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>> 26 // $Id: G4PenelopeRayleighModel.cc,v 1.4 2010-12-15 10:26:41 pandola Exp $
>> 27 // GEANT4 tag $Name: not supported by cvs2svn $
26 // 28 //
27 // Author: Luciano Pandola 29 // Author: Luciano Pandola
28 // 30 //
29 // History: 31 // History:
30 // -------- 32 // --------
31 // 03 Dec 2009 L Pandola First implementa 33 // 03 Dec 2009 L Pandola First implementation
32 // 25 May 2011 L.Pandola Renamed (make v2 34 // 25 May 2011 L.Pandola Renamed (make v2008 as default Penelope)
33 // 19 Sep 2013 L.Pandola Migration to MT <<
34 // 35 //
35 36
36 #include "G4PenelopeRayleighModel.hh" 37 #include "G4PenelopeRayleighModel.hh"
37 #include "G4PhysicalConstants.hh" <<
38 #include "G4SystemOfUnits.hh" <<
39 #include "G4PenelopeSamplingData.hh" 38 #include "G4PenelopeSamplingData.hh"
40 #include "G4ParticleDefinition.hh" 39 #include "G4ParticleDefinition.hh"
41 #include "G4MaterialCutsCouple.hh" 40 #include "G4MaterialCutsCouple.hh"
42 #include "G4ProductionCutsTable.hh" 41 #include "G4ProductionCutsTable.hh"
43 #include "G4DynamicParticle.hh" 42 #include "G4DynamicParticle.hh"
44 #include "G4PhysicsTable.hh" 43 #include "G4PhysicsTable.hh"
45 #include "G4ElementTable.hh" 44 #include "G4ElementTable.hh"
46 #include "G4Element.hh" 45 #include "G4Element.hh"
47 #include "G4PhysicsFreeVector.hh" 46 #include "G4PhysicsFreeVector.hh"
48 #include "G4AutoLock.hh" <<
49 #include "G4Exp.hh" <<
50 47
51 //....oooOO0OOooo........oooOO0OOooo........oo <<
52 <<
53 const G4int G4PenelopeRayleighModel::fMaxZ; <<
54 G4PhysicsFreeVector* G4PenelopeRayleighModel:: <<
55 G4PhysicsFreeVector* G4PenelopeRayleighModel:: <<
56 48
57 //....oooOO0OOooo........oooOO0OOooo........oo 49 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
58 50
59 G4PenelopeRayleighModel::G4PenelopeRayleighMod << 51
>> 52 G4PenelopeRayleighModel::G4PenelopeRayleighModel(const G4ParticleDefinition*,
60 const G4String& nam) 53 const G4String& nam)
61 :G4VEmModel(nam),fParticleChange(nullptr),fP << 54 :G4VEmModel(nam),isInitialised(false),logAtomicCrossSection(0),
62 fLogFormFactorTable(nullptr),fPMaxTable(nul << 55 atomicFormFactor(0),logFormFactorTable(0),pMaxTable(0),samplingTable(0)
63 fIsInitialised(false),fLocalTable(false) <<
64 { 56 {
65 fIntrinsicLowEnergyLimit = 100.0*eV; 57 fIntrinsicLowEnergyLimit = 100.0*eV;
66 fIntrinsicHighEnergyLimit = 100.0*GeV; 58 fIntrinsicHighEnergyLimit = 100.0*GeV;
67 // SetLowEnergyLimit(fIntrinsicLowEnergyLim 59 // SetLowEnergyLimit(fIntrinsicLowEnergyLimit);
68 SetHighEnergyLimit(fIntrinsicHighEnergyLimit 60 SetHighEnergyLimit(fIntrinsicHighEnergyLimit);
69 <<
70 if (part) <<
71 SetParticle(part); <<
72 <<
73 // 61 //
74 fVerboseLevel= 0; << 62 verboseLevel= 0;
75 // Verbosity scale: 63 // Verbosity scale:
76 // 0 = nothing << 64 // 0 = nothing
77 // 1 = warning for energy non-conservation << 65 // 1 = warning for energy non-conservation
78 // 2 = details of energy budget 66 // 2 = details of energy budget
79 // 3 = calculation of cross sections, file o 67 // 3 = calculation of cross sections, file openings, sampling of atoms
80 // 4 = entering in methods << 68 // 4 = entering in methods
81 69
82 //build the energy grid. It is the same for 70 //build the energy grid. It is the same for all materials
83 G4double logenergy = G4Log(fIntrinsicLowEner << 71 G4double logenergy = std::log(fIntrinsicLowEnergyLimit/2.);
84 G4double logmaxenergy = G4Log(1.5*fIntrinsic << 72 G4double logmaxenergy = std::log(1.5*fIntrinsicHighEnergyLimit);
85 //finer grid below 160 keV 73 //finer grid below 160 keV
86 G4double logtransitionenergy = G4Log(160*keV << 74 G4double logtransitionenergy = std::log(160*keV);
87 G4double logfactor1 = G4Log(10.)/250.; << 75 G4double logfactor1 = std::log(10.)/250.;
88 G4double logfactor2 = logfactor1*10; 76 G4double logfactor2 = logfactor1*10;
89 fLogEnergyGridPMax.push_back(logenergy); << 77 logEnergyGridPMax.push_back(logenergy);
90 do{ 78 do{
91 if (logenergy < logtransitionenergy) 79 if (logenergy < logtransitionenergy)
92 logenergy += logfactor1; 80 logenergy += logfactor1;
93 else 81 else
94 logenergy += logfactor2; 82 logenergy += logfactor2;
95 fLogEnergyGridPMax.push_back(logenergy); << 83 logEnergyGridPMax.push_back(logenergy);
96 }while (logenergy < logmaxenergy); 84 }while (logenergy < logmaxenergy);
97 } 85 }
98 86
99 //....oooOO0OOooo........oooOO0OOooo........oo 87 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
100 88
101 G4PenelopeRayleighModel::~G4PenelopeRayleighMo 89 G4PenelopeRayleighModel::~G4PenelopeRayleighModel()
102 { 90 {
103 if (IsMaster() || fLocalTable) << 91 std::map <const G4int,G4PhysicsFreeVector*>::iterator i;
>> 92 if (logAtomicCrossSection)
104 { 93 {
105 << 94 for (i=logAtomicCrossSection->begin();i != logAtomicCrossSection->end();i++)
106 for(G4int i=0; i<=fMaxZ; ++i) << 95 if (i->second) delete i->second;
107 { << 96 delete logAtomicCrossSection;
108 if(fLogAtomicCrossSection[i]) << 97 }
109 { << 98
110 delete fLogAtomicCrossSection[i]; << 99 if (atomicFormFactor)
111 fLogAtomicCrossSection[i] = nullptr; << 100 {
112 } << 101 for (i=atomicFormFactor->begin();i != atomicFormFactor->end();i++)
113 if(fAtomicFormFactor[i]) << 102 if (i->second) delete i->second;
114 { << 103 delete atomicFormFactor;
115 delete fAtomicFormFactor[i]; << 104 }
116 fAtomicFormFactor[i] = nullptr; << 105
117 } << 106 ClearTables();
118 } <<
119 ClearTables(); <<
120 } <<
121 } 107 }
122 108
123 //....oooOO0OOooo........oooOO0OOooo........oo 109 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
124 void G4PenelopeRayleighModel::ClearTables() 110 void G4PenelopeRayleighModel::ClearTables()
125 { 111 {
126 if (fLogFormFactorTable) << 112 std::map <const G4Material*,G4PhysicsFreeVector*>::iterator i;
>> 113
>> 114 if (logFormFactorTable)
127 { 115 {
128 for (auto& item : (*fLogFormFactorTable << 116 for (i=logFormFactorTable->begin(); i != logFormFactorTable->end(); i++)
129 if (item.second) delete item.second; << 117 if (i->second) delete i->second;
130 delete fLogFormFactorTable; << 118 delete logFormFactorTable;
131 fLogFormFactorTable = nullptr; //zero e << 119 logFormFactorTable = 0; //zero explicitely
132 } 120 }
133 if (fPMaxTable) << 121
>> 122 if (pMaxTable)
134 { 123 {
135 for (auto& item : (*fPMaxTable)) << 124 for (i=pMaxTable->begin(); i != pMaxTable->end(); i++)
136 if (item.second) delete item.second; << 125 if (i->second) delete i->second;
137 delete fPMaxTable; << 126 delete pMaxTable;
138 fPMaxTable = nullptr; //zero explicitly << 127 pMaxTable = 0; //zero explicitely
139 } 128 }
140 if (fSamplingTable) << 129
>> 130 std::map<const G4Material*,G4PenelopeSamplingData*>::iterator ii;
>> 131 if (samplingTable)
141 { 132 {
142 for (auto& item : (*fSamplingTable)) << 133 for (ii=samplingTable->begin(); ii != samplingTable->end(); ii++)
143 if (item.second) delete item.second; << 134 if (ii->second) delete ii->second;
144 delete fSamplingTable; << 135 delete samplingTable;
145 fSamplingTable = nullptr; //zero explic << 136 samplingTable = 0; //zero explicitely
146 } << 137 }
>> 138
147 return; 139 return;
148 } 140 }
149 141
150 //....oooOO0OOooo........oooOO0OOooo........oo 142 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
151 143
152 void G4PenelopeRayleighModel::Initialise(const << 144 void G4PenelopeRayleighModel::Initialise(const G4ParticleDefinition* ,
153 const G4DataVector& ) 145 const G4DataVector& )
154 { 146 {
155 if (fVerboseLevel > 3) << 147 if (verboseLevel > 3)
156 G4cout << "Calling G4PenelopeRayleighModel 148 G4cout << "Calling G4PenelopeRayleighModel::Initialise()" << G4endl;
157 149
158 SetParticle(part); << 150 //clear tables depending on materials, not the atomic ones
159 << 151 ClearTables();
160 //Only the master model creates/fills/destro << 152
161 if (IsMaster() && part == fParticle) << 153 //create new tables
162 { << 154 //
163 //clear tables depending on materials, n << 155 // logAtomicCrossSection and atomicFormFactor are created only once,
164 ClearTables(); << 156 // since they are never cleared
165 << 157 if (!logAtomicCrossSection)
166 if (fVerboseLevel > 3) << 158 logAtomicCrossSection = new std::map<const G4int,G4PhysicsFreeVector*>;
167 G4cout << "Calling G4PenelopeRayleighModel:: << 159 if (!atomicFormFactor)
168 << 160 atomicFormFactor = new std::map<const G4int,G4PhysicsFreeVector*>;
169 //create new tables << 161
170 if (!fLogFormFactorTable) << 162 if (!logFormFactorTable)
171 fLogFormFactorTable = new std::map<const G4M << 163 logFormFactorTable = new std::map<const G4Material*,G4PhysicsFreeVector*>;
172 if (!fPMaxTable) << 164 if (!pMaxTable)
173 fPMaxTable = new std::map<const G4Material*, << 165 pMaxTable = new std::map<const G4Material*,G4PhysicsFreeVector*>;
174 if (!fSamplingTable) << 166 if (!samplingTable)
175 fSamplingTable = new std::map<const G4Materi << 167 samplingTable = new std::map<const G4Material*,G4PenelopeSamplingData*>;
176 << 168
177 G4ProductionCutsTable* theCoupleTable = << 169
178 G4ProductionCutsTable::GetProductionCutsTabl << 170 if (verboseLevel > 0) {
179 << 171 G4cout << "Penelope Rayleigh model v2008 is initialized " << G4endl
180 for (G4int i=0;i<(G4int)theCoupleTable-> << 172 << "Energy range: "
181 { << 173 << LowEnergyLimit() / keV << " keV - "
182 const G4Material* material = << 174 << HighEnergyLimit() / GeV << " GeV"
183 theCoupleTable->GetMaterialCutsCouple(i) << 175 << G4endl;
184 const G4ElementVector* theElementVector = << 176 }
185 <<
186 for (std::size_t j=0;j<material->GetNumber <<
187 { <<
188 G4int iZ = theElementVector->at(j)->Ge <<
189 //read data files only in the master <<
190 if (!fLogAtomicCrossSection[iZ]) <<
191 ReadDataFile(iZ); <<
192 } <<
193 <<
194 //1) If the table has not been built for t <<
195 if (!fLogFormFactorTable->count(material)) <<
196 BuildFormFactorTable(material); <<
197 <<
198 //2) retrieve or build the sampling table <<
199 if (!(fSamplingTable->count(material))) <<
200 InitializeSamplingAlgorithm(material); <<
201 <<
202 //3) retrieve or build the pMax data <<
203 if (!fPMaxTable->count(material)) <<
204 GetPMaxTable(material); <<
205 } <<
206 <<
207 if (fVerboseLevel > 1) { <<
208 G4cout << "Penelope Rayleigh model v2008 is <<
209 << "Energy range: " <<
210 << LowEnergyLimit() / keV << " keV - <<
211 << HighEnergyLimit() / GeV << " GeV" <<
212 << G4endl; <<
213 } <<
214 } <<
215 177
216 if(fIsInitialised) return; << 178 if(isInitialised) return;
