Irena: tool suite for modeling and analysis of small-angle scattering

被引:1351
作者
Ilavsky, Jan [1 ]
Jemian, Peter R. [1 ]
机构
[1] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA
关键词
X-RAY-SCATTERING; PARTICLE-SIZE DISTRIBUTIONS; ENTROPY IMAGE-RECONSTRUCTION; THERMAL BARRIER COATINGS; MAXIMUM-ENTROPY; ANOMALOUS-SCATTERING; HARD SPHERES; FORM-FACTOR; NEUTRON; SILICA;
D O I
10.1107/S0021889809002222
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Irena, a tool suite for analysis of both X-ray and neutron small-angle scattering (SAS) data within the commercial Igor Pro application, brings together a comprehensive suite of tools useful for investigations in materials science, physics, chemistry, polymer science and other fields. In addition to Guinier and Porod fits, the suite combines a variety of advanced SAS data evaluation tools for the modeling of size distribution in the dilute limit using maximum entropy and other methods, dilute limit small-angle scattering from multiple non-interacting populations of scatterers, the pair-distance distribution function, a unified fit, the Debye-Bueche model, the reflectivity (X-ray and neutron) using Parratt's formalism, and small-angle diffraction. There are also a number of support tools, such as a data import/export tool supporting a broad sampling of common data formats, a data modification tool, a presentation-quality graphics tool optimized for small-angle scattering data, and a neutron and X-ray scattering contrast calculator. These tools are brought together into one suite with consistent interfaces and functionality. The suite allows robust automated note recording and saving of parameters during export.
引用
收藏
页码:347 / 353
页数:7
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