Core-Excited States and X-ray Absorption Spectra from Multireference Algebraic Diagrammatic Construction Theory
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, The Ohio State University, Columbus, Ohio 43210, United States
Funder
Division of Chemistry
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00477
Reference193 articles.
1. Recent advances in x-ray absorption spectroscopy
2. Springer Series in Surface Sciences;Stöhr J.,2013
3. Recent progress in EXAFS/NEXAFS spectroscopy
4. What will it take to observe processes in 'real time'?
5. Attosecond Electron Dynamics in Molecules
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