217 fParticleChange = GetParticleChangeForGamma( 179 fParticleChange = GetParticleChangeForGamma();
218 fIsInitialised = true; << 180 isInitialised = true;
219 } 181 }
220 182
221 //....oooOO0OOooo........oooOO0OOooo........oo 183 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
222 184
223 void G4PenelopeRayleighModel::InitialiseLocal( <<
224 G4VEmModel *masterModel) <<
225 { <<
226 if (fVerboseLevel > 3) <<
227 G4cout << "Calling G4PenelopeRayleighMode <<
228 // <<
229 //Check that particle matches: one might hav <<
230 //for e+ and e-). <<
231 // <<
232 if (part == fParticle) <<
233 { <<
234 //Get the const table pointers from the <<
235 const G4PenelopeRayleighModel* theModel <<
236 static_cast<G4PenelopeRayleighModel*> (maste <<
237 <<
238 //Copy pointers to the data tables <<
239 for(G4int i=0; i<=fMaxZ; ++i) <<
240 { <<
241 fLogAtomicCrossSection[i] = theModel->fLog <<
242 fAtomicFormFactor[i] = theModel->fAtomicFo <<
243 } <<
244 fLogFormFactorTable = theModel->fLogForm <<
245 fPMaxTable = theModel->fPMaxTable; <<
246 fSamplingTable = theModel->fSamplingTabl <<
247 <<
248 //copy the G4DataVector with the grid <<
249 fLogQSquareGrid = theModel->fLogQSquareG <<
250 <<
251 //Same verbosity for all workers, as the <<
252 fVerboseLevel = theModel->fVerboseLevel; <<
253 } <<
254 <<
255 return; <<
256 } <<
257 <<
258 <<
259 //....oooOO0OOooo........oooOO0OOooo........oo <<
260 namespace { G4Mutex PenelopeRayleighModelMute <<
261 G4double G4PenelopeRayleighModel::ComputeCross 185 G4double G4PenelopeRayleighModel::ComputeCrossSectionPerAtom(const G4ParticleDefinition*,
262 G4double energy, 186 G4double energy,
263 G4double Z, 187 G4double Z,
264 G4double, 188 G4double,
265 G4double, 189 G4double,
266 G4double) 190 G4double)
267 { 191 {
268 // Cross section of Rayleigh scattering in P << 192 // Cross section of Rayleigh scattering in Penelope v2008 is calculated by the EPDL97
269 // tabulation, Cuellen et al. (1997), with n << 193 // tabulation, Cuellen et al. (1997), with non-relativistic form factors from Hubbel
270 // et al. J. Phys. Chem. Ref. Data 4 (1975) 194 // et al. J. Phys. Chem. Ref. Data 4 (1975) 471; Erratum ibid. 6 (1977) 615.
271 195
272 if (fVerboseLevel > 3) << 196 if (verboseLevel > 3)
273 G4cout << "Calling CrossSectionPerAtom() o 197 G4cout << "Calling CrossSectionPerAtom() of G4PenelopeRayleighModel" << G4endl;
>> 198
>> 199 G4int iZ = (G4int) Z;
274 200
275 G4int iZ = G4int(Z); << 201 //read data files
276 << 202 if (!logAtomicCrossSection->count(iZ))
277 if (!fLogAtomicCrossSection[iZ]) << 203 ReadDataFile(iZ);
>> 204 //now it should be ok
>> 205 if (!logAtomicCrossSection->count(iZ))
278 { 206 {
279 //If we are here, it means that Initial << 207 G4Exception("G4PenelopeRayleighModel::ComputeCrossSectionPerAtom()",
280 //not filled up. This can happen in a U << 208 "em2040",FatalException,"Unable to load the cross section table");
281 if (fVerboseLevel > 0) <<
282 { <<
283 //Issue a G4Exception (warning) only in ve <<
284 G4ExceptionDescription ed; <<
285 ed << "Unable to retrieve the cross sectio <<
286 ed << "This can happen only in Unit Tests <<
287 G4Exception("G4PenelopeRayleighModel::Comp <<
288 "em2040",JustWarning,ed); <<
289 } <<
290 //protect file reading via autolock <<
291 G4AutoLock lock(&PenelopeRayleighModelM <<
292 ReadDataFile(iZ); <<
293 lock.unlock(); <<
294 } 209 }
295 210
296 G4double cross = 0; 211 G4double cross = 0;
297 G4PhysicsFreeVector* atom = fLogAtomicCross << 212
>> 213 G4PhysicsFreeVector* atom = logAtomicCrossSection->find(iZ)->second;
298 if (!atom) 214 if (!atom)
299 { 215 {
300 G4ExceptionDescription ed; 216 G4ExceptionDescription ed;
301 ed << "Unable to find Z=" << iZ << " in 217 ed << "Unable to find Z=" << iZ << " in the atomic cross section table" << G4endl;
302 G4Exception("G4PenelopeRayleighModel::C 218 G4Exception("G4PenelopeRayleighModel::ComputeCrossSectionPerAtom()",
303 "em2041",FatalException,ed); 219 "em2041",FatalException,ed);
304 return 0; 220 return 0;
305 } 221 }
306 G4double logene = G4Log(energy); << 222 G4double logene = std::log(energy);
307 G4double logXS = atom->Value(logene); 223 G4double logXS = atom->Value(logene);
308 cross = G4Exp(logXS); << 224 cross = std::exp(logXS);
309 225
310 if (fVerboseLevel > 2) << 226 if (verboseLevel > 2)
311 { << 227 G4cout << "Rayleigh cross section at " << energy/keV << " keV for Z=" << Z <<
312 G4cout << "Rayleigh cross section at " << 228 " = " << cross/barn << " barn" << G4endl;
313 " = " << cross/barn << " barn" << G4endl; << 229 return cross;
314 } <<
315 return cross; <<
316 } 230 }
317 231
318 232
319 //....oooOO0OOooo........oooOO0OOooo........oo 233 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
320 void G4PenelopeRayleighModel::BuildFormFactorT 234 void G4PenelopeRayleighModel::BuildFormFactorTable(const G4Material* material)
321 { 235 {
>> 236
322 /* 237 /*
323 1) get composition and equivalent molecula 238 1) get composition and equivalent molecular density
324 */ 239 */
325 std::size_t nElements = material->GetNumberO << 240
>> 241 G4int nElements = material->GetNumberOfElements();
326 const G4ElementVector* elementVector = mater 242 const G4ElementVector* elementVector = material->GetElementVector();
327 const G4double* fractionVector = material->G 243 const G4double* fractionVector = material->GetFractionVector();
328 244
329 std::vector<G4double> *StechiometricFactors 245 std::vector<G4double> *StechiometricFactors = new std::vector<G4double>;
330 for (std::size_t i=0;i<nElements;++i) << 246 for (G4int i=0;i<nElements;i++)
331 { 247 {
332 G4double fraction = fractionVector[i]; 248 G4double fraction = fractionVector[i];
333 G4double atomicWeigth = (*elementVector) 249 G4double atomicWeigth = (*elementVector)[i]->GetA()/(g/mole);
334 StechiometricFactors->push_back(fraction 250 StechiometricFactors->push_back(fraction/atomicWeigth);
335 } 251 }
336 //Find max 252 //Find max
337 G4double MaxStechiometricFactor = 0.; 253 G4double MaxStechiometricFactor = 0.;
338 for (std::size_t i=0;i<nElements;++i) << 254 for (G4int i=0;i<nElements;i++)
339 { 255 {
340 if ((*StechiometricFactors)[i] > MaxStec 256 if ((*StechiometricFactors)[i] > MaxStechiometricFactor)
341 MaxStechiometricFactor = (*Stechiometr 257 MaxStechiometricFactor = (*StechiometricFactors)[i];
342 } 258 }
343 if (MaxStechiometricFactor<1e-16) 259 if (MaxStechiometricFactor<1e-16)
344 { 260 {
345 G4ExceptionDescription ed; 261 G4ExceptionDescription ed;
346 ed << "Inconsistent data of atomic compo << 262 ed << "Inconsistent data of atomic composition for " <<
347 material->GetName() << G4endl; 263 material->GetName() << G4endl;
348 G4Exception("G4PenelopeRayleighModel::Bu 264 G4Exception("G4PenelopeRayleighModel::BuildFormFactorTable()",
349 "em2042",FatalException,ed); 265 "em2042",FatalException,ed);
350 } 266 }
351 //Normalize 267 //Normalize
352 for (std::size_t i=0;i<nElements;++i) << 268 for (G4int i=0;i<nElements;i++)
353 (*StechiometricFactors)[i] /= MaxStechiom 269 (*StechiometricFactors)[i] /= MaxStechiometricFactor;
354 << 270
>> 271 // Equivalent atoms per molecule
>> 272 G4double atomsPerMolecule = 0;
>> 273 for (G4int i=0;i<nElements;i++)
>> 274 atomsPerMolecule += (*StechiometricFactors)[i];
>> 275
355 /* 276 /*
356 CREATE THE FORM FACTOR TABLE 277 CREATE THE FORM FACTOR TABLE
357 */ 278 */
358 G4PhysicsFreeVector* theFFVec = new G4Physic << 279 G4PhysicsFreeVector* theFFVec = new G4PhysicsFreeVector(logQSquareGrid.size());
>> 280 theFFVec->SetSpline(true);
359 281
360 for (std::size_t k=0;k<fLogQSquareGrid.size( << 282 for (size_t k=0;k<logQSquareGrid.size();k++)
361 { 283 {
362 G4double ff2 = 0; //squared form factor 284 G4double ff2 = 0; //squared form factor
363 for (std::size_t i=0;i<nElements;++i) << 285 for (G4int i=0;i<nElements;i++)
364 { 286 {
365 G4int iZ = (*elementVector)[i]->GetZasInt( << 287 G4int iZ = (G4int) (*elementVector)[i]->GetZ();
366 G4PhysicsFreeVector* theAtomVec = fAtomicF << 288 G4PhysicsFreeVector* theAtomVec = atomicFormFactor->find(iZ)->second;
367 G4double f = (*theAtomVec)[k]; //the q-gri << 289 G4double f = (*theAtomVec)[k]; //the q-grid is always the same
368 ff2 += f*f*(*StechiometricFactors)[i]; 290 ff2 += f*f*(*StechiometricFactors)[i];
369 } 291 }
370 if (ff2) 292 if (ff2)
371 theFFVec->PutValue(k,fLogQSquareGrid[k],G4Lo << 293 theFFVec->PutValue(k,logQSquareGrid[k],std::log(ff2)); //NOTICE: THIS IS log(Q^2) vs. log(F^2)
372 } 294 }
373 theFFVec->FillSecondDerivatives(); //vector << 295 logFormFactorTable->insert(std::make_pair(material,theFFVec));
374 fLogFormFactorTable->insert(std::make_pair(m <<
375 296
376 delete StechiometricFactors; 297 delete StechiometricFactors;
>> 298
377 return; 299 return;
378 } 300 }
379 301
>> 302
380 //....oooOO0OOooo........oooOO0OOooo........oo 303 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
381 304
382 void G4PenelopeRayleighModel::SampleSecondarie 305 void G4PenelopeRayleighModel::SampleSecondaries(std::vector<G4DynamicParticle*>* ,
383 const G4MaterialCutsCouple* couple 306 const G4MaterialCutsCouple* couple,
384 const G4DynamicParticle* aDynamicG 307 const G4DynamicParticle* aDynamicGamma,
385 G4double, 308 G4double,
386 G4double) 309 G4double)
387 { 310 {
388 // Sampling of the Rayleigh final state (nam << 311 // Sampling of the Rayleigh final state (namely, scattering angle of the photon)
389 // from the Penelope2008 model. The scatteri << 312 // from the Penelope2008 model. The scattering angle is sampled from the atomic
390 // cross section dOmega/d(cosTheta) from Bor << 313 // cross section dOmega/d(cosTheta) from Born ("Atomic Phyisics", 1969), disregarding
391 // anomalous scattering effects. The Form Fa << 314 // anomalous scattering effects. The Form Factor F(Q) function which appears in the
392 // analytical cross section is retrieved via << 315 // analytical cross section is retrieved via the method GetFSquared(); atomic data
393 // are tabulated for F(Q). Form factor for c << 316 // are tabulated for F(Q). Form factor for compounds is calculated according to
394 // the additivity rule. The sampling from th << 317 // the additivity rule. The sampling from the F(Q) is made via a Rational Inverse
395 // Transform with Aliasing (RITA) algorithm; << 318 // Transform with Aliasing (RITA) algorithm; RITA parameters are calculated once
396 // for each material and managed by G4Penelo 319 // for each material and managed by G4PenelopeSamplingData objects.
