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Public Member Functions | Protected Member Functions | Protected Attributes | List of all members
Mantid::Geometry::IsotropicAtomBraggScatterer Class Reference

IsotropicAtomBraggScatterer calculates the structure factor for a given HKL using the following equation, which gives the structure factor for the j-th atom in the unit cell: More...

#include <IsotropicAtomBraggScatterer.h>

Inheritance diagram for Mantid::Geometry::IsotropicAtomBraggScatterer:
Mantid::Geometry::BraggScattererInCrystalStructure Mantid::Geometry::BraggScatterer Mantid::Kernel::PropertyManager Mantid::Kernel::IPropertyManager

Public Member Functions

StructureFactor calculateStructureFactor (const Kernel::V3D &hkl) const override
 Calculates the structure factor. More...
 
BraggScatterer_sptr clone () const override
 Clones the instance. More...
 
std::string getElement () const
 Returns the string representation of the contained element. More...
 
PhysicalConstants::NeutronAtom getNeutronAtom () const
 Returns the internally stored NeutronAtom that holds element specific data. More...
 
double getOccupancy () const
 Returns the occupancy. More...
 
double getU () const
 Returns the isotropic atomic displacement parameter. More...
 
 IsotropicAtomBraggScatterer ()
 Constructor which takes an element symbol, fractional coordinates, isotropic atomic displacement parameter and occupancy. More...
 
std::string name () const override
 
- Public Member Functions inherited from Mantid::Geometry::BraggScattererInCrystalStructure
 BraggScattererInCrystalStructure ()
 Default constructor. More...
 
UnitCell getCell () const
 Returns the cell which is currently set. More...
 
Kernel::V3D getPosition () const
 Returns the position of the scatterer. More...
 
- Public Member Functions inherited from Mantid::Geometry::BraggScatterer
 BraggScatterer ()
 Default constructor. More...
 
double calculateFSquared (const Kernel::V3D &hkl) const
 Returns |F(hkl)|^2. More...
 
virtual StructureFactor calculateStructureFactor (const Kernel::V3D &hkl) const =0
 
virtual BraggScatterer_sptr clone () const =0
 
void initialize ()
 Initialization method that calls declareProperties() and sets initialized state to true. More...
 
bool isInitialized ()
 Returns whether the instance has been initialized. More...
 
bool isPropertyExposedToComposite (const std::string &propertyName) const
 Checks whether a property with the given name is exposed to BraggScattererComposite. More...
 
bool isPropertyExposedToComposite (Kernel::Property *property) const
 Checks if a property is exposed to BraggScattererComposite or throws std::invalid_argument if a null-pointer is supplied. More...
 
virtual std::string name () const =0
 
- Public Member Functions inherited from Mantid::Kernel::PropertyManager
::Json::Value asJson (bool withDefaultValues=false) const override
 Return the property manager serialized as a json object. More...
 
std::string asString (bool withDefaultValues=false) const override
 Return the property manager serialized as a string. More...
 
void clear () override
 Clears the whole property map. More...
 
void declareOrReplaceProperty (std::unique_ptr< Property > p, const std::string &doc="") override
 Add or replace a property in the list of managed properties. More...
 
void declareProperty (const std::string &name, const char *value, const std::string &doc, IValidator_sptr validator=std::make_shared< NullValidator >(), const unsigned int direction=Direction::Input)
 Specialised version of declareProperty template method to prevent the creation of a PropertyWithValue of type const char* if an argument in quotes is passed (it will be converted to a string). More...
 
void declareProperty (const std::string &name, const char *value, const unsigned int direction)
 Add a property of string type to the list of managed properties. More...
 
void declareProperty (const std::string &name, const char *value, IValidator_sptr validator=std::make_shared< NullValidator >(), const std::string &doc=std::string(), const unsigned int direction=Direction::Input)
 Specialised version of declareProperty template method to prevent the creation of a PropertyWithValue of type const char* if an argument in quotes is passed (it will be converted to a string). More...
 
template<typename T >
void declareProperty (const std::string &name, T value, const std::string &doc, const unsigned int direction=Direction::Input)
 Add a property to the list of managed properties with no validator. More...
 
