ObjCryst::PDFCrystal::pdfAtom Struct Reference

Container of temp data for each atom. More...

List of all members.

Public Member Functions
	pdfAtom ()
	default constructor

Public Attributes
REAL	fx0
	Fractionnal & cartesian unique coordinates.
REAL	fy0
REAL	fz0
REAL	x0
REAL	y0
REAL	z0
const ScatteringPower *	pScattPow
	The scattering power.
REAL	occupBi
	Scattering amplitudes, multiplied by occupancy.
bool	hasChanged
	Has this atom changed since last time ?
CrystVector_REAL	x
	List of all equivalent & translated positions, in cartesian coordinates.
CrystVector_REAL	y
CrystVector_REAL	z

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Detailed Description

Container of temp data for each atom.

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The documentation for this struct was generated from the following file:

• PDF.h