397 // The sampling algorithm (rejection method) << 320 // The sampling algorithm (rejection method) has efficiency 67% at low energy, and
398 // increases with energy. For E=100 keV the << 321 // increases with energy. For E=100 keV the efficiency is 100% and 86% for
399 // hydrogen and uranium, respectively. 322 // hydrogen and uranium, respectively.
400 323
401 if (fVerboseLevel > 3) << 324 if (verboseLevel > 3)
402 G4cout << "Calling SamplingSecondaries() o 325 G4cout << "Calling SamplingSecondaries() of G4PenelopeRayleighModel" << G4endl;
403 326
404 G4double photonEnergy0 = aDynamicGamma->GetK 327 G4double photonEnergy0 = aDynamicGamma->GetKineticEnergy();
405 << 328
406 if (photonEnergy0 <= fIntrinsicLowEnergyLimi 329 if (photonEnergy0 <= fIntrinsicLowEnergyLimit)
407 { 330 {
408 fParticleChange->ProposeTrackStatus(fSto 331 fParticleChange->ProposeTrackStatus(fStopAndKill);
409 fParticleChange->SetProposedKineticEnerg 332 fParticleChange->SetProposedKineticEnergy(0.);
410 fParticleChange->ProposeLocalEnergyDepos 333 fParticleChange->ProposeLocalEnergyDeposit(photonEnergy0);
411 return ; 334 return ;
412 } 335 }
413 336
414 G4ParticleMomentum photonDirection0 = aDynam 337 G4ParticleMomentum photonDirection0 = aDynamicGamma->GetMomentumDirection();
415 << 338
416 const G4Material* theMat = couple->GetMateri 339 const G4Material* theMat = couple->GetMaterial();
417 << 340
418 //1) Verify if tables are ready 341 //1) Verify if tables are ready
419 //Either Initialize() was not called, or we << 342 if (!pMaxTable || !samplingTable)
420 //not invoked << 343 {
421 if (!fPMaxTable || !fSamplingTable || !fLogF << 344 G4Exception("G4PenelopeRayleighModel::SampleSecondaries()",
422 { << 345 "em2043",FatalException,"Invalid model initialization");
423 //create a **thread-local** version of t << 346 return;
424 //Unit Tests << 347 }
425 fLocalTable = true; << 348
426 if (!fLogFormFactorTable) << 349 //2) retrieve or build the sampling table
427 fLogFormFactorTable = new std::map<const G4M << 350 if (!(samplingTable->count(theMat)))
428 if (!fPMaxTable) << 351 InitializeSamplingAlgorithm(theMat);
429 fPMaxTable = new std::map<const G4Material*, << 352 G4PenelopeSamplingData* theDataTable = samplingTable->find(theMat)->second;
430 if (!fSamplingTable) << 353
431 fSamplingTable = new std::map<const G4Materi << 354 //3) retrieve or build the pMax data
432 } << 355 if (!pMaxTable->count(theMat))
433 << 356 GetPMaxTable(theMat);
434 if (!fSamplingTable->count(theMat)) << 357 G4PhysicsFreeVector* thePMax = pMaxTable->find(theMat)->second;
435 { <<
436 //If we are here, it means that Initiali <<
437 //not filled up. This can happen in a Un <<
438 if (fVerboseLevel > 0) <<
439 { <<
440 //Issue a G4Exception (warning) only in ve <<
441 G4ExceptionDescription ed; <<
442 ed << "Unable to find the fSamplingTable d <<
443 theMat->GetName() << G4endl; <<
444 ed << "This can happen only in Unit Tests" <<
445 G4Exception("G4PenelopeRayleighModel::Samp <<
446 "em2019",JustWarning,ed); <<
447 } <<
448 const G4ElementVector* theElementVector <<
449 //protect file reading via autolock <<
450 G4AutoLock lock(&PenelopeRayleighModelMu <<
451 for (std::size_t j=0;j<theMat->GetNumber <<
452 { <<
453 G4int iZ = theElementVector->at(j)->GetZas <<
454 if (!fLogAtomicCrossSection[iZ]) <<
455 { <<
456 lock.lock(); <<
457 ReadDataFile(iZ); <<
458 lock.unlock(); <<
459 } <<
460 } <<
461 lock.lock(); <<
462 //1) If the table has not been built for <<
463 if (!fLogFormFactorTable->count(theMat)) <<
464 BuildFormFactorTable(theMat); <<
465 <<
466 //2) retrieve or build the sampling tabl <<
467 if (!(fSamplingTable->count(theMat))) <<
468 InitializeSamplingAlgorithm(theMat); <<
469 <<
470 //3) retrieve or build the pMax data <<
471 if (!fPMaxTable->count(theMat)) <<
472 GetPMaxTable(theMat); <<
473 lock.unlock(); <<
474 } <<
475 <<
476 //Ok, restart the job <<
477 G4PenelopeSamplingData* theDataTable = fSamp <<
478 G4PhysicsFreeVector* thePMax = fPMaxTable->f <<
479 358
480 G4double cosTheta = 1.0; 359 G4double cosTheta = 1.0;
481 << 360
482 //OK, ready to go! 361 //OK, ready to go!
483 G4double qmax = 2.0*photonEnergy0/electron_m 362 G4double qmax = 2.0*photonEnergy0/electron_mass_c2; //this is non-dimensional now
484 363
485 if (qmax < 1e-10) //very low momentum transf 364 if (qmax < 1e-10) //very low momentum transfer
486 { 365 {
487 G4bool loopAgain=false; 366 G4bool loopAgain=false;
488 do 367 do
489 { 368 {
490 loopAgain = false; 369 loopAgain = false;
491 cosTheta = 1.0-2.0*G4UniformRand(); 370 cosTheta = 1.0-2.0*G4UniformRand();
492 G4double G = 0.5*(1+cosTheta*cosTheta); 371 G4double G = 0.5*(1+cosTheta*cosTheta);
493 if (G4UniformRand()>G) 372 if (G4UniformRand()>G)
494 loopAgain = true; 373 loopAgain = true;
495 }while(loopAgain); 374 }while(loopAgain);
496 } 375 }
497 else //larger momentum transfer 376 else //larger momentum transfer
498 { 377 {
499 std::size_t nData = theDataTable->GetNum << 378 size_t nData = theDataTable->GetNumberOfStoredPoints();
500 G4double LastQ2inTheTable = theDataTable 379 G4double LastQ2inTheTable = theDataTable->GetX(nData-1);
501 G4double q2max = std::min(qmax*qmax,Last 380 G4double q2max = std::min(qmax*qmax,LastQ2inTheTable);
502 381
503 G4bool loopAgain = false; 382 G4bool loopAgain = false;
504 G4double MaxPValue = thePMax->Value(phot 383 G4double MaxPValue = thePMax->Value(photonEnergy0);
505 G4double xx=0; 384 G4double xx=0;
506 << 385
507 //Sampling by rejection method. The reje << 386 //Sampling by rejection method. The rejection function is
508 //G = 0.5*(1+cos^2(theta)) 387 //G = 0.5*(1+cos^2(theta))
509 // 388 //
510 do{ 389 do{
511 loopAgain = false; 390 loopAgain = false;
512 G4double RandomMax = G4UniformRand()*MaxPVal 391 G4double RandomMax = G4UniformRand()*MaxPValue;
513 xx = theDataTable->SampleValue(RandomMax); 392 xx = theDataTable->SampleValue(RandomMax);
514 //xx is a random value of q^2 in (0,q2max),s << 393 //xx is a random value of q^2 in (0,q2max),sampled according to
515 //F(Q^2) via the RITA algorithm 394 //F(Q^2) via the RITA algorithm
516 if (xx > q2max) 395 if (xx > q2max)
517 loopAgain = true; 396 loopAgain = true;
518 cosTheta = 1.0-2.0*xx/q2max; 397 cosTheta = 1.0-2.0*xx/q2max;
519 G4double G = 0.5*(1+cosTheta*cosTheta); 398 G4double G = 0.5*(1+cosTheta*cosTheta);
520 if (G4UniformRand()>G) 399 if (G4UniformRand()>G)
521 loopAgain = true; 400 loopAgain = true;
522 }while(loopAgain); 401 }while(loopAgain);
523 } 402 }
524 << 403
525 G4double sinTheta = std::sqrt(1-cosTheta*cos 404 G4double sinTheta = std::sqrt(1-cosTheta*cosTheta);
526 << 405
527 // Scattered photon angles. ( Z - axis along 406 // Scattered photon angles. ( Z - axis along the parent photon)
528 G4double phi = twopi * G4UniformRand() ; 407 G4double phi = twopi * G4UniformRand() ;
529 G4double dirX = sinTheta*std::cos(phi); 408 G4double dirX = sinTheta*std::cos(phi);
530 G4double dirY = sinTheta*std::sin(phi); 409 G4double dirY = sinTheta*std::sin(phi);
531 G4double dirZ = cosTheta; 410 G4double dirZ = cosTheta;
532 << 411
533 // Update G4VParticleChange for the scattere << 412 // Update G4VParticleChange for the scattered photon
534 G4ThreeVector photonDirection1(dirX, dirY, d 413 G4ThreeVector photonDirection1(dirX, dirY, dirZ);
535 414
536 photonDirection1.rotateUz(photonDirection0); 415 photonDirection1.rotateUz(photonDirection0);
537 fParticleChange->ProposeMomentumDirection(ph 416 fParticleChange->ProposeMomentumDirection(photonDirection1) ;
538 fParticleChange->SetProposedKineticEnergy(ph 417 fParticleChange->SetProposedKineticEnergy(photonEnergy0) ;
539 << 418
540 return; 419 return;
541 } 420 }
542 421
543 422
544 //....oooOO0OOooo........oooOO0OOooo........oo 423 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
545 424
546 void G4PenelopeRayleighModel::ReadDataFile(con 425 void G4PenelopeRayleighModel::ReadDataFile(const G4int Z)
547 { 426 {
548 if (fVerboseLevel > 2) << 427 if (verboseLevel > 2)
549 { 428 {
550 G4cout << "G4PenelopeRayleighModel::Read 429 G4cout << "G4PenelopeRayleighModel::ReadDataFile()" << G4endl;
551 G4cout << "Going to read Rayleigh data f 430 G4cout << "Going to read Rayleigh data files for Z=" << Z << G4endl;
552 } 431 }
553 const char* path = G4FindDataDir("G4LEDATA << 432
554 if(!path) << 433 char* path = getenv("G4LEDATA");
>> 434 if (!path)
555 { 435 {
556 G4String excep = "G4LEDATA environment v 436 G4String excep = "G4LEDATA environment variable not set!";
557 G4Exception("G4PenelopeRayleighModel::Re 437 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
558 "em0006",FatalException,excep); 438 "em0006",FatalException,excep);
559 return; 439 return;
560 } 440 }
561 441
562 /* 442 /*
563 Read first the cross section file 443 Read first the cross section file
564 */ 444 */
565 std::ostringstream ost; 445 std::ostringstream ost;
566 if (Z>9) 446 if (Z>9)
567 ost << path << "/penelope/rayleigh/pdgra" 447 ost << path << "/penelope/rayleigh/pdgra" << Z << ".p08";
568 else 448 else
569 ost << path << "/penelope/rayleigh/pdgra0" 449 ost << path << "/penelope/rayleigh/pdgra0" << Z << ".p08";
570 std::ifstream file(ost.str().c_str()); 450 std::ifstream file(ost.str().c_str());
571 if (!file.is_open()) 451 if (!file.is_open())
572 { 452 {
573 G4String excep = "Data file " + G4String 453 G4String excep = "Data file " + G4String(ost.str()) + " not found!";
574 G4Exception("G4PenelopeRayleighModel::Re 454 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
575 "em0003",FatalException,excep); 455 "em0003",FatalException,excep);
576 } 456 }
577 G4int readZ =0; 457 G4int readZ =0;
578 std::size_t nPoints= 0; << 458 size_t nPoints= 0;
579 file >> readZ >> nPoints; 459 file >> readZ >> nPoints;
580 //check the right file is opened. 460 //check the right file is opened.