template<typename T >
void declareProperty (const std::string &name, T value, const unsigned int direction)
 Add a property of the template type to the list of managed properties. More...
 
template<typename T >
void declareProperty (const std::string &name, T value, IValidator_sptr validator=std::make_shared< NullValidator >(), const std::string &doc="", const unsigned int direction=Direction::Input)
 Add a property of the template type to the list of managed properties. More...
 
void declareProperty (std::unique_ptr< Property > p, const std::string &doc="") override
 Add a property to the list of managed properties. More...
 
virtual void declareProperty (std::unique_ptr< Property > p, const std::string &doc="")=0
 Function to declare properties (i.e. store them) More...
 
bool existsProperty (const std::string &name) const override
 Checks whether the named property is already in the list of managed property. More...
 
void filterByProperty (const TimeSeriesProperty< bool > &filter, const std::vector< std::string > &excludedFromFiltering=std::vector< std::string >()) override
 Filter the managed properties by the given boolean property mask. More...
 
void filterByTime (const Types::Core::DateAndTime &start, const Types::Core::DateAndTime &stop) override
 Filter out a run by time. More...
 
std::vector< std::string > getDeclaredPropertyNames () const noexcept override
 Return the list of declared property names. More...
 
PropertygetPointerToProperty (const std::string &name) const override
 Get a property by name. More...
 
const std::vector< Property * > & getProperties () const override
 Get the list of managed properties. More...
 
TypedValue getProperty (const std::string &name) const override
 Get the value of a property. More...
 
std::string getPropertyValue (const std::string &name) const override
 Get the value of a property as a string. More...
 
bool operator!= (const PropertyManager &other) const
 
PropertyManageroperator+= (const PropertyManager &rhs)
 Addition operator. More...
 
PropertyManageroperator= (const PropertyManager &)
 Assignment operator - performs a deep copy. More...
 
bool operator== (const PropertyManager &other) const
 
size_t propertyCount () const override
 Count the number of properties under management. More...
 
 PropertyManager ()
 Default constructor. More...
 
 PropertyManager (const PropertyManager &)
 copy constructor More...
 
void removeProperty (const std::string &name, const bool delproperty=true) override
 removes the property from properties map More...
 
void resetProperties () override
 Reset property values back to initial values (blank or default values) More...
 
void setProperties (const ::Json::Value &jsonValue, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >(), bool createMissing=false) override
 Set the ordered list of properties by a json value collection. More...
 
void setProperties (const ::Json::Value &jsonValue, IPropertyManager *targetPropertyManager, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >(), bool createMissing=false)
 Set the ordered list of properties by a json value collection. More...
 
void setProperties (const std::string &propertiesJson, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >(), bool createMissing=false) override
 Set the ordered list of properties by one string of values, separated by semicolons. More...
 
void setProperties (const std::string &propertiesJson, IPropertyManager *targetPropertyManager, const std::unordered_set< std::string > &ignoreProperties, bool createMissing=false)
 Set the ordered list of properties by one string of values, separated by semicolons. More...
 
void setPropertiesWithString (const std::string &propertiesString, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >()) override
 Sets all the declared properties from a string. More...
 
void setPropertyOrdinal (const int &index, const std::string &value) override
 Set the value of a property by an index N.B. More...
 
void setPropertyValue (const std::string &name, const std::string &value) override
 Set the value of a property by string N.B. More...
 
void setPropertyValueFromJson (const std::string &name, const Json::Value &value) override
 Set the value of a property by Json::Value. More...
 
void splitByTime (std::vector< SplittingInterval > &splitter, std::vector< PropertyManager * > outputs) const override
 Split a run by time (splits the TimeSeriesProperties contained). More...
 
std::unique_ptr< PropertytakeProperty (const size_t index) override
 removes the property from the properties map and returns a pointer to it More...
 
bool validateProperties () const override
 Validates all the properties in the collection. More...
 
virtual ~PropertyManager () override
 Virtual destructor. More...
 
