[ASAP] A Combined Wave Function and Density Functional Approach for K ‑Edge X‑ray Absorption Near-Edge Spectroscopy: A Case Study of Hydrated First-Row Transition Metal Ions

The Journal of Physical Chemistry LettersDOI: 10.1021/acs.jpclett.3c00611

Source: The Journal of Physical Chemistry Letters - May 31, 2023 Category: Chemistry Authors: Soumen Ghosh, Shaul Mukamel, and Niranjan Govind Source Type: research