581 if (readZ != Z || nPoints <= 0 || nPoints >= 461 if (readZ != Z || nPoints <= 0 || nPoints >= 5000)
582 { 462 {
583 G4ExceptionDescription ed; 463 G4ExceptionDescription ed;
584 ed << "Corrupted data file for Z=" << Z 464 ed << "Corrupted data file for Z=" << Z << G4endl;
585 G4Exception("G4PenelopeRayleighModel::Re 465 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
586 "em0005",FatalException,ed); 466 "em0005",FatalException,ed);
587 return; 467 return;
588 } << 468 }
589 << 469 G4PhysicsFreeVector* theVec = new G4PhysicsFreeVector((size_t)nPoints);
590 fLogAtomicCrossSection[Z] = new G4PhysicsFre <<
591 G4double ene=0,f1=0,f2=0,xs=0; 470 G4double ene=0,f1=0,f2=0,xs=0;
592 for (std::size_t i=0;i<nPoints;++i) << 471 for (size_t i=0;i<nPoints;i++)
593 { 472 {
594 file >> ene >> f1 >> f2 >> xs; 473 file >> ene >> f1 >> f2 >> xs;
595 //dimensional quantities 474 //dimensional quantities
596 ene *= eV; 475 ene *= eV;
597 xs *= cm2; 476 xs *= cm2;
598 fLogAtomicCrossSection[Z]->PutValue(i,G4 << 477 theVec->PutValue(i,std::log(ene),std::log(xs));
599 if (file.eof() && i != (nPoints-1)) //fi 478 if (file.eof() && i != (nPoints-1)) //file ended too early
600 { 479 {
601 G4ExceptionDescription ed ; << 480 G4ExceptionDescription ed ;
602 ed << "Corrupted data file for Z=" << Z << 481 ed << "Corrupted data file for Z=" << Z << G4endl;
603 ed << "Found less than " << nPoints << "en 482 ed << "Found less than " << nPoints << "entries " <<G4endl;
604 G4Exception("G4PenelopeRayleighModel::Read 483 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
605 "em0005",FatalException,ed); 484 "em0005",FatalException,ed);
606 } 485 }
607 } 486 }
>> 487 if (!logAtomicCrossSection)
>> 488 {
>> 489 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
>> 490 "em2044",FatalException,"Unable to allocate the atomic cross section table");
>> 491 delete theVec;
>> 492 return;
>> 493 }
>> 494 logAtomicCrossSection->insert(std::make_pair(Z,theVec));
608 file.close(); 495 file.close();
609 496
610 /* 497 /*
611 Then read the form factor file 498 Then read the form factor file
612 */ 499 */
613 std::ostringstream ost2; 500 std::ostringstream ost2;
614 if (Z>9) 501 if (Z>9)
615 ost2 << path << "/penelope/rayleigh/pdaff" 502 ost2 << path << "/penelope/rayleigh/pdaff" << Z << ".p08";
616 else 503 else
617 ost2 << path << "/penelope/rayleigh/pdaff0 504 ost2 << path << "/penelope/rayleigh/pdaff0" << Z << ".p08";
618 file.open(ost2.str().c_str()); 505 file.open(ost2.str().c_str());
619 if (!file.is_open()) 506 if (!file.is_open())
620 { 507 {
621 G4String excep = "Data file " + G4String 508 G4String excep = "Data file " + G4String(ost2.str()) + " not found!";
622 G4Exception("G4PenelopeRayleighModel::Re 509 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
623 "em0003",FatalException,excep); 510 "em0003",FatalException,excep);
624 } 511 }
625 file >> readZ >> nPoints; 512 file >> readZ >> nPoints;
626 //check the right file is opened. 513 //check the right file is opened.
627 if (readZ != Z || nPoints <= 0 || nPoints >= 514 if (readZ != Z || nPoints <= 0 || nPoints >= 5000)
628 { 515 {
629 G4ExceptionDescription ed; 516 G4ExceptionDescription ed;
630 ed << "Corrupted data file for Z=" << Z 517 ed << "Corrupted data file for Z=" << Z << G4endl;
631 G4Exception("G4PenelopeRayleighModel::Re 518 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
632 "em0005",FatalException,ed); 519 "em0005",FatalException,ed);
633 return; 520 return;
634 } << 521 }
635 fAtomicFormFactor[Z] = new G4PhysicsFreeVect << 522 G4PhysicsFreeVector* theFFVec = new G4PhysicsFreeVector((size_t)nPoints);
636 G4double q=0,ff=0,incoh=0; 523 G4double q=0,ff=0,incoh=0;
637 G4bool fillQGrid = false; 524 G4bool fillQGrid = false;
638 //fill this vector only the first time. 525 //fill this vector only the first time.
639 if (!fLogQSquareGrid.size()) << 526 if (!logQSquareGrid.size())
640 fillQGrid = true; 527 fillQGrid = true;
641 for (std::size_t i=0;i<nPoints;++i) << 528 for (size_t i=0;i<nPoints;i++)
642 { 529 {
643 file >> q >> ff >> incoh; 530 file >> q >> ff >> incoh;
644 //q and ff are dimensionless (q is in un 531 //q and ff are dimensionless (q is in units of (m_e*c)
645 fAtomicFormFactor[Z]->PutValue(i,q,ff); << 532 theFFVec->PutValue(i,q,ff);
646 if (fillQGrid) 533 if (fillQGrid)
647 { 534 {
648 fLogQSquareGrid.push_back(2.0*G4Log(q)); << 535 logQSquareGrid.push_back(2.0*std::log(q));
649 } 536 }
650 if (file.eof() && i != (nPoints-1)) //fi 537 if (file.eof() && i != (nPoints-1)) //file ended too early
651 { 538 {
652 G4ExceptionDescription ed; << 539 G4ExceptionDescription ed;
653 ed << "Corrupted data file for Z=" << Z << 540 ed << "Corrupted data file for Z=" << Z << G4endl;
654 ed << "Found less than " << nPoints << "en 541 ed << "Found less than " << nPoints << "entries " <<G4endl;
655 G4Exception("G4PenelopeRayleighModel::Read 542 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
656 "em0005",FatalException,ed); 543 "em0005",FatalException,ed);
657 } 544 }
658 } 545 }
>> 546 if (!atomicFormFactor)
>> 547 {
>> 548 G4Exception("G4PenelopeRayleighModel::ReadDataFile()",
>> 549 "em2045",FatalException,
>> 550 "Unable to allocate the atomicFormFactor data table");
>> 551 delete theFFVec;
>> 552 return;
>> 553 }
>> 554 atomicFormFactor->insert(std::make_pair(Z,theFFVec));
659 file.close(); 555 file.close();
660 return; 556 return;
661 } 557 }
662 558
663 //....oooOO0OOooo........oooOO0OOooo........oo 559 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
664 560
665 G4double G4PenelopeRayleighModel::GetFSquared( 561 G4double G4PenelopeRayleighModel::GetFSquared(const G4Material* mat, const G4double QSquared)
666 { 562 {
667 G4double f2 = 0; 563 G4double f2 = 0;
668 //Input value QSquared could be zero: protec << 564 //Input value QSquared could be zero: protect the log() below against
669 //the FPE exception 565 //the FPE exception
670 //If Q<1e-10, set Q to 1e-10 566 //If Q<1e-10, set Q to 1e-10
671 G4double logQSquared = (QSquared>1e-10) ? G4 << 567 G4double logQSquared = (QSquared>1e-10) ? std::log(QSquared) : -23.;
672 //last value of the table 568 //last value of the table
673 G4double maxlogQ2 = fLogQSquareGrid[fLogQSqu << 569 G4double maxlogQ2 = logQSquareGrid[logQSquareGrid.size()-1];
674 << 570 //If the table has not been built for the material, do it!
