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>> 26 // $Id: G4LivermoreIonisationModel.cc 87443 2014-12-04 12:26:31Z gunter $
26 // 27 //
27 // Author: Luciano Pandola 28 // Author: Luciano Pandola
28 // on base of G4LowEnergyIonisation de 29 // on base of G4LowEnergyIonisation developed by A.Forti and V.Ivanchenko
29 // 30 //
30 // History: 31 // History:
31 // -------- 32 // --------
32 // 12 Jan 2009 L Pandola Migration from p 33 // 12 Jan 2009 L Pandola Migration from process to model
33 // 03 Mar 2009 L Pandola Bug fix (release 34 // 03 Mar 2009 L Pandola Bug fix (release memory in the destructor)
34 // 15 Apr 2009 V Ivanchenko Cleanup initiali 35 // 15 Apr 2009 V Ivanchenko Cleanup initialisation and generation of secondaries:
35 // - apply internal high-ener 36 // - apply internal high-energy limit only in constructor
36 // - do not apply low-energy 37 // - do not apply low-energy limit (default is 0)
37 // - simplify sampling of dee 38 // - simplify sampling of deexcitation by using cut in energy
38 // - set activation of Auger 39 // - set activation of Auger "false"
39 // - remove initialisation of 40 // - remove initialisation of element selectors
40 // 19 May 2009 L Pandola Explicitely set 41 // 19 May 2009 L Pandola Explicitely set to zero pointers deleted in
41 // Initialise(), si 42 // Initialise(), since they might be checked later on
42 // 23 Oct 2009 L Pandola 43 // 23 Oct 2009 L Pandola
43 // - atomic deexcitation mana 44 // - atomic deexcitation managed via G4VEmModel::DeexcitationFlag() is
44 // set as "true" (default w 45 // set as "true" (default would be false)
45 // 12 Oct 2010 L Pandola 46 // 12 Oct 2010 L Pandola
46 // - add debugging informatio 47 // - add debugging information about energy in
47 // SampleDeexcitationAlongS 48 // SampleDeexcitationAlongStep()
48 // - generate fluorescence Sa 49 // - generate fluorescence SampleDeexcitationAlongStep() only above
49 // the cuts. 50 // the cuts.
50 // 01 Jun 2011 V Ivanchenko general cleanup 51 // 01 Jun 2011 V Ivanchenko general cleanup - all old deexcitation code removed
51 // 52 //
52 53
53 #include "G4LivermoreIonisationModel.hh" 54 #include "G4LivermoreIonisationModel.hh"
54 #include "G4PhysicalConstants.hh" 55 #include "G4PhysicalConstants.hh"
55 #include "G4SystemOfUnits.hh" 56 #include "G4SystemOfUnits.hh"
56 #include "G4ParticleDefinition.hh" 57 #include "G4ParticleDefinition.hh"
57 #include "G4MaterialCutsCouple.hh" 58 #include "G4MaterialCutsCouple.hh"
58 #include "G4ProductionCutsTable.hh" 59 #include "G4ProductionCutsTable.hh"
59 #include "G4DynamicParticle.hh" 60 #include "G4DynamicParticle.hh"
60 #include "G4Element.hh" 61 #include "G4Element.hh"
61 #include "G4ParticleChangeForLoss.hh" 62 #include "G4ParticleChangeForLoss.hh"
62 #include "G4Electron.hh" 63 #include "G4Electron.hh"
63 #include "G4CrossSectionHandler.hh" 64 #include "G4CrossSectionHandler.hh"
64 #include "G4VEMDataSet.hh" 65 #include "G4VEMDataSet.hh"
65 #include "G4eIonisationCrossSectionHandler.hh" 66 #include "G4eIonisationCrossSectionHandler.hh"
66 #include "G4eIonisationSpectrum.hh" 67 #include "G4eIonisationSpectrum.hh"
67 #include "G4VEnergySpectrum.hh" 68 #include "G4VEnergySpectrum.hh"
68 #include "G4SemiLogInterpolation.hh" 69 #include "G4SemiLogInterpolation.hh"
