEnergyDeposit(t 326 fParticleChange->ProposeLocalEnergyDeposit(theEnergyDeposit);
326 327
327 if (verboseLevel > 1) 328 if (verboseLevel > 1)
328 { 329 {
329 G4cout << "----------------------------- 330 G4cout << "-----------------------------------------------------------" << G4endl;
330 G4cout << "Energy balance from G4Livermo 331 G4cout << "Energy balance from G4LivermoreIonisation" << G4endl;
331 G4cout << "Incoming primary energy: " << 332 G4cout << "Incoming primary energy: " << kineticEnergy/keV << " keV" << G4endl;
332 G4cout << "----------------------------- 333 G4cout << "-----------------------------------------------------------" << G4endl;
333 G4cout << "Outgoing primary energy: " << 334 G4cout << "Outgoing primary energy: " << finalKinEnergy/keV << " keV" << G4endl;
334 G4cout << "Delta ray " << energyDelta/ke 335 G4cout << "Delta ray " << energyDelta/keV << " keV" << G4endl;
335 G4cout << "Fluorescence: " << (bindingEn 336 G4cout << "Fluorescence: " << (bindingEnergy-theEnergyDeposit)/keV << " keV" << G4endl;
336 G4cout << "Local energy deposit " << the 337 G4cout << "Local energy deposit " << theEnergyDeposit/keV << " keV" << G4endl;
337 G4cout << "Total final state: " << (fina 338 G4cout << "Total final state: " << (finalKinEnergy+energyDelta+bindingEnergy)
338 << " keV" << G4endl; 339 << " keV" << G4endl;
339 G4cout << "----------------------------- 340 G4cout << "-----------------------------------------------------------" << G4endl;
340 } 341 }
341 return; 342 return;
342 } 343 }
343 344
344 //....oooOO0OOooo........oooOO0OOooo........oo 345 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
345 346
346 347