>> 571 if (!logFormFactorTable->count(mat))
>> 572 BuildFormFactorTable(mat);
>> 573
675 //now it should be all right 574 //now it should be all right
676 G4PhysicsFreeVector* theVec = fLogFormFactor << 575 G4PhysicsFreeVector* theVec = logFormFactorTable->find(mat)->second;
677 576
678 if (!theVec) 577 if (!theVec)
679 { 578 {
680 G4ExceptionDescription ed; 579 G4ExceptionDescription ed;
681 ed << "Unable to retrieve F squared tabl 580 ed << "Unable to retrieve F squared table for " << mat->GetName() << G4endl;
682 G4Exception("G4PenelopeRayleighModel::Ge 581 G4Exception("G4PenelopeRayleighModel::GetFSquared()",
683 "em2046",FatalException,ed); 582 "em2046",FatalException,ed);
684 return 0; 583 return 0;
685 } 584 }
686 if (logQSquared < -20) // Q < 1e-9 585 if (logQSquared < -20) // Q < 1e-9
687 { 586 {
688 G4double logf2 = (*theVec)[0]; //first v 587 G4double logf2 = (*theVec)[0]; //first value of the table
689 f2 = G4Exp(logf2); << 588 f2 = std::exp(logf2);
690 } 589 }
691 else if (logQSquared > maxlogQ2) 590 else if (logQSquared > maxlogQ2)
692 f2 =0; 591 f2 =0;
693 else 592 else
694 { 593 {
695 //log(Q^2) vs. log(F^2) 594 //log(Q^2) vs. log(F^2)
696 G4double logf2 = theVec->Value(logQSquar 595 G4double logf2 = theVec->Value(logQSquared);
697 f2 = G4Exp(logf2); << 596 f2 = std::exp(logf2);
698 597
699 } 598 }
700 if (fVerboseLevel > 3) << 599 if (verboseLevel > 3)
701 { 600 {
702 G4cout << "G4PenelopeRayleighModel::GetF << 601 G4cout << "G4PenelopeRayleighModel::GetFSquared() in " << mat->GetName() << G4endl;
703 G4cout << "Q^2 = " << QSquared << " (un 602 G4cout << "Q^2 = " << QSquared << " (units of 1/(m_e*c); F^2 = " << f2 << G4endl;
704 } 603 }
705 return f2; 604 return f2;
706 } 605 }
707 606
708 //....oooOO0OOooo........oooOO0OOooo........oo 607 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
709 608
710 void G4PenelopeRayleighModel::InitializeSampli 609 void G4PenelopeRayleighModel::InitializeSamplingAlgorithm(const G4Material* mat)
711 { 610 {
712 G4double q2min = 0; 611 G4double q2min = 0;
713 G4double q2max = 0; 612 G4double q2max = 0;
714 const std::size_t np = 150; //hard-coded in << 613 const size_t np = 150; //hard-coded in Penelope
715 //G4cout << "Init N= " << fLogQSquareGrid.si << 614 for (size_t i=1;i<logQSquareGrid.size();i++)
716 for (std::size_t i=1;i<fLogQSquareGrid.size( <<
717 { 615 {
718 G4double Q2 = G4Exp(fLogQSquareGrid[i]); << 616 G4double Q2 = std::exp(logQSquareGrid[i]);
719 if (GetFSquared(mat,Q2) > 1e-35) 617 if (GetFSquared(mat,Q2) > 1e-35)
720 { 618 {
721 q2max = G4Exp(fLogQSquareGrid[i-1]); << 619 q2max = std::exp(logQSquareGrid[i-1]);
722 } 620 }
723 //G4cout << "Q2= " << Q2 << " q2max= " < <<
724 } 621 }
725 << 622
726 std::size_t nReducedPoints = np/4; << 623 size_t nReducedPoints = np/4;
727 624
728 //check for errors 625 //check for errors
729 if (np < 16) 626 if (np < 16)
730 { 627 {
731 G4Exception("G4PenelopeRayleighModel::In 628 G4Exception("G4PenelopeRayleighModel::InitializeSamplingAlgorithm()",
732 "em2047",FatalException, 629 "em2047",FatalException,
733 "Too few points to initialize the sampli 630 "Too few points to initialize the sampling algorithm");
734 } 631 }
735 if (q2min > (q2max-1e-10)) 632 if (q2min > (q2max-1e-10))
736 { 633 {
737 G4cout << "q2min= " << q2min << " q2max= <<
738 G4Exception("G4PenelopeRayleighModel::In 634 G4Exception("G4PenelopeRayleighModel::InitializeSamplingAlgorithm()",
739 "em2048",FatalException, 635 "em2048",FatalException,
740 "Too narrow grid to initialize the sampl 636 "Too narrow grid to initialize the sampling algorithm");
741 } 637 }
742 638
743 //This is subroutine RITAI0 of Penelope 639 //This is subroutine RITAI0 of Penelope
744 //Create an object of type G4PenelopeRayleig 640 //Create an object of type G4PenelopeRayleighSamplingData --> store in a map::Material*
745 641
746 //temporary vectors --> Then everything is s 642 //temporary vectors --> Then everything is stored in G4PenelopeSamplingData
747 G4DataVector* x = new G4DataVector(); 643 G4DataVector* x = new G4DataVector();
748 << 644
749 /******************************************* 645 /*******************************************************************************
750 Start with a grid of NUNIF points uniforml 646 Start with a grid of NUNIF points uniformly spaced in the interval q2min,q2max
751 ******************************************** 647 ********************************************************************************/
752 std::size_t NUNIF = std::min(std::max(((std: << 648 size_t NUNIF = std::min(std::max(((size_t)8),nReducedPoints),np/2);
753 const G4int nip = 51; //hard-coded in Penelo 649 const G4int nip = 51; //hard-coded in Penelope
754 650
755 G4double dx = (q2max-q2min)/((G4double) NUNI << 651 G4double dx = (q2max-q2min)/((G4double) NUNIF-1);
756 x->push_back(q2min); << 652 x->push_back(q2min);
757 for (std::size_t i=1;i<NUNIF-1;++i) << 653 for (size_t i=1;i<NUNIF-1;i++)
758 { 654 {
759 G4double app = q2min + i*dx; 655 G4double app = q2min + i*dx;
760 x->push_back(app); //increase << 656 x->push_back(app); //increase
761 } 657 }
762 x->push_back(q2max); 658 x->push_back(q2max);
763 << 659
764 if (fVerboseLevel> 3) << 660 if (verboseLevel> 3)
765 G4cout << "Vector x has " << x->size() << 661 G4cout << "Vector x has " << x->size() << " points, while NUNIF = " << NUNIF << G4endl;
766 662
767 //Allocate temporary storage vectors 663 //Allocate temporary storage vectors
768 G4DataVector* area = new G4DataVector(); 664 G4DataVector* area = new G4DataVector();
769 G4DataVector* a = new G4DataVector(); 665 G4DataVector* a = new G4DataVector();
770 G4DataVector* b = new G4DataVector(); 666 G4DataVector* b = new G4DataVector();
771 G4DataVector* c = new G4DataVector(); 667 G4DataVector* c = new G4DataVector();
772 G4DataVector* err = new G4DataVector(); 668 G4DataVector* err = new G4DataVector();
773 669
774 for (std::size_t i=0;i<NUNIF-1;++i) //build << 670 for (size_t i=0;i<NUNIF-1;i++) //build all points but the last
775 { << 671 {
776 //Temporary vectors for this loop 672 //Temporary vectors for this loop
777 G4DataVector* pdfi = new G4DataVector(); 673 G4DataVector* pdfi = new G4DataVector();
778 G4DataVector* pdfih = new G4DataVector() 674 G4DataVector* pdfih = new G4DataVector();
779 G4DataVector* sumi = new G4DataVector(); 675 G4DataVector* sumi = new G4DataVector();
780 676
781 G4double dxi = ((*x)[i+1]-(*x)[i])/(G4do 677 G4double dxi = ((*x)[i+1]-(*x)[i])/(G4double (nip-1));
782 G4double pdfmax = 0; 678 G4double pdfmax = 0;
783 for (G4int k=0;k<nip;k++) 679 for (G4int k=0;k<nip;k++)
784 { 680 {
785 G4double xik = (*x)[i]+k*dxi; << 681 G4double xik = (*x)[i]+k*dxi;
786 G4double pdfk = std::max(GetFSquared(mat,x 682 G4double pdfk = std::max(GetFSquared(mat,xik),0.);
787 pdfi->push_back(pdfk); 683 pdfi->push_back(pdfk);
788 pdfmax = std::max(pdfmax,pdfk); << 684 pdfmax = std::max(pdfmax,pdfk);
789 if (k < (nip-1)) 685 if (k < (nip-1))
790 { 686 {
791 G4double xih = xik + 0.5*dxi; 687 G4double xih = xik + 0.5*dxi;
792 G4double pdfIK = std::max(GetFSquared( 688 G4double pdfIK = std::max(GetFSquared(mat,xih),0.);
793 pdfih->push_back(pdfIK); 689 pdfih->push_back(pdfIK);
794 pdfmax = std::max(pdfmax,pdfIK); 690 pdfmax = std::max(pdfmax,pdfIK);
795 } 691 }
796 } 692 }
797 << 693
798 //Simpson's integration 694 //Simpson's integration
799 G4double cons = dxi*0.5*(1./3.); 695 G4double cons = dxi*0.5*(1./3.);
800 sumi->push_back(0.); 696 sumi->push_back(0.);
801 for (G4int k=1;k<nip;k++) 697 for (G4int k=1;k<nip;k++)
802 { 698 {
803 G4double previous = (*sumi)[k-1]; 699 G4double previous = (*sumi)[k-1];
804 G4double next = previous + cons*((*pdfi)[k 700 G4double next = previous + cons*((*pdfi)[k-1]+4.0*(*pdfih)[k-1]+(*pdfi)[k]);
805 sumi->push_back(next); 701 sumi->push_back(next);
806 } 702 }
807 << 703
808 G4double lastIntegral = (*sumi)[sumi->si 704 G4double lastIntegral = (*sumi)[sumi->size()-1];
809 area->push_back(lastIntegral); 705 area->push_back(lastIntegral);
810 //Normalize cumulative function 706 //Normalize cumulative function
811 G4double factor = 1.0/lastIntegral; 707 G4double factor = 1.0/lastIntegral;
812 for (std::size_t k=0;k<sumi->size();++k) << 708 for (size_t k=0;k<sumi->size();k++)
813 (*sumi)[k] *= factor; 709 (*sumi)[k] *= factor;
814 << 710
815 //When the PDF vanishes at one of the in 711 //When the PDF vanishes at one of the interval end points, its value is modified
816 if ((*pdfi)[0] < 1e-35) << 712 if ((*pdfi)[0] < 1e-35)
817 (*pdfi)[0] = 1e-5*pdfmax; 713 (*pdfi)[0] = 1e-5*pdfmax;
818 if ((*pdfi)[pdfi->size()-1] < 1e-35) 714 if ((*pdfi)[pdfi->size()-1] < 1e-35)