69 #include "G4AtomicTransitionManager.hh" 70 #include "G4AtomicTransitionManager.hh"
70 #include "G4AtomicShell.hh" 71 #include "G4AtomicShell.hh"
71 #include "G4DeltaAngle.hh" 72 #include "G4DeltaAngle.hh"
72 73
73 //....oooOO0OOooo........oooOO0OOooo........oo 74 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
74 75
75 76
76 G4LivermoreIonisationModel::G4LivermoreIonisat 77 G4LivermoreIonisationModel::G4LivermoreIonisationModel(const G4ParticleDefinition*,
77 const G4String& nam) : 78 const G4String& nam) :
78 G4VEmModel(nam), fParticleChange(nullptr), << 79 G4VEmModel(nam), fParticleChange(0),
79 crossSectionHandler(nullptr), energySpectrum << 80 isInitialised(false),
80 isInitialised(false) << 81 crossSectionHandler(0), energySpectrum(0)
81 { 82 {
82 fIntrinsicLowEnergyLimit = 12.*eV; << 83 fIntrinsicLowEnergyLimit = 10.0*eV;
83 fIntrinsicHighEnergyLimit = 100.0*GeV; 84 fIntrinsicHighEnergyLimit = 100.0*GeV;
84 85
85 verboseLevel = 0; 86 verboseLevel = 0;
86 SetAngularDistribution(new G4DeltaAngle()); 87 SetAngularDistribution(new G4DeltaAngle());
87 88
88 transitionManager = G4AtomicTransitionManage 89 transitionManager = G4AtomicTransitionManager::Instance();
89 } 90 }
90 91
91 //....oooOO0OOooo........oooOO0OOooo........oo 92 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
92 93
93 G4LivermoreIonisationModel::~G4LivermoreIonisa 94 G4LivermoreIonisationModel::~G4LivermoreIonisationModel()
94 { 95 {
95 delete energySpectrum; 96 delete energySpectrum;
96 delete crossSectionHandler; 97 delete crossSectionHandler;
97 } 98 }
98 99
99 //....oooOO0OOooo........oooOO0OOooo........oo 100 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
100 101
101 void G4LivermoreIonisationModel::Initialise(co 102 void G4LivermoreIonisationModel::Initialise(const G4ParticleDefinition* particle,
102 const G4DataVector& cuts) 103 const G4DataVector& cuts)
103 { 104 {
104 //Check that the Livermore Ionisation is NOT 105 //Check that the Livermore Ionisation is NOT attached to e+
105 if (particle != G4Electron::Electron()) 106 if (particle != G4Electron::Electron())
106 { 107 {
107 G4Exception("G4LivermoreIonisationModel: 108 G4Exception("G4LivermoreIonisationModel::Initialise",
108 "em0002",FatalException, 109 "em0002",FatalException,
109 "Livermore Ionisation Model is applicabl 110 "Livermore Ionisation Model is applicable only to electrons");
110 } 111 }
>> 112
111 transitionManager->Initialise(); 113 transitionManager->Initialise();
112 114
113 //Read energy spectrum 115 //Read energy spectrum
114 if (energySpectrum) 116 if (energySpectrum)
115 { 117 {
116 delete energySpectrum; 118 delete energySpectrum;
117 energySpectrum = nullptr; << 119 energySpectrum = 0;
118 } 120 }
119 energySpectrum = new G4eIonisationSpectrum() 121 energySpectrum = new G4eIonisationSpectrum();
120 if (verboseLevel > 3) 122 if (verboseLevel > 3)
121 G4cout << "G4VEnergySpectrum is initialize 123 G4cout << "G4VEnergySpectrum is initialized" << G4endl;
122 124
123 //Initialize cross section handler 125 //Initialize cross section handler
124 if (crossSectionHandler) 126 if (crossSectionHandler)
125 { 127 {
126 delete crossSectionHandler; 128 delete crossSectionHandler;
127 crossSectionHandler = nullptr; << 129 crossSectionHandler = 0;
128 } 130 }
129 131
130 const size_t nbins = 20; 132 const size_t nbins = 20;