- Public Member Functions inherited from Mantid::Kernel::IPropertyManager
virtual ::Json::Value asJson (bool withDefaultValues=false) const =0
 Return the property manager serialized as a json object. More...
 
virtual std::string asString (bool withDefaultValues=false) const =0
 Return the property manager serialized as a string. More...
 
virtual void declareOrReplaceProperty (std::unique_ptr< Property > p, const std::string &doc="")=0
 Function to declare properties (i.e. store them) More...
 
void declareProperty (const std::string &name, const char *value, const std::string &doc, IValidator_sptr validator=std::make_shared< NullValidator >(), const unsigned int direction=Direction::Input)
 Specialised version of declareProperty template method to prevent the creation of a PropertyWithValue of type const char* if an argument in quotes is passed (it will be converted to a string). More...
 
void declareProperty (const std::string &name, const char *value, const unsigned int direction)
 Add a property of string type to the list of managed properties. More...
 
void declareProperty (const std::string &name, const char *value, IValidator_sptr validator=std::make_shared< NullValidator >(), const std::string &doc=std::string(), const unsigned int direction=Direction::Input)
 Specialised version of declareProperty template method to prevent the creation of a PropertyWithValue of type const char* if an argument in quotes is passed (it will be converted to a string). More...
 
template<typename T >
void declareProperty (const std::string &name, T value, const std::string &doc, const unsigned int direction=Direction::Input)
 Add a property to the list of managed properties with no validator. More...
 
template<typename T >
void declareProperty (const std::string &name, T value, const unsigned int direction)
 Add a property of the template type to the list of managed properties. More...
 
template<typename T >
void declareProperty (const std::string &name, T value, IValidator_sptr validator=std::make_shared< NullValidator >(), const std::string &doc="", const unsigned int direction=Direction::Input)
 Add a property of the template type to the list of managed properties. More...
 
virtual void declareProperty (std::unique_ptr< Property > p, const std::string &doc="")=0
 Function to declare properties (i.e. store them) More...
 
virtual bool existsProperty (const std::string &name) const =0
 Checks whether the named property is already in the list of managed property. More...
 
virtual void filterByProperty (const TimeSeriesProperty< bool > &, const std::vector< std::string > &)=0
 
virtual void filterByTime (const Types::Core::DateAndTime &, const Types::Core::DateAndTime &)=0
 
virtual std::vector< std::string > getDeclaredPropertyNames () const noexcept=0
 Get the list of managed property names. More...
 
virtual PropertygetPointerToProperty (const std::string &name) const =0
 Get a pointer to property by name. More...
 
virtual const std::vector< Property * > & getProperties () const =0
 Get the list of managed properties. More...
 
std::vector< Property * > getPropertiesInGroup (const std::string &group) const
 Get the list of managed properties in a given group. More...
 
virtual TypedValue getProperty (const std::string &name) const =0
 Get the value of a property. More...
 
virtual std::string getPropertyValue (const std::string &name) const =0
 Get the value of a property as a string. More...
 
virtual size_t propertyCount () const =0
 Returns the number of properties under management. More...
 
virtual void removeProperty (const std::string &name, const bool delproperty=true)=0
 Removes the property from management. More...
 
virtual void resetProperties ()=0
 
virtual void setProperties (const ::Json::Value &jsonValue, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >(), bool createMissing=false)=0
 Sets all the properties from a json object. More...
 
virtual void setProperties (const std::string &propertiesJson, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >(), bool createMissing=false)=0
 Sets all properties from a string. More...
 
virtual void setPropertiesWithString (const std::string &propertiesString, const std::unordered_set< std::string > &ignoreProperties=std::unordered_set< std::string >())=0
 Sets all the declared properties from a string. More...
 
IPropertyManagersetProperty (const std::string &name, const char *value)
 Specialised version of setProperty template method to handle const char *. More...
 
IPropertyManagersetProperty (const std::string &name, const std::string &value)
 Specialised version of setProperty template method to handle std::string. More...
 
template<typename T >
IPropertyManagersetProperty (const std::string &name, const T &value)
 Templated method to set the value of a PropertyWithValue. More...
 
template<typename T >
IPropertyManagersetProperty (const std::string &name, std::unique_ptr< T > value)
 Templated method to set the value of a PropertyWithValue from a std::unique_ptr. More...
 
void setPropertyGroup (const std::string &name, const std::string &group)
 Set the group for a given property. More...
 
virtual void setPropertyOrdinal (const int &index, const std::string &value)=0
 Set the value of a property by an index. More...
 
