G4GDMLWriteMaterials.cc

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//
// G4GDMLWriteMaterials implementation
//
// Author: Zoltan Torzsok, November 2007
// --------------------------------------------------------------------
 
#include <sstream>
 
#include "G4GDMLWriteMaterials.hh"
 
#include "G4PhysicalConstants.hh"
#include "G4SystemOfUnits.hh"
#include "G4Element.hh"
#include "G4Isotope.hh"
#include "G4Material.hh"
 
// --------------------------------------------------------------------
G4GDMLWriteMaterials::G4GDMLWriteMaterials()
  : G4GDMLWriteDefine()
{
}
 
// --------------------------------------------------------------------
G4GDMLWriteMaterials::~G4GDMLWriteMaterials()
{
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::AtomWrite(xercesc::DOMElement* element,
                                     const G4double& a)
{
  xercesc::DOMElement* atomElement = NewElement("atom");
  atomElement->setAttributeNode(NewAttribute("unit", "g/mole"));
  atomElement->setAttributeNode(NewAttribute("value", a * mole / g));
  element->appendChild(atomElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::DWrite(xercesc::DOMElement* element,
                                  const G4double& d)
{
  xercesc::DOMElement* DElement = NewElement("D");
  DElement->setAttributeNode(NewAttribute("unit", "g/cm3"));
  DElement->setAttributeNode(NewAttribute("value", d * cm3 / g));
  element->appendChild(DElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::PWrite(xercesc::DOMElement* element,
                                  const G4double& P)
{
  xercesc::DOMElement* PElement = NewElement("P");
  PElement->setAttributeNode(NewAttribute("unit", "pascal"));
  PElement->setAttributeNode(NewAttribute("value", P / hep_pascal));
  element->appendChild(PElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::TWrite(xercesc::DOMElement* element,
                                  const G4double& T)
{
  xercesc::DOMElement* TElement = NewElement("T");
  TElement->setAttributeNode(NewAttribute("unit", "K"));
  TElement->setAttributeNode(NewAttribute("value", T / kelvin));
  element->appendChild(TElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::MEEWrite(xercesc::DOMElement* element,
                                    const G4double& MEE)
{
  xercesc::DOMElement* PElement = NewElement("MEE");
  PElement->setAttributeNode(NewAttribute("unit", "eV"));
  PElement->setAttributeNode(NewAttribute("value", MEE / electronvolt));
  element->appendChild(PElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::IsotopeWrite(const G4Isotope* const isotopePtr)
{
  const G4String name = GenerateName(isotopePtr->GetName(), isotopePtr);
 
  xercesc::DOMElement* isotopeElement = NewElement("isotope");
  isotopeElement->setAttributeNode(NewAttribute("name", name));
  isotopeElement->setAttributeNode(NewAttribute("N", isotopePtr->GetN()));
  isotopeElement->setAttributeNode(NewAttribute("Z", isotopePtr->GetZ()));
  materialsElement->appendChild(isotopeElement);
  AtomWrite(isotopeElement, isotopePtr->GetA());
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::ElementWrite(const G4Element* const elementPtr)
{
  const G4String name = GenerateName(elementPtr->GetName(), elementPtr);
 
  xercesc::DOMElement* elementElement = NewElement("element");
  elementElement->setAttributeNode(NewAttribute("name", name));
 
  const G4int NumberOfIsotopes = (G4int)elementPtr->GetNumberOfIsotopes();
 
