ObjCryst::PeakList::hkl Struct Reference

One observed diffraction line, to be indexed. More...

Public Member Functions
	hkl (const float dobs=1.0, const float iobs=0.0, const float dobssigma=0.0, const float iobssigma=0.0, const int h=0, const int k=0, const int l=0, const float d2calc=0)

Public Attributes
float	dobs
	Observed peak position 1/d.
float	dobssigma
	Error on peak position.
float	d2obs
	Observed peak position 1/d^2.
float	d2obsmin
	Min value for observed peak position 1/(d+disgma/2)^2.
float	d2obsmax
	Min value for observed peak position 1/(d-disgma/2)^2.
float	iobs
	Observed peak intensity.
float	iobssigma
	Error on observed peak intensity.
int	h
	Miller indices, after line is indexed.
int	k
int	l
std::list< hkl0 >	vDicVolHKL
	Possible Miller indices, stored during a dichotomy search.
bool	isIndexed
	Is this line indexed ?
bool	isSpurious
	Is this an impurity line ?
unsigned long	stats
	Indexing statistics.
float	d2calc
	Calculated position, 1/d^2.
float	d2diff
	1/d^2 difference, obs-calc

Detailed Description

One observed diffraction line, to be indexed.

Definition at line 158 of file Indexing.h.

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

• Indexing.h
• Indexing.cpp