void setPropertySettings (const std::string &name, std::unique_ptr< IPropertySettings > settings)
 
virtual void setPropertyValue (const std::string &name, const std::string &value)=0
 Sets property value from a string. More...
 
virtual void setPropertyValueFromJson (const std::string &name, const Json::Value &value)=0
 Sets property value from a Json::Value. More...
 
virtual void splitByTime (std::vector< SplittingInterval > &, std::vector< PropertyManager * >) const =0
 
virtual std::unique_ptr< PropertytakeProperty (const size_t index)=0
 Removes the property from management and returns a pointer to it. More...
 
void updatePropertyValues (const IPropertyManager &other)
 Update values of the existing properties. More...
 
virtual bool validateProperties () const =0
 Validates all the properties in the collection. More...
 
virtual ~IPropertyManager ()=default
 

Protected Member Functions

void afterScattererPropertySet (const std::string &propertyName) override
 After setting the element as a string, the corresponding. More...
 
void declareScattererProperties () override
 Declares properties of this scatterer model. More...
 
double getDebyeWallerFactor (const Kernel::V3D &hkl) const
 Returns the Debye-Waller factor, using an isotropic atomic displacement and the stored unit cell. More...
 
double getScatteringLength () const
 Returns the scattering length of the stored element. More...
 
void setElement (const std::string &element)
 Tries to obtain element specific data for the given symbol using PhysicalConstants::getAtom. More...
 
- Protected Member Functions inherited from Mantid::Geometry::BraggScattererInCrystalStructure
void afterPropertySet (const std::string &propertyName) override
 Additional property processing. More...
 
virtual void afterScattererPropertySet (const std::string &)
 This method should be re-implemented by subclasses for additional parameter processing. More...
 
void declareProperties () override
 Declares basic properties, should not be overridden by subclasses, use declareScattererProperties instead. More...
 
virtual void declareScattererProperties ()
 This method should be implemented by subclasses for declaring additional properties. More...
 
Kernel::V3D getPositionFromString (const std::string &positionString) const
 
virtual void setCell (const UnitCell &cell)
 Assigns a unit cell, which may be required for certain calculations. More...
 
virtual void setPosition (const Kernel::V3D &position)
 Sets the position of the scatterer to the supplied coordinates - vector is wrapped to [0, 1). More...
 
- Protected Member Functions inherited from Mantid::Geometry::BraggScatterer
void afterPropertySet (const std::string &) override
 Base implementation does nothing, can be re-implemented by subclasses. More...
 
virtual void declareProperties ()
 Base implementation does nothing - for implementing classes only. More...
 
void exposePropertyToComposite (const std::string &propertyName)
 Exposes the property with the supplied name to BraggScattererComposite. More...
 
const std::string & getPropagatingGroupName () const
 Returns the group name that is used to mark properties that are propagated. More...
 
void unexposePropertyFromComposite (const std::string &propertyName)
 Removes exposure to composite for specified property. More...
 
- Protected Member Functions inherited from Mantid::Kernel::PropertyManager
PropertygetPointerToPropertyOrdinal (const int &index) const override
 Get a property by an index. More...
 
PropertygetPointerToPropertyOrNull (const std::string &name) const
 Get a property by name. More...
 
- Protected Member Functions inherited from Mantid::Kernel::IPropertyManager
virtual void afterPropertySet (const std::string &)
 Override this method to perform a custom action right after a property was set. More...
 
virtual void clear ()=0
 Clears all properties under management. More...
 
virtual PropertygetPointerToPropertyOrdinal (const int &index) const =0
 Get a property by an index. More...
 
template<typename T >
getValue (const std::string &name) const
 Templated method to get the value of a property. More...
 
template<>
MANTID_KERNEL_DLL PropertyManager_sptr getValue (const std::string &name) const
 
template<>
MANTID_KERNEL_DLL PropertyManager_const_sptr getValue (const std::string &name) const
 

Protected Attributes

PhysicalConstants::NeutronAtom m_atom
 
std::string m_label
 
- Protected Attributes inherited from Mantid::Geometry::BraggScattererInCrystalStructure
UnitCell m_cell
 
