Geant4 Cross Reference |
1 // 2 // ******************************************************************** 3 // * License and Disclaimer * 4 // * * 5 // * The Geant4 software is copyright of the Copyright Holders of * 6 // * the Geant4 Collaboration. It is provided under the terms and * 7 // * conditions of the Geant4 Software License, included in the file * 8 // * LICENSE and available at http://cern.ch/geant4/license . These * 9 // * include a list of copyright holders. * 10 // * * 11 // * Neither the authors of this software system, nor their employing * 12 // * institutes,nor the agencies providing financial support for this * 13 // * work make any representation or warranty, express or implied, * 14 // * regarding this software system or assume any liability for its * 15 // * use. Please see the license in the file LICENSE and URL above * 16 // * for the full disclaimer and the limitation of liability. * 17 // * * 18 // * This code implementation is the result of the scientific and * 19 // * technical work of the GEANT4 collaboration. * 20 // * By using, copying, modifying or distributing the software (or * 21 // * any work based on the software) you agree to acknowledge its * 22 // * use in resulting scientific publications, and indicate your * 23 // * acceptance of all terms of the Geant4 Software license. * 24 // ******************************************************************** 25 26 // 26-06-96, Code uses operators (+=, *=, ++, -> etc.) correctly, P. Urban 27 // 10-07-96, new data members added by L.Urban 28 // 12-12-96, new data memberfFreeElecDensitys added by L.Urban 29 // 20-01-97, aesthetic rearrangement. RadLength calculation modified. 30 // Data members Zeff and Aeff REMOVED (i.e. passed to the Elements). 31 // (local definition of Zeff in DensityEffect and FluctModel...) 32 // Vacuum defined as a G4State. Mixture flag removed, M.Maire. 33 // 29-01-97, State=Vacuum automatically set density=0 in the contructors. 34 // Subsequent protections have been put in the calculation of 35 // MeanExcEnergy, ShellCorrectionVector, DensityEffect, M.Maire. 36 // 11-02-97, ComputeDensityEffect() rearranged, M.Maire. 37 // 20-03-97, corrected initialization of pointers, M.Maire. 38 // 28-05-98, the kState=kVacuum has been removed. 39 // automatic check for a minimal density, M.Maire 40 // 12-06-98, new method AddMaterial() allowing mixture of materials, M.Maire 41 // 09-07-98, ionisation parameters removed from the class, M.Maire 42 // 05-10-98, change names: NumDensity -> NbOfAtomsPerVolume 43 // 18-11-98, new interface to SandiaTable 44 // 19-01-99 enlarge tolerance on test of coherence of gas conditions 45 // 19-07-99, Constructors with chemicalFormula added by V.Ivanchenko 46 // 16-01-01, Nuclear interaction length, M.Maire 47 // 12-03-01, G4bool fImplicitElement; 48 // copy constructor and assignement operator revised (mma) 49 // 03-05-01, flux.precision(prec) at begin/end of operator<< 50 // 17-07-01, migration to STL. M. Verderi. 