  if(NumberOfIsotopes > 0)
  {
    const G4double* RelativeAbundanceVector
      = elementPtr->GetRelativeAbundanceVector();
    for(G4int i = 0; i < NumberOfIsotopes; ++i)
    {
      G4String fractionref = GenerateName(elementPtr->GetIsotope(i)->GetName(),
                                          elementPtr->GetIsotope(i));
      xercesc::DOMElement* fractionElement = NewElement("fraction");
      fractionElement->setAttributeNode(
        NewAttribute("n", RelativeAbundanceVector[i]));
      fractionElement->setAttributeNode(NewAttribute("ref", fractionref));
      elementElement->appendChild(fractionElement);
      AddIsotope(elementPtr->GetIsotope(i));
    }
  }
  else
  {
    elementElement->setAttributeNode(NewAttribute("Z", elementPtr->GetZ()));
    AtomWrite(elementElement, elementPtr->GetA());
  }
 
  materialsElement->appendChild(elementElement);
  // Append the element AFTER all the possible components are appended!
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::MaterialWrite(const G4Material* const materialPtr)
{
  G4String state_str("undefined");
  const G4State state = materialPtr->GetState();
  if(state == kStateSolid)
  {
    state_str = "solid";
  }
  else if(state == kStateLiquid)
  {
    state_str = "liquid";
  }
  else if(state == kStateGas)
  {
    state_str = "gas";
  }
 
  const G4String name = GenerateName(materialPtr->GetName(), materialPtr);
 
  xercesc::DOMElement* materialElement = NewElement("material");
  materialElement->setAttributeNode(NewAttribute("name", name));
  materialElement->setAttributeNode(NewAttribute("state", state_str));
 
  // Write any property attached to the material...
  //
  if(materialPtr->GetMaterialPropertiesTable())
  {
    PropertyWrite(materialElement, materialPtr);
  }
 
  if(materialPtr->GetTemperature() != STP_Temperature)
  {
    TWrite(materialElement, materialPtr->GetTemperature());
  }
 
  if(materialPtr->GetPressure() != STP_Pressure)
  {
    PWrite(materialElement, materialPtr->GetPressure());
  }
 
  // Write Ionisation potential (mean excitation energy)
  MEEWrite(materialElement,
           materialPtr->GetIonisation()->GetMeanExcitationEnergy());
 
  DWrite(materialElement, materialPtr->GetDensity());
 
  const G4int NumberOfElements = (G4int)materialPtr->GetNumberOfElements();
 
  if((NumberOfElements > 1) ||
     (materialPtr->GetElement(0) != nullptr &&
      materialPtr->GetElement(0)->GetNumberOfIsotopes() > 1))
  {
    const G4double* MassFractionVector = materialPtr->GetFractionVector();
 
    for(G4int i = 0; i < NumberOfElements; ++i)
    {
      const G4String fractionref = GenerateName(
        materialPtr->GetElement(i)->GetName(), materialPtr->GetElement(i));
      xercesc::DOMElement* fractionElement = NewElement("fraction");
      fractionElement->setAttributeNode(
        NewAttribute("n", MassFractionVector[i]));
      fractionElement->setAttributeNode(NewAttribute("ref", fractionref));
      materialElement->appendChild(fractionElement);
      AddElement(materialPtr->GetElement(i));
    }
  }
  else
  {
    materialElement->setAttributeNode(NewAttribute("Z", materialPtr->GetZ()));
    AtomWrite(materialElement, materialPtr->GetA());
  }
 
  // Append the material AFTER all the possible components are appended!
  //
  materialsElement->appendChild(materialElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::PropertyVectorWrite(
  const G4String& key, const G4PhysicsFreeVector* const pvec)
{
  for(std::size_t i = 0; i < propertyList.size(); ++i)  // Check if property is
  {                                                     // already in the list!
    if(propertyList[i] == pvec)
    {
      return;
    }
  }
  propertyList.push_back(pvec);
 
  const G4String matrixref = GenerateName(key, pvec);
  xercesc::DOMElement* matrixElement = NewElement("matrix");
  matrixElement->setAttributeNode(NewAttribute("name", matrixref));
  matrixElement->setAttributeNode(NewAttribute("coldim", "2"));
  std::ostringstream pvalues;
  for(std::size_t i = 0; i < pvec->GetVectorLength(); ++i)
  {
    if(i != 0)
    {
      pvalues << " ";
    }
    pvalues << pvec->Energy(i) << " " << (*pvec)[i];
  }
  matrixElement->setAttributeNode(NewAttribute("values", pvalues.str()));
 