819 (*pdfi)[pdfi->size()-1] = 1e-5*pdfmax; 715 (*pdfi)[pdfi->size()-1] = 1e-5*pdfmax;
820 716
821 G4double pli = (*pdfi)[0]*factor; 717 G4double pli = (*pdfi)[0]*factor;
822 G4double pui = (*pdfi)[pdfi->size()-1]*f 718 G4double pui = (*pdfi)[pdfi->size()-1]*factor;
823 G4double B_temp = 1.0-1.0/(pli*pui*dx*dx 719 G4double B_temp = 1.0-1.0/(pli*pui*dx*dx);
824 G4double A_temp = (1.0/(pli*dx))-1.0-B_t 720 G4double A_temp = (1.0/(pli*dx))-1.0-B_temp;
825 G4double C_temp = 1.0+A_temp+B_temp; 721 G4double C_temp = 1.0+A_temp+B_temp;
826 if (C_temp < 1e-35) 722 if (C_temp < 1e-35)
827 { 723 {
828 a->push_back(0.); 724 a->push_back(0.);
829 b->push_back(0.); 725 b->push_back(0.);
830 c->push_back(1.); << 726 c->push_back(1.);
831 } 727 }
832 else 728 else
833 { 729 {
834 a->push_back(A_temp); 730 a->push_back(A_temp);
835 b->push_back(B_temp); 731 b->push_back(B_temp);
836 c->push_back(C_temp); 732 c->push_back(C_temp);
837 } 733 }
838 734
839 //OK, now get ERR(I), the integral of th << 735 //OK, now get ERR(I), the integral of the absolute difference between the rational interpolation
840 //and the true pdf, extended over the in 736 //and the true pdf, extended over the interval (X(I),X(I+1))
841 G4int icase = 1; //loop code 737 G4int icase = 1; //loop code
842 G4bool reLoop = false; 738 G4bool reLoop = false;
843 err->push_back(0.); 739 err->push_back(0.);
844 do 740 do
845 { 741 {
846 reLoop = false; 742 reLoop = false;
847 (*err)[i] = 0.; //zero variable 743 (*err)[i] = 0.; //zero variable
848 for (G4int k=0;k<nip;k++) 744 for (G4int k=0;k<nip;k++)
849 { 745 {
850 G4double rr = (*sumi)[k]; 746 G4double rr = (*sumi)[k];
851 G4double pap = (*area)[i]*(1.0+((*a)[i 747 G4double pap = (*area)[i]*(1.0+((*a)[i]+(*b)[i]*rr)*rr)*(1.0+((*a)[i]+(*b)[i]*rr)*rr)/
852 ((1.0-(*b)[i]*rr*rr)*(*c)[i]*((*x)[i+1]-(* 748 ((1.0-(*b)[i]*rr*rr)*(*c)[i]*((*x)[i+1]-(*x)[i]));
853 if (k == 0 || k == nip-1) 749 if (k == 0 || k == nip-1)
854 (*err)[i] += 0.5*std::fabs(pap-(*pdfi)[k]) 750 (*err)[i] += 0.5*std::fabs(pap-(*pdfi)[k]);
855 else 751 else
856 (*err)[i] += std::fabs(pap-(*pdfi)[k]); 752 (*err)[i] += std::fabs(pap-(*pdfi)[k]);
857 } 753 }
858 (*err)[i] *= dxi; 754 (*err)[i] *= dxi;
859 << 755
860 //If err(I) is too large, the pdf is appro 756 //If err(I) is too large, the pdf is approximated by a uniform distribution
861 if ((*err)[i] > 0.1*(*area)[i] && icase == << 757 if ((*err)[i] > 0.1*(*area)[i] && icase == 1)
862 { 758 {
863 (*b)[i] = 0; 759 (*b)[i] = 0;
864 (*a)[i] = 0; 760 (*a)[i] = 0;
865 (*c)[i] = 1.; 761 (*c)[i] = 1.;
866 icase = 2; 762 icase = 2;
867 reLoop = true; 763 reLoop = true;
868 } 764 }
869 }while(reLoop); 765 }while(reLoop);
>> 766
870 delete pdfi; 767 delete pdfi;
871 delete pdfih; 768 delete pdfih;
872 delete sumi; 769 delete sumi;
873 } //end of first loop over i 770 } //end of first loop over i
874 771
875 //Now assign last point 772 //Now assign last point
876 (*x)[x->size()-1] = q2max; 773 (*x)[x->size()-1] = q2max;
877 a->push_back(0.); 774 a->push_back(0.);
878 b->push_back(0.); 775 b->push_back(0.);
879 c->push_back(0.); 776 c->push_back(0.);
880 err->push_back(0.); 777 err->push_back(0.);
881 area->push_back(0.); 778 area->push_back(0.);
882 779
883 if (x->size() != NUNIF || a->size() != NUNIF << 780 if (x->size() != NUNIF || a->size() != NUNIF ||
884 err->size() != NUNIF || area->size() != 781 err->size() != NUNIF || area->size() != NUNIF)
885 { 782 {
886 G4ExceptionDescription ed; 783 G4ExceptionDescription ed;
887 ed << "Problem in building the Table for 784 ed << "Problem in building the Table for Sampling: array dimensions do not match" << G4endl;
888 G4Exception("G4PenelopeRayleighModel::In 785 G4Exception("G4PenelopeRayleighModel::InitializeSamplingAlgorithm()",
889 "em2049",FatalException,ed); 786 "em2049",FatalException,ed);
890 } 787 }
891 << 788
892 /******************************************* 789 /*******************************************************************************
893 New grid points are added by halving the su 790 New grid points are added by halving the sub-intervals with the largest absolute error
894 This is done up to np=150 points in the grid 791 This is done up to np=150 points in the grid
895 ******************************************** 792 ********************************************************************************/
896 do 793 do
897 { 794 {
898 G4double maxError = 0.0; 795 G4double maxError = 0.0;
899 std::size_t iErrMax = 0; << 796 size_t iErrMax = 0;
900 for (std::size_t i=0;i<err->size()-2;++i << 797 for (size_t i=0;i<err->size()-2;i++)
901 { 798 {
902 //maxError is the lagest of the interval e 799 //maxError is the lagest of the interval errors err[i]
903 if ((*err)[i] > maxError) 800 if ((*err)[i] > maxError)
904 { 801 {
905 maxError = (*err)[i]; 802 maxError = (*err)[i];
906 iErrMax = i; 803 iErrMax = i;
907 } 804 }
908 } 805 }
909 << 806
910 //OK, now I have to insert one new point 807 //OK, now I have to insert one new point in the position iErrMax
911 G4double newx = 0.5*((*x)[iErrMax]+(*x)[ 808 G4double newx = 0.5*((*x)[iErrMax]+(*x)[iErrMax+1]);
912 << 809
913 x->insert(x->begin()+iErrMax+1,newx); 810 x->insert(x->begin()+iErrMax+1,newx);
914 //Add place-holders in the other vectors 811 //Add place-holders in the other vectors
915 area->insert(area->begin()+iErrMax+1,0.) 812 area->insert(area->begin()+iErrMax+1,0.);
916 a->insert(a->begin()+iErrMax+1,0.); 813 a->insert(a->begin()+iErrMax+1,0.);
917 b->insert(b->begin()+iErrMax+1,0.); 814 b->insert(b->begin()+iErrMax+1,0.);
918 c->insert(c->begin()+iErrMax+1,0.); 815 c->insert(c->begin()+iErrMax+1,0.);
919 err->insert(err->begin()+iErrMax+1,0.); 816 err->insert(err->begin()+iErrMax+1,0.);
920 << 817
921 //Now calculate the other parameters 818 //Now calculate the other parameters
922 for (std::size_t i=iErrMax;i<=iErrMax+1; << 819 for (size_t i=iErrMax;i<=iErrMax+1;i++)
923 { 820 {
924 //Temporary vectors for this loop 821 //Temporary vectors for this loop
925 G4DataVector* pdfi = new G4DataVector(); 822 G4DataVector* pdfi = new G4DataVector();
926 G4DataVector* pdfih = new G4DataVector(); 823 G4DataVector* pdfih = new G4DataVector();
927 G4DataVector* sumi = new G4DataVector(); 824 G4DataVector* sumi = new G4DataVector();
928 << 825
929 G4double dxLocal = (*x)[i+1]-(*x)[i]; << 826 G4double dx = (*x)[i+1]-(*x)[i];
930 G4double dxi = ((*x)[i+1]-(*x)[i])/(G4doub 827 G4double dxi = ((*x)[i+1]-(*x)[i])/(G4double (nip-1));
931 G4double pdfmax = 0; 828 G4double pdfmax = 0;
932 for (G4int k=0;k<nip;k++) 829 for (G4int k=0;k<nip;k++)
933 { 830 {
934 G4double xik = (*x)[i]+k*dxi; 831 G4double xik = (*x)[i]+k*dxi;
935 G4double pdfk = std::max(GetFSquared(m 832 G4double pdfk = std::max(GetFSquared(mat,xik),0.);
936 pdfi->push_back(pdfk); 833 pdfi->push_back(pdfk);
937 pdfmax = std::max(pdfmax,pdfk); << 834 pdfmax = std::max(pdfmax,pdfk);
938 if (k < (nip-1)) 835 if (k < (nip-1))
939 { 836 {
940 G4double xih = xik + 0.5*dxi; 837 G4double xih = xik + 0.5*dxi;
941 G4double pdfIK = std::max(GetFSquared(ma 838 G4double pdfIK = std::max(GetFSquared(mat,xih),0.);
942 pdfih->push_back(pdfIK); 839 pdfih->push_back(pdfIK);
943 pdfmax = std::max(pdfmax,pdfIK); 840 pdfmax = std::max(pdfmax,pdfIK);
944 } 841 }
945 } 842 }
946 << 843
947 //Simpson's integration 844 //Simpson's integration
948 G4double cons = dxi*0.5*(1./3.); 845 G4double cons = dxi*0.5*(1./3.);
949 sumi->push_back(0.); 846 sumi->push_back(0.);
950 for (G4int k=1;k<nip;k++) 847 for (G4int k=1;k<nip;k++)
951 { 848 {
952 G4double previous = (*sumi)[k-1]; 849 G4double previous = (*sumi)[k-1];
953 G4double next = previous + cons*((*pdf 850 G4double next = previous + cons*((*pdfi)[k-1]+4.0*(*pdfih)[k-1]+(*pdfi)[k]);
954 sumi->push_back(next); 851 sumi->push_back(next);
955 } 852 }
956 G4double lastIntegral = (*sumi)[sumi->size 853 G4double lastIntegral = (*sumi)[sumi->size()-1];
957 (*area)[i] = lastIntegral; 854 (*area)[i] = lastIntegral;
958 << 855
959 //Normalize cumulative function 856 //Normalize cumulative function
960 G4double factor = 1.0/lastIntegral; 857 G4double factor = 1.0/lastIntegral;
961 for (std::size_t k=0;k<sumi->size();++k) << 858 for (size_t k=0;k<sumi->size();k++)
962 (*sumi)[k] *= factor; 859 (*sumi)[k] *= factor;
963 << 860
964 //When the PDF vanishes at one of the inte 861 //When the PDF vanishes at one of the interval end points, its value is modified
965 if ((*pdfi)[0] < 1e-35) << 862 if ((*pdfi)[0] < 1e-35)
966 (*pdfi)[0] = 1e-5*pdfmax; 863 (*pdfi)[0] = 1e-5*pdfmax;
967 if ((*pdfi)[pdfi->size()-1] < 1e-35) 864 if ((*pdfi)[pdfi->size()-1] < 1e-35)
968 (*pdfi)[pdfi->size()-1] = 1e-5*pdfmax; 865 (*pdfi)[pdfi->size()-1] = 1e-5*pdfmax;