51 // 14-09-01, Suppression of the data member fIndexInTable 52 // 26-02-02, fIndexInTable renewed 53 // 16-04-02, G4Exception put in constructor with chemical formula 54 // 06-05-02, remove the check of the ideal gas state equation 55 // 06-08-02, remove constructors with chemical formula (mma) 56 // 22-01-04, proper STL handling of theElementVector (Hisaya) 57 // 30-03-05, warning in GetMaterial(materialName) 58 // 09-03-06, minor change of printout (V.Ivanchenko) 59 // 10-01-07, compute fAtomVector in the case of mass fraction (V.Ivanchenko) 60 // 27-07-07, improve destructor (V.Ivanchenko) 61 // 18-10-07, moved definition of mat index to InitialisePointers (V.Ivanchenko) 62 // 13-08-08, do not use fixed size arrays (V.Ivanchenko) 63 // 26-10-11, new scheme for G4Exception (mma) 64 // 13-04-12, map<G4Material*,G4double> fMatComponents, filled in AddMaterial() 65 // 21-04-12, fMassOfMolecule, computed for AtomsCount (mma) 66 67 #include "G4Material.hh" 68 69 #include "G4ApplicationState.hh" 70 #include "G4AtomicShells.hh" 71 #include "G4ExtendedMaterial.hh" 72 #include "G4Pow.hh" 73 #include "G4NistManager.hh" 74 #include "G4PhysicalConstants.hh" 75 #include "G4StateManager.hh" 76 #include "G4SystemOfUnits.hh" 77 #include "G4UnitsTable.hh" 78 79 #include <iomanip> 80 81 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 82 83 // Constructor to create a material from scratch 84 85 G4Material::G4Material(const G4String& name, G4double z, G4double a, G4double density, 86 G4State state, G4double temp, G4double pressure) 87 : fName(name) 88 { 89 InitializePointers(); 90 91 if (density < universe_mean_density) { 92 G4cout << " G4Material WARNING:" 93 << " define a material with density=0 is not allowed. \n" 94 << " The material " << name << " will be constructed with the" 95 << " default minimal density: " << universe_mean_density / (g / cm3) << "g/cm3" 96 << G4endl; 97 density = universe_mean_density; 98 } 99 100 fDensity = density; 101 fState = state; 102 fTemp = temp; 103 fPressure = pressure; 104 105 // Initialize theElementVector allocating one 106 // element corresponding to this material 107 fNbComponents = fNumberOfElements = 1; 108 theElementVector = new G4ElementVector(); 109 110 // take element from DB 111 G4NistManager* nist = G4NistManager::Instance(); 112 G4int iz = G4lrint(z); 113 auto elm = nist->FindOrBuildElement(iz); 114 if (elm == nullptr) { 115 elm = new G4Element("ELM_" + name, name, z, a); 116 } 117 theElementVector->push_back(elm); 118 119 fMassFractionVector = new G4double[1]; 120 fMassFractionVector[0] = 1.; 121 fMassOfMolecule = a / CLHEP::Avogadro; 122 123 if (fState == kStateUndefined) { 124 if (fDensity > kGasThreshold) { 125 fState = kStateSolid; 126 } 127 else { 128 fState = kStateGas; 129 } 130 } 131 132 ComputeDerivedQuantities(); 133 } 134 135 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 136 137 // Constructor to create a material from a List of constituents 138 // (elements and/or materials) added with AddElement or AddMaterial 139 140 G4Material::G4Material(const G4String& name, G4double density, G4int nComponents, G4State state, 141 G4double temp, G4double pressure) 142 : fName(name) 143 { 144 InitializePointers(); 145 146 if (density < universe_mean_density) { 147 G4cout << "--- Warning from G4Material::G4Material()" 148 << " define a material with density=0 is not allowed. \n" 149 << " The material " << name << " will be constructed with the" 150 << " default minimal density: " << universe_mean_density / (g / cm3) << "g/cm3" 151 << G4endl; 152 density = universe_mean_density; 153 } 154 155 fDensity = density; 156 fState = state; 157 fTemp = temp; 158 fPressure = pressure; 159 160 fNbComponents = nComponents; 161 fMassFraction = true; 162 163 if (fState == kStateUndefined) { 164 if (fDensity > kGasThreshold) { 165 fState = kStateSolid; 166 } 167 else { 168 fState = kStateGas; 169 } 170 } 171 } 172 173 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 174 175 // Constructor to create a material from base material 