131 G4double emin = LowEnergyLimit(); 133 G4double emin = LowEnergyLimit();
132 G4double emax = HighEnergyLimit(); 134 G4double emax = HighEnergyLimit();
133 G4int ndec = G4int(std::log10(emax/emin) + 0 135 G4int ndec = G4int(std::log10(emax/emin) + 0.5);
134 if(ndec <= 0) { ndec = 1; } 136 if(ndec <= 0) { ndec = 1; }
135 137
136 G4VDataSetAlgorithm* interpolation = new G4S 138 G4VDataSetAlgorithm* interpolation = new G4SemiLogInterpolation();
137 crossSectionHandler = 139 crossSectionHandler =
138 new G4eIonisationCrossSectionHandler(energ 140 new G4eIonisationCrossSectionHandler(energySpectrum,interpolation,
139 emin,emax,nbins*ndec); 141 emin,emax,nbins*ndec);
140 crossSectionHandler->Clear(); 142 crossSectionHandler->Clear();
141 crossSectionHandler->LoadShellData("ioni/ion 143 crossSectionHandler->LoadShellData("ioni/ion-ss-cs-");
142 //This is used to retrieve cross section val 144 //This is used to retrieve cross section values later on
143 G4VEMDataSet* emdata = 145 G4VEMDataSet* emdata =
144 crossSectionHandler->BuildMeanFreePathForM 146 crossSectionHandler->BuildMeanFreePathForMaterials(&cuts);
145 //The method BuildMeanFreePathForMaterials() 147 //The method BuildMeanFreePathForMaterials() is required here only to force
146 //the building of an internal table: the out 148 //the building of an internal table: the output pointer can be deleted
147 delete emdata; 149 delete emdata;
148 150
149 if (verboseLevel > 0) 151 if (verboseLevel > 0)
150 { 152 {
151 G4cout << "Livermore Ionisation model is 153 G4cout << "Livermore Ionisation model is initialized " << G4endl
152 << "Energy range: " 154 << "Energy range: "
153 << LowEnergyLimit() / keV << " keV - " 155 << LowEnergyLimit() / keV << " keV - "
154 << HighEnergyLimit() / GeV << " GeV" 156 << HighEnergyLimit() / GeV << " GeV"
155 << G4endl; 157 << G4endl;
156 } 158 }
157 159
158 if (verboseLevel > 3) 160 if (verboseLevel > 3)
159 { 161 {
160 G4cout << "Cross section data: " << G4en 162 G4cout << "Cross section data: " << G4endl;
161 crossSectionHandler->PrintData(); 163 crossSectionHandler->PrintData();
162 G4cout << "Parameters: " << G4endl; 164 G4cout << "Parameters: " << G4endl;
163 energySpectrum->PrintData(); 165 energySpectrum->PrintData();
164 } 166 }
165 167
166 if(isInitialised) { return; } 168 if(isInitialised) { return; }
167 fParticleChange = GetParticleChangeForLoss() 169 fParticleChange = GetParticleChangeForLoss();
168 isInitialised = true; 170 isInitialised = true;
169 } 171 }
170 172
171 //....oooOO0OOooo........oooOO0OOooo........oo 173 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
172 174
173 G4double 175 G4double
174 G4LivermoreIonisationModel::ComputeCrossSectio 176 G4LivermoreIonisationModel::ComputeCrossSectionPerAtom(
175 const G4ParticleDe 177 const G4ParticleDefinition*,
176 G4double energy, 178 G4double energy,
177 G4double Z, G4double, 179 G4double Z, G4double,
178 G4double cutEnergy, 180 G4double cutEnergy,
179 G4double) 181 G4double)
180 { 182 {
181 G4int iZ = G4int(Z); << 183 G4int iZ = (G4int) Z;
182 if (!crossSectionHandler) 184 if (!crossSectionHandler)
183 { 185 {
184 G4Exception("G4LivermoreIonisationModel: 186 G4Exception("G4LivermoreIonisationModel::ComputeCrossSectionPerAtom",
185 "em1007",FatalException, 187 "em1007",FatalException,