969 << 866
970 G4double pli = (*pdfi)[0]*factor; 867 G4double pli = (*pdfi)[0]*factor;
971 G4double pui = (*pdfi)[pdfi->size()-1]*fac 868 G4double pui = (*pdfi)[pdfi->size()-1]*factor;
972 G4double B_temp = 1.0-1.0/(pli*pui*dxLocal << 869 G4double B_temp = 1.0-1.0/(pli*pui*dx*dx);
973 G4double A_temp = (1.0/(pli*dxLocal))-1.0- << 870 G4double A_temp = (1.0/(pli*dx))-1.0-B_temp;
974 G4double C_temp = 1.0+A_temp+B_temp; 871 G4double C_temp = 1.0+A_temp+B_temp;
975 if (C_temp < 1e-35) 872 if (C_temp < 1e-35)
976 { 873 {
977 (*a)[i]= 0.; 874 (*a)[i]= 0.;
978 (*b)[i] = 0.; 875 (*b)[i] = 0.;
979 (*c)[i] = 1; 876 (*c)[i] = 1;
980 } 877 }
981 else 878 else
982 { 879 {
983 (*a)[i]= A_temp; 880 (*a)[i]= A_temp;
984 (*b)[i] = B_temp; 881 (*b)[i] = B_temp;
985 (*c)[i] = C_temp; 882 (*c)[i] = C_temp;
986 } 883 }
987 //OK, now get ERR(I), the integral of the << 884 //OK, now get ERR(I), the integral of the absolute difference between the rational interpolation
988 //and the true pdf, extended over the inte 885 //and the true pdf, extended over the interval (X(I),X(I+1))
989 G4int icase = 1; //loop code 886 G4int icase = 1; //loop code
990 G4bool reLoop = false; 887 G4bool reLoop = false;
991 do 888 do
992 { 889 {
993 reLoop = false; 890 reLoop = false;
994 (*err)[i] = 0.; //zero variable 891 (*err)[i] = 0.; //zero variable
995 for (G4int k=0;k<nip;k++) 892 for (G4int k=0;k<nip;k++)
996 { 893 {
997 G4double rr = (*sumi)[k]; << 894 G4double rr = (*sumi)[k];
998 G4double pap = (*area)[i]*(1.0+((*a)[i]+ 895 G4double pap = (*area)[i]*(1.0+((*a)[i]+(*b)[i]*rr)*rr)*(1.0+((*a)[i]+(*b)[i]*rr)*rr)/
999 ((1.0-(*b)[i]*rr*rr)*(*c)[i]*((*x)[i+1 896 ((1.0-(*b)[i]*rr*rr)*(*c)[i]*((*x)[i+1]-(*x)[i]));
1000 if (k == 0 || k == nip-1) 897 if (k == 0 || k == nip-1)
1001 (*err)[i] += 0.5*std::fabs(pap-(*pdfi 898 (*err)[i] += 0.5*std::fabs(pap-(*pdfi)[k]);
1002 else 899 else
1003 (*err)[i] += std::fabs(pap-(*pdfi)[k] 900 (*err)[i] += std::fabs(pap-(*pdfi)[k]);
1004 } 901 }
1005 (*err)[i] *= dxi; 902 (*err)[i] *= dxi;
1006 << 903
1007 //If err(I) is too large, the pdf is 904 //If err(I) is too large, the pdf is approximated by a uniform distribution
1008 if ((*err)[i] > 0.1*(*area)[i] && ica << 905 if ((*err)[i] > 0.1*(*area)[i] && icase == 1)
1009 { 906 {
1010 (*b)[i] = 0; 907 (*b)[i] = 0;
1011 (*a)[i] = 0; 908 (*a)[i] = 0;
1012 (*c)[i] = 1.; 909 (*c)[i] = 1.;
1013 icase = 2; 910 icase = 2;
1014 reLoop = true; 911 reLoop = true;
1015 } 912 }
1016 }while(reLoop); 913 }while(reLoop);
1017 delete pdfi; 914 delete pdfi;
1018 delete pdfih; 915 delete pdfih;
1019 delete sumi; 916 delete sumi;
1020 } 917 }
1021 }while(x->size() < np); 918 }while(x->size() < np);
1022 919
1023 if (x->size() != np || a->size() != np || << 920 if (x->size() != np || a->size() != np ||
1024 err->size() != np || area->size() != np 921 err->size() != np || area->size() != np)
1025 { 922 {
1026 G4Exception("G4PenelopeRayleighModel::I 923 G4Exception("G4PenelopeRayleighModel::InitializeSamplingAlgorithm()",
1027 "em2050",FatalException, 924 "em2050",FatalException,
1028 "Problem in building the extended Table 925 "Problem in building the extended Table for Sampling: array dimensions do not match ");
1029 } 926 }
1030 927
1031 /****************************************** 928 /*******************************************************************************
1032 Renormalization 929 Renormalization
1033 ******************************************* 930 ********************************************************************************/
1034 G4double ws = 0; 931 G4double ws = 0;
1035 for (std::size_t i=0;i<np-1;++i) << 932 for (size_t i=0;i<np-1;i++)
1036 ws += (*area)[i]; 933 ws += (*area)[i];
1037 ws = 1.0/ws; 934 ws = 1.0/ws;
1038 G4double errMax = 0; 935 G4double errMax = 0;
1039 for (std::size_t i=0;i<np-1;++i) << 936 for (size_t i=0;i<np-1;i++)
1040 { 937 {
1041 (*area)[i] *= ws; 938 (*area)[i] *= ws;
1042 (*err)[i] *= ws; 939 (*err)[i] *= ws;
1043 errMax = std::max(errMax,(*err)[i]); 940 errMax = std::max(errMax,(*err)[i]);
1044 } 941 }
1045 942
1046 //Vector with the normalized cumulative dis 943 //Vector with the normalized cumulative distribution
1047 G4DataVector* PAC = new G4DataVector(); 944 G4DataVector* PAC = new G4DataVector();
1048 PAC->push_back(0.); 945 PAC->push_back(0.);
1049 for (std::size_t i=0;i<np-1;++i) << 946 for (size_t i=0;i<np-1;i++)
1050 { 947 {
1051 G4double previous = (*PAC)[i]; 948 G4double previous = (*PAC)[i];
1052 PAC->push_back(previous+(*area)[i]); 949 PAC->push_back(previous+(*area)[i]);
1053 } 950 }
1054 (*PAC)[PAC->size()-1] = 1.; 951 (*PAC)[PAC->size()-1] = 1.;
1055 << 952
1056 /****************************************** 953 /*******************************************************************************
1057 Pre-calculated limits for the initial binar 954 Pre-calculated limits for the initial binary search for subsequent sampling
1058 ******************************************* 955 ********************************************************************************/
1059 std::vector<std::size_t> *ITTL = new std::v << 956
1060 std::vector<std::size_t> *ITTU = new std::v << 957 //G4DataVector* ITTL = new G4DataVector();
>> 958 std::vector<size_t> *ITTL = new std::vector<size_t>;
>> 959 std::vector<size_t> *ITTU = new std::vector<size_t>;
1061 960
1062 //Just create place-holders 961 //Just create place-holders
1063 for (std::size_t i=0;i<np;++i) << 962 for (size_t i=0;i<np;i++)
1064 { 963 {
1065 ITTL->push_back(0); 964 ITTL->push_back(0);
1066 ITTU->push_back(0); 965 ITTU->push_back(0);
1067 } 966 }
1068 967
1069 G4double bin = 1.0/(np-1); 968 G4double bin = 1.0/(np-1);
1070 (*ITTL)[0]=0; 969 (*ITTL)[0]=0;
1071 for (std::size_t i=1;i<(np-1);++i) << 970 for (size_t i=1;i<(np-1);i++)
1072 { 971 {
1073 G4double ptst = i*bin; << 972 G4double ptst = i*bin;
1074 G4bool found = false; 973 G4bool found = false;
1075 for (std::size_t j=(*ITTL)[i-1];j<np && << 974 for (size_t j=(*ITTL)[i-1];j<np && !found;j++)
1076 { 975 {
1077 if ((*PAC)[j] > ptst) 976 if ((*PAC)[j] > ptst)
1078 { 977 {
1079 (*ITTL)[i] = j-1; 978 (*ITTL)[i] = j-1;
1080 (*ITTU)[i-1] = j; 979 (*ITTU)[i-1] = j;
1081 found = true; 980 found = true;
1082 } 981 }
1083 } 982 }
1084 } 983 }
1085 (*ITTU)[ITTU->size()-2] = ITTU->size()-1; 984 (*ITTU)[ITTU->size()-2] = ITTU->size()-1;
1086 (*ITTU)[ITTU->size()-1] = ITTU->size()-1; 985 (*ITTU)[ITTU->size()-1] = ITTU->size()-1;
1087 (*ITTL)[ITTL->size()-1] = ITTU->size()-2; 986 (*ITTL)[ITTL->size()-1] = ITTU->size()-2;
1088 987
1089 if (ITTU->size() != np || ITTU->size() != n 988 if (ITTU->size() != np || ITTU->size() != np)
1090 { 989 {
1091 G4Exception("G4PenelopeRayleighModel::I 990 G4Exception("G4PenelopeRayleighModel::InitializeSamplingAlgorithm()",
1092 "em2051",FatalException, 991 "em2051",FatalException,
1093 "Problem in building the Limit Tables f 992 "Problem in building the Limit Tables for Sampling: array dimensions do not match");
1094 } 993 }
1095 994
>> 995
1096 /****************************************** 996 /********************************************************************************
1097 Copy tables 997 Copy tables
1098 ******************************************* 998 ********************************************************************************/
1099 G4PenelopeSamplingData* theTable = new G4Pe 999 G4PenelopeSamplingData* theTable = new G4PenelopeSamplingData(np);
1100 for (std::size_t i=0;i<np;++i) << 1000 for (size_t i=0;i<np;i++)
1101 { 1001 {
1102 theTable->AddPoint((*x)[i],(*PAC)[i],(* 1002 theTable->AddPoint((*x)[i],(*PAC)[i],(*a)[i],(*b)[i],(*ITTL)[i],(*ITTU)[i]);
1103 } 1003 }
1104 1004
1105 if (fVerboseLevel > 2) << 1005 if (verboseLevel > 2)
1106 { 1006 {
1107 G4cout << "**************************** << 1007 G4cout << "*************************************************************************" <<
1108 G4endl; 1008 G4endl;
1109 G4cout << "Sampling table for Penelope 1009 G4cout << "Sampling table for Penelope Rayleigh scattering in " << mat->GetName() << G4endl;
1110 theTable->DumpTable(); 1010 theTable->DumpTable();
1111 } << 1011 }
1112 fSamplingTable->insert(std::make_pair(mat,t << 1012 samplingTable->insert(std::make_pair(mat,theTable));
1113 1013
>> 1014
1114 //Clean up temporary vectors 1015 //Clean up temporary vectors
1115 delete x; 1016 delete x;
1116 delete a; 1017 delete a;
1117 delete b; 1018 delete b;
1118 delete c; 1019 delete c;
1119 delete err; 1020 delete err;
1120 delete area; 1021 delete area;
1121 delete PAC; 1022 delete PAC;
1122 delete ITTL; 1023 delete ITTL;
1123 delete ITTU; 1024 delete ITTU;
1124 1025
1125 //DONE! 1026 //DONE!
