Frequency analysis for modulation-enhanced powder diffraction

Acta Crystallogr A Found Adv. 2016 Jul 1;72(Pt 4):500-6. doi: 10.1107/S2053273316008378. Epub 2016 Jun 29.

Abstract

Periodic modulation of external conditions on a crystalline sample with a consequent analysis of periodic diffraction response has been recently proposed as a tool to enhance experimental sensitivity for minor structural changes. Here the intensity distributions for both a linear and nonlinear structural response induced by a symmetric and periodic stimulus are analysed. The analysis is further extended for powder diffraction when an external perturbation changes not only the intensity of Bragg lines but also their positions. The derived results should serve as a basis for a quantitative modelling of modulation-enhanced diffraction data measured in real conditions.

Keywords: frequency response; modulation-enhanced diffraction; periodic modulation; powder diffraction.

Publication types

  • Research Support, Non-U.S. Gov't