186 "The cross section handler is not correc 188 "The cross section handler is not correctly initialized");
187 return 0; 189 return 0;
188 } 190 }
189 191
190 //The cut is already included in the crossSe 192 //The cut is already included in the crossSectionHandler
191 G4double cs = 193 G4double cs =
192 crossSectionHandler->GetCrossSectionAboveT 194 crossSectionHandler->GetCrossSectionAboveThresholdForElement(energy,
193 cutEnergy, 195 cutEnergy,
194 iZ); 196 iZ);
195 197
196 if (verboseLevel > 1) 198 if (verboseLevel > 1)
197 { 199 {
198 G4cout << "G4LivermoreIonisationModel " 200 G4cout << "G4LivermoreIonisationModel " << G4endl;
199 G4cout << "Cross section for delta emiss 201 G4cout << "Cross section for delta emission > "
200 << cutEnergy/keV << " keV at " 202 << cutEnergy/keV << " keV at "
201 << energy/keV << " keV and Z = " << iZ 203 << energy/keV << " keV and Z = " << iZ << " --> "
202 << cs/barn << " barn" << G4endl; 204 << cs/barn << " barn" << G4endl;
203 } 205 }
204 return cs; 206 return cs;
205 } 207 }
206 208
207 209
208 //....oooOO0OOooo........oooOO0OOooo........oo 210 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
209 211
210 G4double 212 G4double
211 G4LivermoreIonisationModel::ComputeDEDXPerVolu 213 G4LivermoreIonisationModel::ComputeDEDXPerVolume(const G4Material* material,
212 const G4ParticleDefinition*, 214 const G4ParticleDefinition*,
213 G4double kineticEnergy, 215 G4double kineticEnergy,
214 G4double cutEnergy) 216 G4double cutEnergy)
215 { 217 {
216 G4double sPower = 0.0; 218 G4double sPower = 0.0;
217 219
218 const G4ElementVector* theElementVector = ma 220 const G4ElementVector* theElementVector = material->GetElementVector();
219 size_t NumberOfElements = material->GetNumbe 221 size_t NumberOfElements = material->GetNumberOfElements() ;
220 const G4double* theAtomicNumDensityVector = 222 const G4double* theAtomicNumDensityVector =
221 material->GetAtomicNumDens 223 material->GetAtomicNumDensityVector();
222 224
223 // loop for elements in the material 225 // loop for elements in the material
224 for (size_t iel=0; iel<NumberOfElements; iel 226 for (size_t iel=0; iel<NumberOfElements; iel++ )
225 { 227 {
226 G4int iZ = (G4int)((*theElementVector)[i 228 G4int iZ = (G4int)((*theElementVector)[iel]->GetZ());
227 G4int nShells = transitionManager->Numbe 229 G4int nShells = transitionManager->NumberOfShells(iZ);
228 for (G4int n=0; n<nShells; n++) 230 for (G4int n=0; n<nShells; n++)
229 { 231 {
230 G4double e = energySpectrum->AverageEnergy 232 G4double e = energySpectrum->AverageEnergy(iZ, 0.0,cutEnergy,
231 kineticEnergy, n); 233 kineticEnergy, n);
232 G4double cs= crossSectionHandler->FindValu 234 G4double cs= crossSectionHandler->FindValue(iZ,kineticEnergy, n);
233 sPower += e * cs * theAtomicNumDensityVe 235 sPower += e * cs * theAtomicNumDensityVector[iel];
234 } 236 }
235 G4double esp = energySpectrum->Excitatio 237 G4double esp = energySpectrum->Excitation(iZ,kineticEnergy);
236 sPower += esp * theAtomicNumDensityVec 238 sPower += esp * theAtomicNumDensityVector[iel];
237 } 239 }
238 240
239 if (verboseLevel > 2) 241 if (verboseLevel > 2)
240 { 242 {
241 G4cout << "G4LivermoreIonisationModel " 243 G4cout << "G4LivermoreIonisationModel " << G4endl;
242 G4cout << "Stopping power < " << cutEner 244 G4cout << "Stopping power < " << cutEnergy/keV
