G4NistManager.hh

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// -------------------------------------------------------------------
//
// GEANT4 Class header file
//
// File name:     G4NistManager
//
// Author:        Vladimir Ivanchenko
//
// Creation date: 23.12.2004
//
// Modifications:
// 27.02.06 V.Ivanchneko add GetAtomicMassAmu and ConstructNewGasMaterial
// 11.05.06 V.Ivanchneko add warning flag to FindMaterial method
// 17.10.06 V.Ivanchneko add methods: GetAtomicMass, GetNistElementNames,
//                       GetNistMaterialNames
// 02.05.07 V.Ivanchneko add GetNistFirstIsotopeN and GetNumberOfNistIsotopes
// 28.07.07 V.Ivanchneko make simple methods inline
// 28.10.07 V.Ivanchneko add state, T, P to maetrial build
// 29.04.10 V.Ivanchneko add GetMeanIonisationEnergy method
// 01.11.10 V.Ivanchneko add G4Pow for fast computations
// 09.02.12 P.Gumplinger add ConstructNewIdealGasMaterial
//
// Class Description:
//
// A utility static class
//
// Element data from the NIST DB on Atomic Weights and Isotope Compositions
// http://physics.nist.gov/PhysRefData/Compositions/index.html
//
// -------------------------------------------------------------------
 
#ifndef G4NistManager_h
#define G4NistManager_h 1
 
#include "G4ICRU90StoppingData.hh"
#include "G4Material.hh"
#include "G4Element.hh"
#include "G4Isotope.hh"
#include "G4NistElementBuilder.hh"
#include "G4NistMaterialBuilder.hh"
#include "G4Pow.hh"
#include "globals.hh"
 
#include <CLHEP/Units/PhysicalConstants.h>
 
#include <vector>
 
class G4NistMessenger;
 
class G4NistManager
{
 public:
  static G4NistManager* Instance();
  ~G4NistManager();
 
  // Get G4Element by index
  //
  inline G4Element* GetElement(std::size_t index) const;
 
  // Find or build G4Element by atomic number
  //
  inline G4Element* FindElement(G4int Z) const;
  inline G4Element* FindOrBuildElement(G4int Z, G4bool isotopes = true);
 
  // Find or build G4Element by symbol
  //
  inline G4Element* FindOrBuildElement(const G4String& symb, G4bool isotopes = true);
 
  // Get number of elements
  //
  inline std::size_t GetNumberOfElements() const;
 
  // Get atomic number by element symbol
  //
  inline G4int GetZ(const G4String& symb) const;
 
  // Get atomic weight by element symbol - mean mass in units of amu of
  // an atom with electron shell for the natural isotope composition
  //
  inline G4double GetAtomicMassAmu(const G4String& symb) const;
 
  // Get atomic weight in atomic units - mean mass in units of amu of an atom
  // with electron shell for the natural isotope composition
  //
  inline G4double GetAtomicMassAmu(G4int Z) const;
 
  // Get mass of isotope without electron shell in Geant4 energy units
  //
  inline G4double GetIsotopeMass(G4int Z, G4int N) const;
 
  // Get mass in Geant4 energy units of an atom of a particular isotope
  // with the electron shell
  //
  inline G4double GetAtomicMass(G4int Z, G4int N) const;
 
  // Get total ionisation energy of an atom
  //
  inline G4double GetTotalElectronBindingEnergy(G4int Z) const;
 
  // Get N for the first natural isotope
  //
  inline G4int GetNistFirstIsotopeN(G4int Z) const;
 
  // Get number of natural isotopes
  //
  inline G4int GetNumberOfNistIsotopes(G4int Z) const;
 
  // Get natural isotope abundance
  //
  inline G4double GetIsotopeAbundance(G4int Z, G4int N) const;
 
  // Print element by Z
  //
  inline void PrintElement(G4int Z) const;
 
  // Print element from internal DB by symbol, if "all" - print all elements
  //
  void PrintElement(const G4String&) const;
 
  // Print G4Element by name, if "all" - print all G4Elements
  //
  void PrintG4Element(const G4String&) const;
 
  // Access to the vector of Geant4 predefined element names
  //
  inline const std::vector<G4String>& GetNistElementNames() const;
 
  // Access mean ionisation energy for atoms (Z <= 98) by its index
  //
  inline G4double GetMeanIonisationEnergy(G4int Z) const;
 
  // Access nominal density by atomic number for simple materials and
  // by the index for other NIST materials
  //
  inline G4double GetNominalDensity(G4int Z) const;
 
  // Get G4Material by index
  //
  inline G4Material* GetMaterial(std::size_t index) const;
 
