Extended range X-ray pair distribution functions

التفاصيل البيبلوغرافية
العنوان: Extended range X-ray pair distribution functions
المؤلفون: E. Clark, Emmanuel Soignard, Jeffery L. Yarger, Chris J. Benmore, D. S. Robinson, Jan Ilavsky, J. K. R. Weber, Anthony Tamalonis, Guy Jennings, O. L. G. Alderman
المصدر: Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment. 955:163318
بيانات النشر: Elsevier BV, 2020.
سنة النشر: 2020
مصطلحات موضوعية: Physics, Nuclear and High Energy Physics, Small-angle X-ray scattering, Resolution (electron density), Pair distribution function, 02 engineering and technology, 010402 general chemistry, 021001 nanoscience & nanotechnology, 01 natural sciences, 0104 chemical sciences, Computational physics, symbols.namesake, Reciprocal lattice, Fourier transform, Distribution function, symbols, Small-angle scattering, 0210 nano-technology, Structure factor, Instrumentation
الوصف: Here we describe a dual detector system for high-energy X-ray, simultaneous, small and wide-angle X-ray scattering (SAXS and WAXS), designed to extract extended-range pair distribution functions (ER-PDF) for disordered materials. The hardware and software provides continuous reciprocal space coverage over atomic to nanometer length-scales. Details of the varying resolution, splicing of data and normalization on an absolute scale are outlined. In addition, the combination of SAXS and WAXS theory is considered with a view to enabling a direct Fourier transformation of the structure factor spanning multiple length-scales into real space. Important distinctions between the ER-PDF and the pair distance distribution function (PDDF) representations are demonstrated. It is shown that when the SAXS intensity in the structure factor, S(Q), is similar to the WAXS intensity, the contributions to the ER-PDF are minimal. However, when the SAXS S(Q) intensities are substantially stronger than the WAXS, the ER-PDF can provide important structural information on the local, intermediate and nanometer length-scales. Notably, the ER-PDF method provides direct information on particle sizes and their density distributions, overcoming the limitations of PDDF analysis for densely packed systems.
تدمد: 0168-9002
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::75d198e0b25e8c4f796e1dc96a85f66b
https://doi.org/10.1016/j.nima.2019.163318
حقوق: OPEN
رقم الأكسشن: edsair.doi...........75d198e0b25e8c4f796e1dc96a85f66b
قاعدة البيانات: OpenAIRE