Sier Daniel, Cousland Geoffrey P, Trevorah Ryan M, Ekanayake Ruwini S K, Tran Chanh Q, Hester James R, Chantler Christopher T
School of Physics, University of Melbourne, Australia.
La Trobe University, Australia.
J Synchrotron Radiat. 2020 Sep 1;27(Pt 5):1262-1277. doi: 10.1107/S1600577520010097. Epub 2020 Aug 17.
Measurements of mass attenuation coefficients and X-ray absorption fine structure (XAFS) of zinc selenide (ZnSe) are reported to accuracies typically better than 0.13%. The high accuracy of the results presented here is due to our successful implementation of the X-ray extended range technique, a relatively new methodology, which can be set up on most synchrotron X-ray beamlines. 561 attenuation coefficients were recorded in the energy range 6.8-15 keV with measurements concentrated at the zinc and selenium pre-edge, near-edge and fine-structure absorption edge regions. This accuracy yielded detailed nanostructural analysis of room-temperature ZnSe with full uncertainty propagation. Bond lengths, accurate to 0.003 Å to 0.009 Å, or 0.1% to 0.3%, are plausible and physical. Small variation from a crystalline structure suggests local dynamic motion beyond that of a standard crystal lattice, noting that XAFS is sensitive to dynamic correlated motion. The results obtained in this work are the most accurate to date with comparisons with theoretically determined values of the attenuation showing discrepancies from literature theory of up to 4%, motivating further investigation into the origin of such discrepancies.
据报道,硒化锌(ZnSe)的质量衰减系数和X射线吸收精细结构(XAFS)测量精度通常优于0.13%。本文所呈现结果的高精度归因于我们成功实施了X射线扩展范围技术,这是一种相对较新的方法,可在大多数同步加速器X射线束线上设置。在6.8 - 15 keV能量范围内记录了561个衰减系数,测量集中在锌和硒的预边缘、近边缘和精细结构吸收边缘区域。这种精度实现了对室温下ZnSe的详细纳米结构分析,并进行了完整的不确定度传播。精确到0.003 Å至0.009 Å或0.1%至0.3%的键长是合理且符合物理规律的。与晶体结构的微小差异表明存在超出标准晶格的局部动态运动,需注意XAFS对动态相关运动敏感。与理论确定的衰减值相比,本工作获得的结果是迄今为止最准确的,显示出与文献理论的差异高达4%,这促使人们进一步研究这种差异的来源。