  // Find or build a G4Material by name, from the Geant4 dataBase
  //
  inline G4Material* FindMaterial(const G4String& name) const;
  inline G4Material* FindOrBuildMaterial(
    const G4String& name, G4bool isotopes = true, G4bool warning = false);
 
  // Find or build a simple material via atomic number
  //
  inline G4Material* FindSimpleMaterial(G4int Z) const;
  inline G4Material* FindOrBuildSimpleMaterial(G4int Z, G4bool warning = false);
 
  // Build G4Material with user defined name and density on base
  // of a material from Geant4 dataBase
  //
  G4Material* BuildMaterialWithNewDensity(const G4String& name, const G4String& basename,
    G4double density = 0.0, G4double temp = NTP_Temperature, G4double pres = CLHEP::STP_Pressure);
 
  // Construct a G4Material from scratch by atome count
  // temperature and pressure should be consistent with the density
  //
  inline G4Material* ConstructNewMaterial(const G4String& name, const std::vector<G4String>& elm,
    const std::vector<G4int>& nbAtoms, G4double dens, G4bool isotopes = true,
    G4State state = kStateSolid, G4double temp = NTP_Temperature,
    G4double pressure = CLHEP::STP_Pressure);
 
  // Construct a G4Material from scratch by fraction mass
  // temperature and pressure should be consistent with the density
  //
  inline G4Material* ConstructNewMaterial(const G4String& name, const std::vector<G4String>& elm,
    const std::vector<G4double>& weight, G4double dens, G4bool isotopes = true,
    G4State state = kStateSolid, G4double temp = NTP_Temperature,
    G4double pressure = CLHEP::STP_Pressure);
 
  // Construct a gas G4Material from scratch by atome count
  //
  inline G4Material* ConstructNewGasMaterial(const G4String& name, const G4String& nameNist,
    G4double temp, G4double pres, G4bool isotopes = true);
 
  // Construct an ideal gas G4Material from scratch by atom count
  //
  inline G4Material* ConstructNewIdealGasMaterial(const G4String& name,
    const std::vector<G4String>& elm, const std::vector<G4int>& nbAtoms, G4bool isotopes = true,
    G4double temp = NTP_Temperature, G4double pressure = CLHEP::STP_Pressure);
 
  // enable/disable density effect calculator by material name
  //
  void SetDensityEffectCalculatorFlag(const G4String&, G4bool);
 
  // enable/disable density effect calculator by material pointer
  //
  void SetDensityEffectCalculatorFlag(G4Material*, G4bool);
 
  // Get number of G4Materials
  //
  inline std::size_t GetNumberOfMaterials() const;
 
  inline G4int GetVerbose() const;
 
  void SetVerbose(G4int);
 
  // Print G4Material by name
  //
  void PrintG4Material(const G4String&) const;
 
  // Print predefined Geant4 materials:
  // "simple" - only pure materials in basic state (Z = 1, ..., 98)
  // "compound" - NIST compounds
  // "hep" - HEP materials and compounds
  // "bio" - bio-medical materials and compounds
  // "all" - all
  //
  inline void ListMaterials(const G4String&) const;
 
  // Access to the list of names of Geant4 predefined materials
  //
  inline const std::vector<G4String>& GetNistMaterialNames() const;
 
  // Fast computation of Z^1/3
  //
  inline G4double GetZ13(G4double Z) const;
  inline G4double GetZ13(G4int Z) const;
 
  // Fast computation of A^0.27 for natuaral abundances
  //
  inline G4double GetA27(G4int Z) const;
 
  // Fast computation of log(A)
  //
  inline G4double GetLOGZ(G4int Z) const;
  inline G4double GetLOGAMU(G4int Z) const;
 
  G4ICRU90StoppingData* GetICRU90StoppingData();
 
 private:
  G4NistManager();
 
  std::vector<G4Element*> elements;
  std::vector<G4Material*> materials;
 
  G4ICRU90StoppingData* fICRU90;
  G4NistElementBuilder* elmBuilder;
  G4NistMaterialBuilder* matBuilder;
  G4NistMessenger* messenger;
  G4Pow* g4pow;
  const G4MaterialTable* theMaterialTable;
  const G4ElementTable* theElementTable;
  const G4IsotopeTable* theIsotopeTable;
 
