Package etomica.models.nitrogen

Class MeterNormalizedCoord

java.lang.Object

etomica.models.nitrogen.MeterNormalizedCoord

All Implemented Interfaces:

IAction, IDataSource, java.io.Serializable

public class MeterNormalizedCoord
extends java.lang.Object
implements IDataSource, IAction, java.io.Serializable

Sample the distribution of the normalized coordinate for the atoms/ molecules from coordinate definition, calcU method. They are the quantities of deviation in translation and rotation from the atomic/molecular nominal position and orientation Eg. N2 molecule with 5 D.O.F, this class will return 5 distributions of 3 translation and 2 rotation motion respectively.

See Also:

Serialized Form

Field Summary

Fields

Modifier and Type	Field	Description
protected CoordinateDefinition	coordinateDefinition

Constructor Summary

Constructors

Constructor	Description
MeterNormalizedCoord(Box newBox, CoordinateDefinition coordDef, ISpecies species)
MeterNormalizedCoord(Box newBox, CoordinateDefinition coordDef, ISpecies species, boolean isVolFluctuation)

Method Summary

Modifier and Type	Method	Description
void	actionPerformed()	Assigning the histogram to data
IData	getData()	Returns the DataGroup of uDistribtion[i]
IDataInfo	getDataInfo()
DataTag	getTag()
boolean	isVolFluctuation()
void	reset()	Sets the tensor summation to 0.
void	setVolFluctuation(boolean isVolFluctuation)

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Field Detail

coordinateDefinition

protected CoordinateDefinition coordinateDefinition

Constructor Detail

MeterNormalizedCoord

public MeterNormalizedCoord(Box newBox,
                            CoordinateDefinition coordDef,
                            ISpecies species)

MeterNormalizedCoord

public MeterNormalizedCoord(Box newBox,
                            CoordinateDefinition coordDef,
                            ISpecies species,
                            boolean isVolFluctuation)

Method Detail

getDataInfo

public IDataInfo getDataInfo()

Specified by:

getDataInfo in interface IDataSource

actionPerformed

public void actionPerformed()

Assigning the histogram to data

Specified by:

actionPerformed in interface IAction

getData

public IData getData()

Returns the DataGroup of uDistribtion[i]

Specified by:

getData in interface IDataSource

Returns:

the data given by this source

reset

public void reset()

Sets the tensor summation to 0.

getTag

public DataTag getTag()

Specified by:

getTag in interface IDataSource

Returns:

a tag that uniquely identifies the IDataInfo

isVolFluctuation

public boolean isVolFluctuation()

setVolFluctuation

public void setVolFluctuation(boolean isVolFluctuation)