Kernel::V3D m_position
 

Additional Inherited Members

- Static Public Member Functions inherited from Mantid::Kernel::PropertyManager
static std::string getInvalidValuesFilterLogName (const std::string &logName)
 Gets the correct log name for the matching invalid values log for a given log name. More...
 
static std::string getLogNameFromInvalidValuesFilter (const std::string &logName)
 
static bool isAnInvalidValuesFilterLog (const std::string &logName)
 
- Static Public Attributes inherited from Mantid::Kernel::PropertyManager
static const std::string INVALID_VALUES_SUFFIX = "_invalid_values"
 

Detailed Description

IsotropicAtomBraggScatterer calculates the structure factor for a given HKL using the following equation, which gives the structure factor for the j-th atom in the unit cell:

\[ F(hkl)_j = b_j \cdot o_j \cdot DWF_j(hkl) \cdot \exp\left[2\pi i \cdot \left(h\cdot x_j + k\cdot y_j + l\cdot z_j\right)\right] \]

Since there are many terms in that equation, further explanation is required. The j-th atom in a unit cell occupies a certain position, here denoted by the fractional coordinates (x, y, z). With this information, an important calculation can be already carried out, calculation of the so called "phase". This term is easier seen when the complex part is written using trigonometric functions:

\begin{eqnarray*} \phi &=& 2\pi\left(h\cdot x_j + k\cdot y_j + l\cdot z_j\right) \\ \exp i\phi &=& \cos\phi + i\sin\phi \end{eqnarray*}

The magnitude of the complex number is determined first of all by the scattering length, \(b_j\) (which is element specific and tabulated, in Mantid this is in PhysicalConstants::NeutronAtom). It is multiplied by the occupancy \(o_j\), which is a number on the interval [0, 1], where 0 is a bit meaningless, since it means "no atoms on this position" and 1 represents a fully occupied position in the crystal lattice. This number can be used to model statistically distributed defects.

\(DWF_j\) denotes the Debye-Waller-factor, which models the diminishing scattering power of atoms that are displaced from their position (either due to temperature or other effects). It is defined like this:

\[ DWF_j(hkl) = \exp\left[-2\pi^2\cdot U \cdot 1/d_{hkl}^2\right] \]

Here, \(U\) is given in \(\mathrm{\AA{}^2}\) (for a discussion of terms regarding atomic displacement parameters, please see [1]), it is often of the order 0.05. \(d_{hkl}\) is alculated using the unit cell. The model used in this class is isotropic (hence the class name), which may be insufficient depending on the crystal structure, but as a first approximation it is often enough.

This class is designed to handle atoms in the asymmetric unit of the cell, creation of symmetrically equivalent atoms in the entire unit cell has to be handled elsewhere.

One example where this is done can be found in CrystalStructure.

[1] http://ww1.iucr.org/comm/cnom/adp/finrep/finrep.html

Author
Michael Wedel, Paul Scherrer Institut - SINQ
Date
21/10/2014

Definition at line 78 of file IsotropicAtomBraggScatterer.h.

Constructor & Destructor Documentation

◆ IsotropicAtomBraggScatterer()

Mantid::Geometry::IsotropicAtomBraggScatterer::IsotropicAtomBraggScatterer ( )

Constructor which takes an element symbol, fractional coordinates, isotropic atomic displacement parameter and occupancy.

Definition at line 27 of file IsotropicAtomBraggScatterer.cpp.

Member Function Documentation

◆ afterScattererPropertySet()

void Mantid::Geometry::IsotropicAtomBraggScatterer::afterScattererPropertySet ( const std::string &  propertyName)
overrideprotectedvirtual

After setting the element as a string, the corresponding.

Reimplemented from Mantid::Geometry::BraggScattererInCrystalStructure.

Definition at line 107 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::Kernel::PropertyManager::getPropertyValue(), and setElement().

◆ calculateStructureFactor()

StructureFactor Mantid::Geometry::IsotropicAtomBraggScatterer::calculateStructureFactor ( const Kernel::V3D hkl) const
overridevirtual

Calculates the structure factor.

This method calculates the structure factor. For details, please refer to the class documentation in the header file.

Parameters
hkl:: HKL for which the structure factor should be calculated
Returns
Structure factor (complex).

Implements Mantid::Geometry::BraggScatterer.

