X-ray Diffraction Profile Correction via Piecewise Spectral Functions

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Solution Overview

Problem

Existing X-ray diffraction imaging systems face challenges in noise increase and reduced detection rates due to normalization against non-uniform primary spectra, and angular variations in scatter angles affect accurate identification of objects.

Innovation Solution

A method involving a piecewise spectral-correction function is applied to remove K structure non-uniformity from the emission spectrum, and an angular-variation correction procedure transforms energy-dispersive XRD spectra to a common intensity and momentum scale, regardless of scatter angle.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Measurement precision

If normalization is applied to remove non-uniform primary spectrum, then spectral structures are removed, but noise significantly increases

Engineering Contradiction:
Improvespectral structure removalVSAvoidnoise level
Core Design Contradiction:
Measurement precisionVSReliability

Solution Approach 1:

The patent extracts and removes only the harmful spectral structures (K-alpha lines, K-beta lines, and K-edge artifacts) from the primary spectrum while preserving the underlying continuous bremsstrahlung background. This selective extraction approach eliminates the need for full normalization, thereby removing spectral interference without introducing the noise amplification that occurs with conventional normalization methods.

Inventive Principle:
Principle #2Taking out (Extraction)

Solution Approach 2:

The patent converts the harmful non-uniform spectral structures into beneficial information by using them to create a correction function. The correction function is derived from the measured primary spectrum and applied to correct subsequent XRD measurements, transforming the problematic spectral variations into a useful correction mechanism that improves measurement accuracy without increasing noise.

Inventive Principle:
Principle #22Blessing in disguise (Convert harm into benefit)

2Measurement precision

If normalization is applied to correct primary spectrum non-uniformity, then spectral structures are removed, but genuine XRD peaks are suppressed

Engineering Contradiction:
Improvespectral structure removalVSAvoidXRD peak intensity
Core Design Contradiction:
Measurement precisionVSLoss of information

Solution Approach 1:

The patent extracts only the discrete spectral structures (K-alpha, K-beta lines and K-edge) from the continuous spectrum, leaving the bremsstrahlung background intact. This selective removal prevents the suppression of genuine XRD peaks that would occur with full normalization, as the continuous background component is preserved and does not interfere with peak detection.

Inventive Principle:
Principle #2Taking out (Extraction)

Solution Approach 2:

The patent applies different handling to different components of the spectrum: discrete spectral structures are removed through correction functions, while the continuous bremsstrahlung background is preserved. This local differentiation ensures that spectral interference is eliminated without affecting the intensity information carried by genuine XRD peaks in the continuous spectrum region.

Inventive Principle:
Principle #3Local quality

3Measurement precision

If angular-variation correction is applied to transform spectra to common scale, then identification accuracy is improved, but device complexity increases

Engineering Contradiction:
Improveidentification accuracyVSAvoidcorrection procedure complexity
Core Design Contradiction:
Measurement precisionVSDevice complexity

Solution Approach 1:

The patent changes the parameter of scatter angle normalization by introducing a correction function that accounts for angular variations in the X-ray beam path. This parameter transformation allows spectra measured at different scatter angles to be transformed to a common reference scale, improving identification accuracy while the correction function itself serves as a practical solution to the complexity issue.

Inventive Principle:
Principle #35Parameter changes

Applied Scientific Principles

This section explains which scientific principles are used to turn an abstract innovation direction into a practical engineering solution.

Function Achieved in This Case

This approach reduces noise, enhances peak amplitudes, and ensures accurate identification of materials by correcting for spectral structures and angular variations, improving detection rates and reducing false alarms.

Implementation Method 1

An X-ray imaging system includes an X-ray source that transmits X-rays through a container towards a detector

Methodology Applied
Scientific EffectX-ray transmission: X-Ray

Implementation Method 2

a detector configured to detect radiation scattered by an interaction of the primary beam with an object

Methodology Applied
Scientific EffectX-ray scattering: Scattering

Implementation Method 3

calculating a piecewise spectral-correction function using the spectral structures in the emission spectrum, applying the spectral-correction function to the measured spectrum

Methodology Applied
Scientific EffectSpectral correction:

Implementation Method 4

an angular-variation correction procedure transforms energy-dispersive XRD spectra to a common intensity and momentum scale, regardless of scatter angle

Methodology Applied
Scientific EffectAngular variation correction:

Data Source

PatentUS8625740B2System and method for correcting X-ray diffraction profiles
Publication Date: 2014.01.07 SMITHS DETECTION GERMANY GMBH
  • US8625740B2 patent drawing
  • US8625740B2 patent drawing
  • US8625740B2 patent drawing

AI summary

A method for correcting an X-ray diffraction (XRD) profile measured by an X-ray diffraction imaging (XDi) system is provided. The XDi system includes an anode, a detector, and a control system. The method includes obtaining an emission spectrum of the anode using the control system. The emission spectrum includes spectral structures. The method further includes calculating a piecewise spectral-correction function using the spectral structures in the emission spectrum, obtaining a measured spectrum of an object, and applying the spectral-correction function to the measured spectrum to generate a spectrally-corrected measured spectrum.