243 << " keV at " << kineticEnergy/keV << " 245 << " keV at " << kineticEnergy/keV << " keV = "
244 << sPower/(keV/mm) << " keV/mm" << G4en 246 << sPower/(keV/mm) << " keV/mm" << G4endl;
245 } 247 }
246 248
247 return sPower; 249 return sPower;
248 } 250 }
249 251
250 //....oooOO0OOooo........oooOO0OOooo........oo 252 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
251 253
252 void G4LivermoreIonisationModel::SampleSeconda 254 void G4LivermoreIonisationModel::SampleSecondaries(
253 std::vector<G 255 std::vector<G4DynamicParticle*>* fvect,
254 const G4MaterialCutsCouple* couple, 256 const G4MaterialCutsCouple* couple,
255 const G4DynamicParticle* aDynamicPart 257 const G4DynamicParticle* aDynamicParticle,
256 G4double cutE, 258 G4double cutE,
257 G4double maxE) 259 G4double maxE)
258 { 260 {
259 261
260 G4double kineticEnergy = aDynamicParticle->G 262 G4double kineticEnergy = aDynamicParticle->GetKineticEnergy();
261 263
262 if (kineticEnergy <= fIntrinsicLowEnergyLimi 264 if (kineticEnergy <= fIntrinsicLowEnergyLimit)
263 { 265 {
264 fParticleChange->SetProposedKineticEnerg 266 fParticleChange->SetProposedKineticEnergy(0.);
265 fParticleChange->ProposeLocalEnergyDepos 267 fParticleChange->ProposeLocalEnergyDeposit(kineticEnergy);
266 return; 268 return;
267 } 269 }
268 270
269 // Select atom and shell 271 // Select atom and shell
270 G4int Z = crossSectionHandler->SelectRandomA 272 G4int Z = crossSectionHandler->SelectRandomAtom(couple, kineticEnergy);
271 G4int shellIndex = crossSectionHandler->Sele 273 G4int shellIndex = crossSectionHandler->SelectRandomShell(Z, kineticEnergy);
272 const G4AtomicShell* shell = transitionManag 274 const G4AtomicShell* shell = transitionManager->Shell(Z,shellIndex);
273 G4double bindingEnergy = shell->BindingEnerg 275 G4double bindingEnergy = shell->BindingEnergy();
274 276
275 // Sample delta energy using energy interval 277 // Sample delta energy using energy interval for delta-electrons
276 G4double energyMax = 278 G4double energyMax =
277 std::min(maxE,energySpectrum->MaxEnergyOfS 279 std::min(maxE,energySpectrum->MaxEnergyOfSecondaries(kineticEnergy));
278 G4double energyDelta = energySpectrum->Sampl 280 G4double energyDelta = energySpectrum->SampleEnergy(Z, cutE, energyMax,
279 kineticEnergy, shellIndex); 281 kineticEnergy, shellIndex);
280 282
281 if (energyDelta == 0.) //nothing happens 283 if (energyDelta == 0.) //nothing happens
282 { return; } 284 { return; }
283 285
284 const G4ParticleDefinition* electron = G4Ele 286 const G4ParticleDefinition* electron = G4Electron::Electron();
285 G4DynamicParticle* delta = new G4DynamicPart 287 G4DynamicParticle* delta = new G4DynamicParticle(electron,
286 GetAngularDistribution()->SampleDirectionF 288 GetAngularDistribution()->SampleDirectionForShell(aDynamicParticle, energyDelta,
287 Z, shellIndex, 289 Z, shellIndex,
288 290 couple->GetMaterial()),
289 291 energyDelta);
290 292
291 fvect->push_back(delta); 293 fvect->push_back(delta);
292 294
293 // Change kinematics of primary particle 295 // Change kinematics of primary particle
294 G4ThreeVector direction = aDynamicParticle-> 296 G4ThreeVector direction = aDynamicParticle->GetMomentumDirection();
295 G4double totalMomentum = std::sqrt(kineticEn 297 G4double totalMomentum = std::sqrt(kineticEnergy*(kineticEnergy + 2*electron_mass_c2));