176 177 G4Material::G4Material(const G4String& name, G4double density, const G4Material* bmat, 178 G4State state, G4double temp, G4double pressure) 179 : fName(name) 180 { 181 InitializePointers(); 182 183 if (density < universe_mean_density) { 184 G4cout << "--- Warning from G4Material::G4Material()" 185 << " define a material with density=0 is not allowed. \n" 186 << " The material " << name << " will be constructed with the" 187 << " default minimal density: " << universe_mean_density / (g / cm3) << "g/cm3" 188 << G4endl; 189 density = universe_mean_density; 190 } 191 192 fDensity = density; 193 fState = state; 194 fTemp = temp; 195 fPressure = pressure; 196 197 fBaseMaterial = bmat; 198 auto ptr = bmat; 199 if (nullptr != ptr) { 200 while (true) { 201 ptr = ptr->GetBaseMaterial(); 202 if (nullptr == ptr) { 203 break; 204 } 205 fBaseMaterial = ptr; 206 } 207 } 208 209 fChemicalFormula = fBaseMaterial->GetChemicalFormula(); 210 fMassOfMolecule = fBaseMaterial->GetMassOfMolecule(); 211 212 fNumberOfElements = (G4int)fBaseMaterial->GetNumberOfElements(); 213 fNbComponents = fNumberOfElements; 214 215 CopyPointersOfBaseMaterial(); 216 } 217 218 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 219 220 G4Material::~G4Material() 221 { 222 if (fBaseMaterial == nullptr) { 223 delete theElementVector; 224 delete fSandiaTable; 225 delete[] fMassFractionVector; 226 delete[] fAtomsVector; 227 } 228 delete fIonisation; 229 delete[] fVecNbOfAtomsPerVolume; 230 231 // Remove this material from the MaterialTable. 232 // 233 (*GetMaterialTable())[fIndexInTable] = nullptr; 234 } 235 236 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 237 238 void G4Material::InitializePointers() 239 { 240 fBaseMaterial = nullptr; 241 fMaterialPropertiesTable = nullptr; 242 theElementVector = nullptr; 243 fAtomsVector = nullptr; 244 fMassFractionVector = nullptr; 245 fVecNbOfAtomsPerVolume = nullptr; 246 247 fIonisation = nullptr; 248 fSandiaTable = nullptr; 249 250 fDensity = fFreeElecDensity = fTemp = fPressure = 0.0; 251 fTotNbOfAtomsPerVolume = 0.0; 252 fTotNbOfElectPerVolume = 0.0; 253 fRadlen = fNuclInterLen = fMassOfMolecule = 0.0; 254 255 fState = kStateUndefined; 256 fNumberOfElements = fNbComponents = fIdxComponent = 0; 257 fMassFraction = true; 258 fChemicalFormula = ""; 259 260 // Store in the static Table of Materials 261 fIndexInTable = GetMaterialTable()->size(); 262 for (std::size_t i = 0; i < fIndexInTable; ++i) { 263 if ((*GetMaterialTable())[i]->GetName() == fName) { 264 G4cout << "G4Material WARNING: duplicate name of material " << fName << G4endl; 265 break; 266 } 267 } 268 GetMaterialTable()->push_back(this); 269 } 270 271 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 272 273 void G4Material::ComputeDerivedQuantities() 274 { 275 // Header routine to compute various properties of material. 276 // 277 // Number of atoms per volume (per element), total nb of electrons per volume 278 G4double Zi, Ai; 279 fTotNbOfAtomsPerVolume = 0.; 280 delete[] fVecNbOfAtomsPerVolume; 281 fVecNbOfAtomsPerVolume = new G4double[fNumberOfElements]; 282 fTotNbOfElectPerVolume = 0.; 283 fFreeElecDensity = 0.; 284 const G4double elecTh = 15. * CLHEP::eV; // threshold for conductivity e- 285 for (G4int i = 0; i < fNumberOfElements; ++i) { 286 Zi = (*theElementVector)[i]->GetZ(); 287 Ai = (*theElementVector)[i]->GetA(); 288 fVecNbOfAtomsPerVolume[i] = Avogadro * fDensity * fMassFractionVector[i] / Ai; 289 fTotNbOfAtomsPerVolume += fVecNbOfAtomsPerVolume[i]; 290 