Definition at line 68 of file IsotropicAtomBraggScatterer.cpp.

References getDebyeWallerFactor(), getOccupancy(), getScatteringLength(), Mantid::Geometry::BraggScattererInCrystalStructure::m_position, and Mantid::Kernel::V3D::scalar_prod().

◆ clone()

BraggScatterer_sptr Mantid::Geometry::IsotropicAtomBraggScatterer::clone ( ) const
overridevirtual

Clones the instance.

Implements Mantid::Geometry::BraggScatterer.

Definition at line 30 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::Kernel::PropertyManager::asString(), and clone().

Referenced by clone().

◆ declareScattererProperties()

void Mantid::Geometry::IsotropicAtomBraggScatterer::declareScattererProperties ( )
overrideprotectedvirtual

Declares properties of this scatterer model.

In addition to the properties of BraggScatterer, this class implements three more properties, as described in the general class documentation, with some restrictions on allowed values:

  • U must be 0 or greater
  • Occupancy must be on the interval [0,1]
  • Element must be present.

Reimplemented from Mantid::Geometry::BraggScattererInCrystalStructure.

Definition at line 88 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::Kernel::PropertyManager::declareProperty(), and setElement().

◆ getDebyeWallerFactor()

double Mantid::Geometry::IsotropicAtomBraggScatterer::getDebyeWallerFactor ( const Kernel::V3D hkl) const
protected

Returns the Debye-Waller factor, using an isotropic atomic displacement and the stored unit cell.

Definition at line 115 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::Geometry::UnitCell::getB(), Mantid::Geometry::BraggScattererInCrystalStructure::getCell(), getU(), and Mantid::Kernel::V3D::norm2().

Referenced by calculateStructureFactor().

◆ getElement()

std::string Mantid::Geometry::IsotropicAtomBraggScatterer::getElement ( ) const

Returns the string representation of the contained element.

Definition at line 48 of file IsotropicAtomBraggScatterer.cpp.

References m_label.

◆ getNeutronAtom()

PhysicalConstants::NeutronAtom Mantid::Geometry::IsotropicAtomBraggScatterer::getNeutronAtom ( ) const

Returns the internally stored NeutronAtom that holds element specific data.

Definition at line 51 of file IsotropicAtomBraggScatterer.cpp.

References m_atom.

◆ getOccupancy()

double Mantid::Geometry::IsotropicAtomBraggScatterer::getOccupancy ( ) const

Returns the occupancy.

Definition at line 54 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::Kernel::PropertyManager::getProperty().

Referenced by calculateStructureFactor().

◆ getScatteringLength()

double Mantid::Geometry::IsotropicAtomBraggScatterer::getScatteringLength ( ) const
protected

Returns the scattering length of the stored element.

Definition at line 122 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::PhysicalConstants::NeutronAtom::coh_scatt_length_real, and m_atom.

Referenced by calculateStructureFactor().

◆ getU()

double Mantid::Geometry::IsotropicAtomBraggScatterer::getU ( ) const

Returns the isotropic atomic displacement parameter.

Definition at line 57 of file IsotropicAtomBraggScatterer.cpp.

References Mantid::Kernel::PropertyManager::getProperty().

Referenced by getDebyeWallerFactor().

◆ name()

std::string Mantid::Geometry::IsotropicAtomBraggScatterer::name ( ) const
inlineoverridevirtual

Implements Mantid::Geometry::BraggScatterer.

Definition at line 82 of file IsotropicAtomBraggScatterer.h.

◆ setElement()

void Mantid::Geometry::IsotropicAtomBraggScatterer::setElement ( const std::string &  element)
protected

Member Data Documentation

◆ m_atom

PhysicalConstants::NeutronAtom Mantid::Geometry::IsotropicAtomBraggScatterer::m_atom
protected

Definition at line 102 of file IsotropicAtomBraggScatterer.h.

Referenced by getNeutronAtom(), getScatteringLength(), and setElement().

◆ m_label

std::string Mantid::Geometry::IsotropicAtomBraggScatterer::m_label
protected

Definition at line 103 of file IsotropicAtomBraggScatterer.h.

Referenced by getElement(), and setElement().


The documentation for this class was generated from the following files: