The development of high-brilliance third-and fourth-generation light sources such as
synchrotrons and X-ray free-electron lasers (XFELs), the emergence of laboratory-based X …

Alkali ion rechargeable batteries play a significant part in portable electronic devices and
electronic vehicles. The rapid development of renewable energy technology nowadays …

Computational spectroscopy has emerged as a critical tool for researchers looking to
achieve both qualitative and quantitative interpretations of experimental spectra. Over the …

Supervised machine learning-enabled mapping of the X-ray absorption near edge structure
(XANES) spectra to local structural descriptors offers new methods for understanding the …

The affordable, accurate, and generalizable prediction of spectroscopic observables plays a
key role in the analysis of increasingly complex experiments. In this article, we develop and …

Material characterization techniques are widely used to characterize the physical and
chemical properties of materials at the nanoscale and, thus, play central roles in material …

X-ray absorption near-edge structure (XANES) spectroscopy is widely used across the
natural sciences to obtain element specific atomic scale insight into the structure of matter …

X-ray absorption spectroscopy at the L2/3 edge can be used to obtain detailed information
about the local electronic and geometric structure of transition metal complexes. By virtue of …

Local electronic structure in the ground state is essential for understanding the stability and
properties of materials. Core-loss spectroscopy using electron or X-ray provides insights into …

Abstract X-ray Absorption Spectroscopy (XAS) methods have been used to study the mixed-
valence iron (II)-iron (III) metal–organic frameworks (MOFs) that undergo order–disorder …