fTotNbOfElectPerVolume += fVecNbOfAtomsPerVolume[i] * Zi; 291 if (fState != kStateGas) { 292 fFreeElecDensity += 293 fVecNbOfAtomsPerVolume[i] * G4AtomicShells::GetNumberOfFreeElectrons(Zi, elecTh); 294 } 295 } 296 297 ComputeRadiationLength(); 298 ComputeNuclearInterLength(); 299 300 if (fIonisation == nullptr) { 301 fIonisation = new G4IonisParamMat(this); 302 } 303 if (fSandiaTable == nullptr) { 304 fSandiaTable = new G4SandiaTable(this); 305 } 306 } 307 308 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 309 310 void G4Material::CopyPointersOfBaseMaterial() 311 { 312 G4double factor = fDensity / fBaseMaterial->GetDensity(); 313 fTotNbOfAtomsPerVolume = factor * fBaseMaterial->GetTotNbOfAtomsPerVolume(); 314 fTotNbOfElectPerVolume = factor * fBaseMaterial->GetTotNbOfElectPerVolume(); 315 fFreeElecDensity = factor * fBaseMaterial->GetFreeElectronDensity(); 316 317 if (fState == kStateUndefined) { 318 fState = fBaseMaterial->GetState(); 319 } 320 321 theElementVector = const_cast<G4ElementVector*>(fBaseMaterial->GetElementVector()); 322 fMassFractionVector = const_cast<G4double*>(fBaseMaterial->GetFractionVector()); 323 fAtomsVector = const_cast<G4int*>(fBaseMaterial->GetAtomsVector()); 324 325 const G4double* v = fBaseMaterial->GetVecNbOfAtomsPerVolume(); 326 delete[] fVecNbOfAtomsPerVolume; 327 fVecNbOfAtomsPerVolume = new G4double[fNumberOfElements]; 328 for (G4int i = 0; i < fNumberOfElements; ++i) { 329 fVecNbOfAtomsPerVolume[i] = factor * v[i]; 330 } 331 fRadlen = fBaseMaterial->GetRadlen() / factor; 332 fNuclInterLen = fBaseMaterial->GetNuclearInterLength() / factor; 333 334 if (fIonisation == nullptr) { 335 fIonisation = new G4IonisParamMat(this); 336 } 337 fIonisation->SetMeanExcitationEnergy(fBaseMaterial->GetIonisation()->GetMeanExcitationEnergy()); 338 if (fBaseMaterial->GetIonisation()->GetDensityEffectCalculator() != nullptr) { 339 ComputeDensityEffectOnFly(true); 340 } 341 342 fSandiaTable = fBaseMaterial->GetSandiaTable(); 343 fMaterialPropertiesTable = fBaseMaterial->GetMaterialPropertiesTable(); 344 } 345 346 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 347 348 void G4Material::AddElementByNumberOfAtoms(const G4Element* elm, G4int nAtoms) 349 { 350 // perform checks consistency 351 if (0 == fIdxComponent) { 352 fMassFraction = false; 353 fAtoms = new std::vector<G4int>; 354 fElm = new std::vector<const G4Element*>; 355 } 356 if (fIdxComponent >= fNbComponents) { 357 G4ExceptionDescription ed; 358 ed << "For material " << fName << " and added element " << elm->GetName() 359 << " with Natoms=" << nAtoms 360 << " wrong attempt to add more than the declared number of elements " << fIdxComponent 361 << " >= " << fNbComponents; 362 G4Exception("G4Material::AddElementByNumberOfAtoms()", "mat031", FatalException, ed, ""); 363 } 364 if (fMassFraction) { 365 G4ExceptionDescription ed; 366 ed << "For material " << fName << " and added element " << elm->GetName() 367 << " with Natoms=" << nAtoms << " problem: cannot add by number of atoms after " 368 << "addition of elements by mass fraction"; 369 G4Exception("G4Material::AddElementByNumberOfAtoms()", "mat031", FatalException, ed, ""); 370 } 371 if (0 >= nAtoms) { 372 G4ExceptionDescription ed; 373 ed << "For material " << fName << " and added element " << elm->GetName() 374 << " with Natoms=" << nAtoms << " problem: number of atoms should be above zero"; 375 G4Exception("G4Material::AddElementByNumberOfAtoms()", "mat031", FatalException, ed, ""); 376 } 377 378 // filling 379 G4bool