296 298
297 G4ThreeVector finalP = totalMomentum*directi 299 G4ThreeVector finalP = totalMomentum*direction - delta->GetMomentum();
298 finalP = finalP.unit(); 300 finalP = finalP.unit();
299 301
300 //This is the amount of energy available for 302 //This is the amount of energy available for fluorescence
301 G4double theEnergyDeposit = bindingEnergy; 303 G4double theEnergyDeposit = bindingEnergy;
302 304
303 // fill ParticleChange 305 // fill ParticleChange
304 // changed energy and momentum of the actual 306 // changed energy and momentum of the actual particle
305 G4double finalKinEnergy = kineticEnergy - en 307 G4double finalKinEnergy = kineticEnergy - energyDelta - theEnergyDeposit;
306 if(finalKinEnergy < 0.0) 308 if(finalKinEnergy < 0.0)
307 { 309 {
308 theEnergyDeposit += finalKinEnergy; 310 theEnergyDeposit += finalKinEnergy;
309 finalKinEnergy = 0.0; 311 finalKinEnergy = 0.0;
310 } 312 }
311 else 313 else
312 { 314 {
313 fParticleChange->ProposeMomentumDirectio 315 fParticleChange->ProposeMomentumDirection(finalP);
314 } 316 }
315 fParticleChange->SetProposedKineticEnergy(fi 317 fParticleChange->SetProposedKineticEnergy(finalKinEnergy);
316 318
317 if (theEnergyDeposit < 0) 319 if (theEnergyDeposit < 0)
318 { 320 {
319 G4cout << "G4LivermoreIonisationModel: 321 G4cout << "G4LivermoreIonisationModel: Negative energy deposit: "
320 << theEnergyDeposit/eV << " eV" << G4en 322 << theEnergyDeposit/eV << " eV" << G4endl;
321 theEnergyDeposit = 0.0; 323 theEnergyDeposit = 0.0;
322 } 324 }
323 325
324 //Assign local energy deposit 326 //Assign local energy deposit
325 fParticleChange->ProposeLocalEnergyDeposit(t 327 fParticleChange->ProposeLocalEnergyDeposit(theEnergyDeposit);
326 328
327 if (verboseLevel > 1) 329 if (verboseLevel > 1)
328 { 330 {
329 G4cout << "----------------------------- 331 G4cout << "-----------------------------------------------------------" << G4endl;
330 G4cout << "Energy balance from G4Livermo 332 G4cout << "Energy balance from G4LivermoreIonisation" << G4endl;
331 G4cout << "Incoming primary energy: " << 333 G4cout << "Incoming primary energy: " << kineticEnergy/keV << " keV" << G4endl;
332 G4cout << "----------------------------- 334 G4cout << "-----------------------------------------------------------" << G4endl;
333 G4cout << "Outgoing primary energy: " << 335 G4cout << "Outgoing primary energy: " << finalKinEnergy/keV << " keV" << G4endl;
334 G4cout << "Delta ray " << energyDelta/ke 336 G4cout << "Delta ray " << energyDelta/keV << " keV" << G4endl;
335 G4cout << "Fluorescence: " << (bindingEn 337 G4cout << "Fluorescence: " << (bindingEnergy-theEnergyDeposit)/keV << " keV" << G4endl;
336 G4cout << "Local energy deposit " << the 338 G4cout << "Local energy deposit " << theEnergyDeposit/keV << " keV" << G4endl;
337 G4cout << "Total final state: " << (fina 339 G4cout << "Total final state: " << (finalKinEnergy+energyDelta+bindingEnergy)
338 << " keV" << G4endl; 340 << " keV" << G4endl;
339 G4cout << "----------------------------- 341 G4cout << "-----------------------------------------------------------" << G4endl;
340 } 342 }
341 return; 343 return;
342 } 344 }
343 345
344 //....oooOO0OOooo........oooOO0OOooo........oo 346 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
345 347
346 348