1126 return; 1027 return;
>> 1028
1127 } 1029 }
1128 1030
1129 //....oooOO0OOooo........oooOO0OOooo........o 1031 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
1130 1032
1131 void G4PenelopeRayleighModel::GetPMaxTable(co 1033 void G4PenelopeRayleighModel::GetPMaxTable(const G4Material* mat)
1132 { 1034 {
1133 if (!fPMaxTable) << 1035 if (!pMaxTable)
1134 { 1036 {
1135 G4cout << "G4PenelopeRayleighModel::Bui 1037 G4cout << "G4PenelopeRayleighModel::BuildPMaxTable" << G4endl;
1136 G4cout << "Going to instanziate the fPM << 1038 G4cout << "Going to instanziate the pMaxTable !" << G4endl;
1137 G4cout << "That should _not_ be here! " 1039 G4cout << "That should _not_ be here! " << G4endl;
1138 fPMaxTable = new std::map<const G4Mater << 1040 pMaxTable = new std::map<const G4Material*,G4PhysicsFreeVector*>;
1139 } 1041 }
1140 //check if the table is already there 1042 //check if the table is already there
1141 if (fPMaxTable->count(mat)) << 1043 if (pMaxTable->count(mat))
1142 return; 1044 return;
1143 1045
1144 //otherwise build it 1046 //otherwise build it
1145 if (!fSamplingTable) << 1047 if (!samplingTable)
1146 { 1048 {
1147 G4Exception("G4PenelopeRayleighModel::G 1049 G4Exception("G4PenelopeRayleighModel::GetPMaxTable()",
1148 "em2052",FatalException, 1050 "em2052",FatalException,
1149 "SamplingTable is not properly instanti 1051 "SamplingTable is not properly instantiated");
1150 return; 1052 return;
1151 } 1053 }
1152 1054
1153 //This should not be: the sampling table is << 1055 if (!samplingTable->count(mat))
1154 if (!fSamplingTable->count(mat)) << 1056 InitializeSamplingAlgorithm(mat);
1155 { << 1057
1156 G4ExceptionDescription ed; << 1058 G4PenelopeSamplingData *theTable = samplingTable->find(mat)->second;
1157 ed << "Sampling table for material " < << 1059 size_t tablePoints = theTable->GetNumberOfStoredPoints();
1158 G4Exception("G4PenelopeRayleighModel:: <<
1159 "em2052",FatalException, <<
1160 ed); <<
1161 return; <<
1162 } <<
1163 1060
1164 G4PenelopeSamplingData *theTable = fSamplin << 1061 size_t nOfEnergyPoints = logEnergyGridPMax.size();
1165 std::size_t tablePoints = theTable->GetNumb <<
1166 <<
1167 std::size_t nOfEnergyPoints = fLogEnergyGri <<
1168 G4PhysicsFreeVector* theVec = new G4Physics 1062 G4PhysicsFreeVector* theVec = new G4PhysicsFreeVector(nOfEnergyPoints);
1169 1063
1170 const std::size_t nip = 51; //hard-coded in << 1064 const size_t nip = 51; //hard-coded in Penelope
1171 1065
1172 for (std::size_t ie=0;ie<fLogEnergyGridPMax << 1066 for (size_t ie=0;ie<logEnergyGridPMax.size();ie++)
1173 { 1067 {
1174 G4double energy = G4Exp(fLogEnergyGridP << 1068 G4double energy = std::exp(logEnergyGridPMax[ie]);
1175 G4double Qm = 2.0*energy/electron_mass_ 1069 G4double Qm = 2.0*energy/electron_mass_c2; //this is non-dimensional now
1176 G4double Qm2 = Qm*Qm; 1070 G4double Qm2 = Qm*Qm;
1177 G4double firstQ2 = theTable->GetX(0); 1071 G4double firstQ2 = theTable->GetX(0);
1178 G4double lastQ2 = theTable->GetX(tableP 1072 G4double lastQ2 = theTable->GetX(tablePoints-1);
1179 G4double thePMax = 0; 1073 G4double thePMax = 0;
1180 << 1074
1181 if (Qm2 > firstQ2) 1075 if (Qm2 > firstQ2)
1182 { 1076 {
1183 if (Qm2 < lastQ2) 1077 if (Qm2 < lastQ2)
1184 { 1078 {
1185 //bisection to look for the index of 1079 //bisection to look for the index of Qm
1186 std::size_t lowerBound = 0; << 1080 size_t lowerBound = 0;
1187 std::size_t upperBound = tablePoints- << 1081 size_t upperBound = tablePoints-1;
1188 while (lowerBound <= upperBound) 1082 while (lowerBound <= upperBound)
1189 { 1083 {
1190 std::size_t midBin = (lowerBound + uppe << 1084 size_t midBin = (lowerBound + upperBound)/2;
1191 if( Qm2 < theTable->GetX(midBin)) 1085 if( Qm2 < theTable->GetX(midBin))
1192 { upperBound = midBin-1; } 1086 { upperBound = midBin-1; }
1193 else 1087 else
1194 { lowerBound = midBin+1; } 1088 { lowerBound = midBin+1; }
1195 } 1089 }
1196 //upperBound is the output (but also 1090 //upperBound is the output (but also lowerBounf --> should be the same!)
1197 G4double Q1 = theTable->GetX(upperBou 1091 G4double Q1 = theTable->GetX(upperBound);
1198 G4double Q2 = Qm2; 1092 G4double Q2 = Qm2;
1199 G4double DQ = (Q2-Q1)/((G4double)(nip 1093 G4double DQ = (Q2-Q1)/((G4double)(nip-1));
1200 G4double theA = theTable->GetA(upperB 1094 G4double theA = theTable->GetA(upperBound);
1201 G4double theB = theTable->GetB(upperB 1095 G4double theB = theTable->GetB(upperBound);
1202 G4double thePAC = theTable->GetPAC(up 1096 G4double thePAC = theTable->GetPAC(upperBound);
1203 G4DataVector* fun = new G4DataVector( 1097 G4DataVector* fun = new G4DataVector();
1204 for (std::size_t k=0;k<nip;++k) << 1098 for (size_t k=0;k<nip;k++)
1205 { 1099 {
1206 G4double qi = Q1 + k*DQ; 1100 G4double qi = Q1 + k*DQ;
1207 G4double tau = (qi-Q1)/ 1101 G4double tau = (qi-Q1)/
1208 (theTable->GetX(upperBound+1)-Q1); 1102 (theTable->GetX(upperBound+1)-Q1);
1209 G4double con1 = 2.0*theB*tau; << 1103 G4double con1 = 2.0*theB*tau;
1210 G4double ci = 1.0+theA+theB; 1104 G4double ci = 1.0+theA+theB;
1211 G4double con2 = ci-theA*tau; 1105 G4double con2 = ci-theA*tau;
1212 G4double etap = 0; 1106 G4double etap = 0;
1213 if (std::fabs(con1) > 1.0e-16*std::fabs 1107 if (std::fabs(con1) > 1.0e-16*std::fabs(con2))
1214 etap = con2*(1.0-std::sqrt(1.0-2.0*ta 1108 etap = con2*(1.0-std::sqrt(1.0-2.0*tau*con1/(con2*con2)))/con1;
1215 else 1109 else
1216 etap = tau/con2; 1110 etap = tau/con2;
1217 G4double theFun = (theTable->GetPAC(upp 1111 G4double theFun = (theTable->GetPAC(upperBound+1)-thePAC)*
1218 (1.0+(theA+theB*etap)*etap)*(1.0+(the 1112 (1.0+(theA+theB*etap)*etap)*(1.0+(theA+theB*etap)*etap)/
1219 ((1.0-theB*etap*etap)*ci*(theTable->G 1113 ((1.0-theB*etap*etap)*ci*(theTable->GetX(upperBound+1)-Q1));
1220 fun->push_back(theFun); 1114 fun->push_back(theFun);
1221 } 1115 }
1222 //Now intergrate numerically the fun 1116 //Now intergrate numerically the fun Cavalieri-Simpson's method
1223 G4DataVector* sum = new G4DataVector; 1117 G4DataVector* sum = new G4DataVector;
1224 G4double CONS = DQ*(1./12.); 1118 G4double CONS = DQ*(1./12.);
1225 G4double HCONS = 0.5*CONS; 1119 G4double HCONS = 0.5*CONS;
1226 sum->push_back(0.); 1120 sum->push_back(0.);
1227 G4double secondPoint = (*sum)[0] + << 1121 G4double secondPoint = (*sum)[0] +
1228 (5.0*(*fun)[0]+8.0*(*fun)[1]-(*fun)[2])*C 1122 (5.0*(*fun)[0]+8.0*(*fun)[1]-(*fun)[2])*CONS;
1229 sum->push_back(secondPoint); 1123 sum->push_back(secondPoint);
1230 for (std::size_t hh=2;hh<nip-1;++hh) << 1124 for (size_t hh=2;hh<nip-1;hh++)
1231 { 1125 {
1232 G4double previous = (*sum)[hh-1]; 1126 G4double previous = (*sum)[hh-1];
1233 G4double next = previous+(13.0*((*fun)[ 1127 G4double next = previous+(13.0*((*fun)[hh-1]+(*fun)[hh])-
1234 (*fun)[hh+1]-(*fun)[hh-2])*HCON 1128 (*fun)[hh+1]-(*fun)[hh-2])*HCONS;
1235 sum->push_back(next); 1129 sum->push_back(next);
1236 } 1130 }
1237 G4double last = (*sum)[nip-2]+(5.0*(* 1131 G4double last = (*sum)[nip-2]+(5.0*(*fun)[nip-1]+8.0*(*fun)[nip-2]-
1238 (*fun)[nip-3])*CONS; 1132 (*fun)[nip-3])*CONS;
1239 sum->push_back(last); << 1133 sum->push_back(last);
1240 thePMax = thePAC + (*sum)[sum->size() 1134 thePMax = thePAC + (*sum)[sum->size()-1]; //last point
1241 delete fun; 1135 delete fun;
1242 delete sum; 1136 delete sum;
1243 } 1137 }
1244 else 1138 else
1245 { 1139 {
1246 thePMax = 1.0; 1140 thePMax = 1.0;
1247 } << 1141 }
1248 } 1142 }
1249 else 1143 else
1250 { 1144 {
1251 thePMax = theTable->GetPAC(0); 1145 thePMax = theTable->GetPAC(0);
1252 } 1146 }
1253 1147
1254 //Write number in the table 1148 //Write number in the table
1255 theVec->PutValue(ie,energy,thePMax); 1149 theVec->PutValue(ie,energy,thePMax);
1256 } 1150 }
1257 << 1151
1258 fPMaxTable->insert(std::make_pair(mat,theVe << 1152 pMaxTable->insert(std::make_pair(mat,theVec));
1259 return; 1153 return;
>> 1154
1260 } 1155 }
1261 1156
1262 //....oooOO0OOooo........oooOO0OOooo........o 1157 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo....
1263 1158
1264 void G4PenelopeRayleighModel::DumpFormFactorT 1159 void G4PenelopeRayleighModel::DumpFormFactorTable(const G4Material* mat)
1265 { 1160 {
1266 G4cout << "******************************** 1161 G4cout << "*****************************************************************" << G4endl;
1267 G4cout << "G4PenelopeRayleighModel: Form Fa 1162 G4cout << "G4PenelopeRayleighModel: Form Factor Table for " << mat->GetName() << G4endl;
1268 //try to use the same format as Penelope-Fo 1163 //try to use the same format as Penelope-Fortran, namely Q (/m_e*c) and F
1269 G4cout << "Q/(m_e*c) F(Q) 1164 G4cout << "Q/(m_e*c) F(Q) " << G4endl;
1270 G4cout << "******************************** 1165 G4cout << "*****************************************************************" << G4endl;
1271 if (!fLogFormFactorTable->count(mat)) << 1166 if (!logFormFactorTable->count(mat))
1272 BuildFormFactorTable(mat); 1167 BuildFormFactorTable(mat);
1273 << 1168
1274 G4PhysicsFreeVector* theVec = fLogFormFacto << 1169 G4PhysicsFreeVector* theVec = logFormFactorTable->find(mat)->second;
1275 for (std::size_t i=0;i<theVec->GetVectorLen << 1170 for (size_t i=0;i<theVec->GetVectorLength();i++)
1276 { 1171 {
1277 G4double logQ2 = theVec->GetLowEdgeEner 1172 G4double logQ2 = theVec->GetLowEdgeEnergy(i);
1278 G4double Q = G4Exp(0.5*logQ2); << 1173 G4double Q = std::exp(0.5*logQ2);
1279 G4double logF2 = (*theVec)[i]; 1174 G4double logF2 = (*theVec)[i];
1280 G4double F = G4Exp(0.5*logF2); << 1175 G4double F = std::exp(0.5*logF2);
1281 G4cout << Q << " " << F << 1176 G4cout << Q << " " << F << G4endl;
1282 } 1177 }
1283 //DONE 1178 //DONE
1284 return; 1179 return;
1285 } <<
1286 <<
1287 //....oooOO0OOooo........oooOO0OOooo........o <<
1288 <<
1289 void G4PenelopeRayleighModel::SetParticle(con <<
1290 { <<
1291 if(!fParticle) { <<
1292 fParticle = p; <<
1293 } <<
1294 } 1180 }
1295 1181