isAdded = false; 380 if (! fElm->empty()) { 381 for (G4int i = 0; i < fNumberOfElements; ++i) { 382 if (elm == (*fElm)[i]) { 383 (*fAtoms)[i] += nAtoms; 384 isAdded = true; 385 break; 386 } 387 } 388 } 389 if (! isAdded) { 390 fElm->push_back(elm); 391 fAtoms->push_back(nAtoms); 392 ++fNumberOfElements; 393 } 394 ++fIdxComponent; 395 396 // is filled - complete composition of atoms 397 if (fIdxComponent == fNbComponents) { 398 theElementVector = new G4ElementVector(); 399 theElementVector->reserve(fNumberOfElements); 400 fAtomsVector = new G4int[fNumberOfElements]; 401 fMassFractionVector = new G4double[fNumberOfElements]; 402 403 G4double Amol = 0.; 404 for (G4int i = 0; i < fNumberOfElements; ++i) { 405 theElementVector->push_back((*fElm)[i]); 406 fAtomsVector[i] = (*fAtoms)[i]; 407 G4double w = fAtomsVector[i] * (*fElm)[i]->GetA(); 408 Amol += w; 409 fMassFractionVector[i] = w; 410 } 411 for (G4int i = 0; i < fNumberOfElements; ++i) { 412 fMassFractionVector[i] /= Amol; 413 } 414 delete fAtoms; 415 delete fElm; 416 fMassOfMolecule = Amol / CLHEP::Avogadro; 417 ComputeDerivedQuantities(); 418 } 419 } 420 421 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 422 423 void G4Material::AddElementByMassFraction(const G4Element* elm, G4double fraction) 424 { 425 // perform checks consistency 426 if (fraction < 0.0 || fraction > 1.0) { 427 G4ExceptionDescription ed; 428 ed << "For material " << fName << " and added element " << elm->GetName() 429 << " massFraction= " << fraction << " is wrong "; 430 G4Exception("G4Material::AddElementByMassFraction()", "mat031", FatalException, ed, ""); 431 } 432 if (! fMassFraction) { 433 G4ExceptionDescription ed; 434 ed << "For material " << fName << " and added element " << elm->GetName() 435 << ", massFraction= " << fraction << ", fIdxComponent=" << fIdxComponent 436 << " problem: cannot add by mass fraction after " 437 << "addition of elements by number of atoms"; 438 G4Exception("G4Material::AddElementByMassFraction()", "mat031", FatalException, ed, ""); 439 } 440 if (fIdxComponent >= fNbComponents) { 441 G4ExceptionDescription ed; 442 ed << "For material " << fName << " and added element " << elm->GetName() 443 << ", massFraction= " << fraction << ", fIdxComponent=" << fIdxComponent 444 << "; attempt to add more than the declared number of components " << fIdxComponent 445 << " >= " << fNbComponents; 446 G4Exception("G4Material::AddElementByMassFraction()", "mat031", FatalException, ed, ""); 447 } 448 if (0 == fIdxComponent) { 449 fElmFrac = new std::vector<G4double>; 450 fElm = new std::vector<const G4Element*>; 451 } 452 453 // filling 454 G4bool isAdded = false; 455 if (! fElm->empty()) { 456 for (G4int i = 0; i < fNumberOfElements; ++i) { 457 if (elm == (*fElm)[i]) { 458 (*fElmFrac)[i] += fraction; 459 isAdded = true; 460 break; 461 } 462 } 463 } 464 if (! isAdded) { 465 fElm->push_back(elm); 466 fElmFrac->push_back(fraction); 467 ++fNumberOfElements; 468 } 469 ++fIdxComponent; 470 471 // is filled 472 if (fIdxComponent == fNbComponents) { 473 FillVectors(); 474 } 475 } 476 477 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 478 479 // composition by fraction of mass 480 void G4Material::AddMaterial(G4Material* material, G4double fraction) 481 { 482 if (fraction < 0.0 || fraction > 1.0) { 483 G4ExceptionDescription ed; 484 ed << "For material " << fName << " and added material " << material->GetName() 485 << ", massFraction= " << fraction << " is wrong "; 486 