  G4double POWERA27[101];
  G4double LOGAZ[101];
 
  std::size_t nElements;
  std::size_t nMaterials;
  G4int verbose;
};
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline std::size_t G4NistManager::GetNumberOfMaterials() const { return nMaterials; }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Element* G4NistManager::GetElement(std::size_t index) const
{
  return (index < theElementTable->size()) ? (*theElementTable)[index] : nullptr;
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Element* G4NistManager::FindElement(G4int Z) const { return elmBuilder->FindElement(Z); }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Element* G4NistManager::FindOrBuildElement(G4int Z, G4bool isotopes)
{
  return elmBuilder->FindOrBuildElement(Z, isotopes);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Element* G4NistManager::FindOrBuildElement(const G4String& symb, G4bool isotopes)
{
  return elmBuilder->FindOrBuildElement(symb, isotopes);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline std::size_t G4NistManager::GetNumberOfElements() const { return nElements; }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4int G4NistManager::GetZ(const G4String& symb) const { return elmBuilder->GetZ(symb); }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetAtomicMassAmu(const G4String& symb) const
{
  return elmBuilder->GetAtomicMassAmu(symb);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetAtomicMassAmu(G4int Z) const
{
  return elmBuilder->GetAtomicMassAmu(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetIsotopeMass(G4int Z, G4int N) const
{
  return elmBuilder->GetIsotopeMass(Z, N);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetAtomicMass(G4int Z, G4int N) const
{
  return elmBuilder->GetAtomicMass(Z, N);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetTotalElectronBindingEnergy(G4int Z) const
{
  return elmBuilder->GetTotalElectronBindingEnergy(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetIsotopeAbundance(G4int Z, G4int N) const
{
  return elmBuilder->GetIsotopeAbundance(Z, N);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4int G4NistManager::GetNistFirstIsotopeN(G4int Z) const
{
  return elmBuilder->GetNistFirstIsotopeN(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4int G4NistManager::GetNumberOfNistIsotopes(G4int Z) const
{
  return elmBuilder->GetNumberOfNistIsotopes(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline const std::vector<G4String>& G4NistManager::GetNistElementNames() const
{
  return elmBuilder->GetElementNames();
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetMeanIonisationEnergy(G4int Z) const
{
  return matBuilder->GetMeanIonisationEnergy(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetNominalDensity(G4int Z) const
{
  return matBuilder->GetNominalDensity(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline void G4NistManager::PrintElement(G4int Z) const { elmBuilder->PrintElement(Z); }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::GetMaterial(std::size_t index) const
{
  return (index < theMaterialTable->size()) ? (*theMaterialTable)[index] : nullptr;
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4int G4NistManager::GetVerbose() const { return verbose; }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::FindMaterial(const G4String& name) const
{
  return matBuilder->FindMaterial(name);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::FindOrBuildMaterial(const G4String& name, G4bool, G4bool warning)
{
  return matBuilder->FindOrBuildMaterial(name, warning);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::FindSimpleMaterial(G4int Z) const
{
  return matBuilder->FindSimpleMaterial(Z);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::FindOrBuildSimpleMaterial(G4int Z, G4bool warning)
{
  return matBuilder->FindOrBuildSimpleMaterial(Z, warning);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::ConstructNewMaterial(const G4String& name,
  const std::vector<G4String>& elm, const std::vector<G4int>& nbAtoms, G4double dens, G4bool,
  G4State state, G4double T, G4double P)
 
{
  return matBuilder->ConstructNewMaterial(name, elm, nbAtoms, dens, state, T, P);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::ConstructNewMaterial(const G4String& name,
  const std::vector<G4String>& elm, const std::vector<G4double>& w, G4double dens, G4bool,
  G4State state, G4double T, G4double P)
{
  return matBuilder->ConstructNewMaterial(name, elm, w, dens, state, T, P);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::ConstructNewGasMaterial(
  const G4String& name, const G4String& nameNist, G4double temp, G4double pres, G4bool)
{
  return matBuilder->ConstructNewGasMaterial(name, nameNist, temp, pres);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4Material* G4NistManager::ConstructNewIdealGasMaterial(const G4String& name,
  const std::vector<G4String>& elm, const std::vector<G4int>& nbAtoms, G4bool, G4double T,
  G4double P)
{
  return matBuilder->ConstructNewIdealGasMaterial(name, elm, nbAtoms, T, P);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline void G4NistManager::ListMaterials(const G4String& list) const
{
  matBuilder->ListMaterials(list);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline const std::vector<G4String>& G4NistManager::GetNistMaterialNames() const
{
  return matBuilder->GetMaterialNames();
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetZ13(G4double A) const { return g4pow->A13(A); }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetZ13(G4int Z) const { return g4pow->Z13(Z); }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetA27(G4int Z) const
{
  return (0 <= Z && Z < 101) ? POWERA27[Z] : g4pow->powZ(Z, 0.27);
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetLOGZ(G4int Z) const { return g4pow->logZ(Z); }
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
inline G4double G4NistManager::GetLOGAMU(G4int Z) const
{
  return (0 <= Z && Z < 101) ? LOGAZ[Z] : 0.0;
}
 
//....oooOO0OOooo........oooOO0OOooo........oooOO0OOooo........oooOO0OOooo......
 
#endif