  defineElement->appendChild(matrixElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::PropertyConstWrite(
  const G4String& key, const G4double pval,
  const G4MaterialPropertiesTable* ptable)
{
  const G4String matrixref           = GenerateName(key, ptable);
  xercesc::DOMElement* matrixElement = NewElement("matrix");
  matrixElement->setAttributeNode(NewAttribute("name", matrixref));
  matrixElement->setAttributeNode(NewAttribute("coldim", "1"));
  std::ostringstream pvalues;
 
  pvalues << pval;
  matrixElement->setAttributeNode(NewAttribute("values", pvalues.str()));
 
  defineElement->appendChild(matrixElement);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::PropertyWrite(xercesc::DOMElement* matElement,
                                         const G4Material* const mat)
{
  xercesc::DOMElement* propElement;
  G4MaterialPropertiesTable* ptable = mat->GetMaterialPropertiesTable();
 
  auto pvec = ptable->GetProperties();
  auto cvec = ptable->GetConstProperties();
 
  for(size_t i = 0; i < pvec.size(); ++i)
  {
    if (pvec[i] != nullptr)
    {
      propElement = NewElement("property");
      propElement->setAttributeNode(
        NewAttribute("name", ptable->GetMaterialPropertyNames()[i]));
      propElement->setAttributeNode(NewAttribute(
        "ref", GenerateName(ptable->GetMaterialPropertyNames()[i],
                            pvec[i])));
      PropertyVectorWrite(ptable->GetMaterialPropertyNames()[i],
                          pvec[i]);
      matElement->appendChild(propElement);
    }
  }
 
  for(size_t i = 0; i < cvec.size(); ++i)
  {
    if (cvec[i].second == true)
    {
      propElement = NewElement("property");
      propElement->setAttributeNode(NewAttribute(
        "name", ptable->GetMaterialConstPropertyNames()[i]));
      propElement->setAttributeNode(NewAttribute(
        "ref", GenerateName(ptable->GetMaterialConstPropertyNames()[i],
                            ptable)));
      PropertyConstWrite(ptable->GetMaterialConstPropertyNames()[i],
                         cvec[i].first, ptable);
      matElement->appendChild(propElement);
    }
  }
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::MaterialsWrite(xercesc::DOMElement* element)
{
#ifdef G4VERBOSE
  G4cout << "G4GDML: Writing materials..." << G4endl;
#endif
  materialsElement = NewElement("materials");
  element->appendChild(materialsElement);
 
  isotopeList.clear();
  elementList.clear();
  materialList.clear();
  propertyList.clear();
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::AddIsotope(const G4Isotope* const isotopePtr)
{
  for(std::size_t i = 0; i < isotopeList.size(); ++i)  // Check if isotope is
  {                                                    // already in the list!
    if(isotopeList[i] == isotopePtr)
    {
      return;
    }
  }
  isotopeList.push_back(isotopePtr);
  IsotopeWrite(isotopePtr);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::AddElement(const G4Element* const elementPtr)
{
  for(std::size_t i = 0; i < elementList.size(); ++i)  // Check if element is
  {                                                    // already in the list!
    if(elementList[i] == elementPtr)
    {
      return;
    }
  }
  elementList.push_back(elementPtr);
  ElementWrite(elementPtr);
}
 
// --------------------------------------------------------------------
void G4GDMLWriteMaterials::AddMaterial(const G4Material* const materialPtr)
{
  for(std::size_t i = 0; i < materialList.size(); ++i)  // Check if material is
  {                                                     // already in the list!
    if(materialList[i] == materialPtr)
    {
      return;
    }
  }
  materialList.push_back(materialPtr);
  MaterialWrite(materialPtr);
}