G4Exception("G4Material::AddMaterial()", "mat031", FatalException, ed, ""); 487 } 488 if (! fMassFraction) { 489 G4ExceptionDescription ed; 490 ed << "For material " << fName << " and added material " << material->GetName() 491 << ", massFraction= " << fraction << ", fIdxComponent=" << fIdxComponent 492 << " problem: cannot add by mass fraction after " 493 << "addition of elements by number of atoms"; 494 G4Exception("G4Material::AddMaterial()", "mat031", FatalException, ed, ""); 495 } 496 if (fIdxComponent >= fNbComponents) { 497 G4ExceptionDescription ed; 498 ed << "For material " << fName << " and added material " << material->GetName() 499 << ", massFraction= " << fraction 500 << "; attempt to add more than the declared number of components " << fIdxComponent 501 << " >= " << fNbComponents; 502 G4Exception("G4Material::AddMaterial()", "mat031", FatalException, ed, ""); 503 } 504 if (0 == fIdxComponent) { 505 fElmFrac = new std::vector<G4double>; 506 fElm = new std::vector<const G4Element*>; 507 } 508 509 // filling 510 auto nelm = (G4int)material->GetNumberOfElements(); 511 for (G4int j = 0; j < nelm; ++j) { 512 auto elm = material->GetElement(j); 513 auto frac = material->GetFractionVector(); 514 G4bool isAdded = false; 515 if (! fElm->empty()) { 516 for (G4int i = 0; i < fNumberOfElements; ++i) { 517 if (elm == (*fElm)[i]) { 518 (*fElmFrac)[i] += fraction * frac[j]; 519 isAdded = true; 520 break; 521 } 522 } 523 } 524 if (! isAdded) { 525 fElm->push_back(elm); 526 fElmFrac->push_back(fraction * frac[j]); 527 ++fNumberOfElements; 528 } 529 } 530 531 fMatComponents[material] = fraction; 532 ++fIdxComponent; 533 534 // is filled 535 if (fIdxComponent == fNbComponents) { 536 FillVectors(); 537 } 538 } 539 540 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 541 542 void G4Material::FillVectors() 543 { 544 // there are material components 545 theElementVector = new G4ElementVector(); 546 theElementVector->reserve(fNumberOfElements); 547 fAtomsVector = new G4int[fNumberOfElements]; 548 fMassFractionVector = new G4double[fNumberOfElements]; 549 550 G4double wtSum(0.0); 551 for (G4int i = 0; i < fNumberOfElements; ++i) { 552 theElementVector->push_back((*fElm)[i]); 553 fMassFractionVector[i] = (*fElmFrac)[i]; 554 wtSum += fMassFractionVector[i]; 555 } 556 delete fElmFrac; 557 delete fElm; 558 559 // check sum of weights -- OK? 560 if (std::abs(1. - wtSum) > perThousand) { 561 G4ExceptionDescription ed; 562 ed << "For material " << fName << " sum of fractional masses " << wtSum 563 << " is not 1 - results may be wrong"; 564 G4Exception("G4Material::FillVectors()", "mat031", JustWarning, ed, ""); 565 } 566 G4double coeff = (wtSum > 0.0) ? 1. / wtSum : 1.0; 567 G4double Amol(0.); 568 for (G4int i = 0; i < fNumberOfElements; ++i) { 569 fMassFractionVector[i] *= coeff; 570 Amol += fMassFractionVector[i] * (*theElementVector)[i]->GetA(); 571 } 572 for (G4int i = 0; i < fNumberOfElements; ++i) { 573 fAtomsVector[i] = G4lrint(fMassFractionVector[i] * Amol / (*theElementVector)[i]->GetA()); 574 } 575 ComputeDerivedQuantities(); 576 } 577 578 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 579 580 void G4Material::ComputeRadiationLength() 581 { 582 G4double radinv = 0.0; 583 for (G4int i = 0; i < fNumberOfElements; ++i) { 584 radinv += fVecNbOfAtomsPerVolume[i] * ((*theElementVector)[i]->GetfRadTsai()); 585 } 586 fRadlen = (radinv <= 0.0 ? DBL_MAX : 1. / radinv); 587 } 588 589 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 590 591 void G4Material::ComputeNuclearInterLength() 592 { 593 const G4double lambda1 = CLHEP::amu*CLHEP::cm2 / (35.0 * CLHEP::g); 594 G4double NILinv = 0.0; 595 for (G4int i = 0; i < fNumberOfElements; ++i) { 596 G4int Z = (*theElementVector)[i]->GetZasInt(); 597 G4double A = (*theElementVector)[i]->GetN(); 598 if (1 == Z) { 599 NILinv += fVecNbOfAtomsPerVolume[i] * A; 600 } 601 else { 602 NILinv += fVecNbOfAtomsPerVolume[i] * G4Pow::GetInstance()->A23(A); 603 } 604 } 605 NILinv *= lambda1; 606 fNuclInterLen = 1.e+20*CLHEP::m; 607 if (fNuclInterLen * NILinv > 1.0) { 608 fNuclInterLen = 1.0 / NILinv; 609 } 610 } 611 612 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 613 614 void G4Material::SetChemicalFormula(const G4String& chF) 615 { 616 if (! IsLocked()) { 617 fChemicalFormula = chF; 618 } 619 } 620 621 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 622 623 void G4Material::SetFreeElectronDensity(G4double val) 624 { 625 if (val >= 0. && ! IsLocked()) { 626 fFreeElecDensity = val; 627 } 628 } 629 630 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 631 632 void G4Material::ComputeDensityEffectOnFly(G4bool val) 633 { 634 if (! IsLocked()) { 635 if (nullptr == fIonisation) { 636 fIonisation = new G4IonisParamMat(this); 637 } 638 fIonisation->ComputeDensityEffectOnFly(val); 639 } 640 } 641 642 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 643 644 G4MaterialTable* G4Material::GetMaterialTable() 645 { 646 struct Holder { 647 G4MaterialTable instance; 648 ~Holder() { 649 for(auto item : instance) 650 delete item; 651 } 652 }; 653 static Holder _holder; 654 return &_holder.instance; 655 } 656 657 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 658 659 std::size_t G4Material::GetNumberOfMaterials() { return GetMaterialTable()->size(); } 660 661 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 662 663 G4Material* G4Material::GetMaterial(const G4String& materialName, G4bool warn) 664 { 665 // search the material by its name 666 for (auto const & j : *GetMaterialTable()) { 667 if (j->GetName() == materialName) { 668 return j; 669 } 670 } 671 672 // the material does not exist in the table 673 if (warn) { 674 G4cout << "G4Material::GetMaterial() WARNING: The material: " << materialName 675 << " does not exist in the table. Return NULL pointer." << G4endl; 676 } 677 return nullptr; 678 } 679 680 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 681 682 G4Material* G4Material::GetMaterial(G4double z, G4double a, G4double dens) 683 { 684 // search the material by its name 685 for (auto const & mat : *GetMaterialTable()) { 686 if (1 == mat->GetNumberOfElements() && z == mat->GetZ() && a == mat->GetA() && 687 dens == mat->GetDensity()) 688 { 689 return mat; 690 } 691 } 692 return nullptr; 693 } 694 695 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 696 697 G4Material* G4Material::GetMaterial(std::size_t nComp, G4double dens) 698 { 699 // search the material by its name 700 for (auto const & mat : *GetMaterialTable()) { 701 if (nComp == mat->GetNumberOfElements() && dens == mat->GetDensity()) { 702 return mat; 703 } 704 } 705 return nullptr; 706 } 707 708 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 709 710 G4double G4Material::GetZ() const 711 { 712 if (fNumberOfElements > 1) { 713 G4ExceptionDescription ed; 714 ed << "For material " << fName << " ERROR in GetZ() - Nelm=" << fNumberOfElements 715 << " > 1, which is not allowed"; 716 G4Exception("G4Material::GetZ()", "mat036", FatalException, ed, ""); 717 } 718 return (*theElementVector)[0]->GetZ(); 719 } 720 721 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 722 723 G4double G4Material::GetA() const 724 { 725 if (fNumberOfElements > 1) { 726 G4ExceptionDescription ed; 727 ed << "For material " << fName << " ERROR in GetA() - Nelm=" << fNumberOfElements 728 << " > 1, which is not allowed"; 729 G4Exception("G4Material::GetA()", "mat036", FatalException, ed, ""); 730 } 731 return (*theElementVector)[0]->GetA(); 732 } 733 734 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 735 736 std::ostream& operator<<(std::ostream& flux, const G4Material* material) 737 { 738 std::ios::fmtflags mode = flux.flags(); 739 flux.setf(std::ios::fixed, std::ios::floatfield); 740 G4long prec = flux.precision(3); 741 742 flux << " Material: " << std::setw(8) << material->fName << " " << material->fChemicalFormula 743 << " " 744 << " density: " << std::setw(6) << std::setprecision(3) 745 << G4BestUnit(material->fDensity, "Volumic Mass") << " RadL: " << std::setw(7) 746 << std::setprecision(3) << G4BestUnit(material->fRadlen, "Length") 747 << " Nucl.Int.Length: " << std::setw(7) << std::setprecision(3) 748 << G4BestUnit(material->fNuclInterLen, "Length") << "\n" 749 << std::setw(30) << " Imean: " << std::setw(7) << std::setprecision(3) 750 << G4BestUnit(material->GetIonisation()->GetMeanExcitationEnergy(), "Energy") 751 << " temperature: " << std::setw(6) << std::setprecision(2) 752 << (material->fTemp) / CLHEP::kelvin << " K" 753 << " pressure: " << std::setw(6) << std::setprecision(2) 754 << (material->fPressure) / CLHEP::atmosphere << " atm" 755 << "\n"; 756 757 for (G4int i = 0; i < material->fNumberOfElements; i++) { 758 flux << "\n ---> " << (*(material->theElementVector))[i] 759 << "\n ElmMassFraction: " << std::setw(6) << std::setprecision(2) 760 << (material->fMassFractionVector[i]) / perCent << " %" 761 << " ElmAbundance " << std::setw(6) << std::setprecision(2) 762 << 100 * (material->fVecNbOfAtomsPerVolume[i]) / (material->fTotNbOfAtomsPerVolume) 763 << " % \n"; 764 } 765 flux.precision(prec); 766 flux.setf(mode, std::ios::floatfield); 767 768 if (material->IsExtended()) { 769 static_cast<const G4ExtendedMaterial*>(material)->Print(flux); 770 } 771 772 return flux; 773 } 774 775 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 776 777 std::ostream& operator<<(std::ostream& flux, const G4Material& material) 778 { 779 flux << &material; 780 return flux; 781 } 782 783 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 784 785 std::ostream& operator<<(std::ostream& flux, const G4MaterialTable& MaterialTable) 786 { 787 // Dump info for all known materials 788 flux << "\n***** Table : Nb of materials = " << MaterialTable.size() << " *****\n" << G4endl; 789 790 for (auto i : MaterialTable) { 791 flux << i << G4endl << G4endl; 792 } 793 794 return flux; 795 } 796 797 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 798 799 G4bool G4Material::IsExtended() const { return false; } 800 801 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 802 803 void G4Material::SetMaterialPropertiesTable(G4MaterialPropertiesTable* anMPT) 804 { 805 if (fMaterialPropertiesTable != anMPT && ! IsLocked()) { 806 delete fMaterialPropertiesTable; 807 fMaterialPropertiesTable = anMPT; 808 } 809 } 810 811 //....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo...... 812 813 G4bool G4Material::IsLocked() 814 { 815 auto state = G4StateManager::GetStateManager()->GetCurrentState(); 816 return state != G4State_PreInit && state != G4State_Init && state != G4State_Idle; 817 } 818