X-ray absorption resonances near L2,3-edges from real-time propagation of the Dirac-Kohn-Sham density matrix

Phys. Chem. Chem. Phys., 2015, 17,22566-22570
DOI: 10.1039/C5CP03712C, Communication

Open Access

&nbsp This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.

Marius Kadek, Lukas Konecny, Bin Gao, Michal Repisky, Kenneth Ruud
We present the first four-component X-ray absorption spectrum obtained from the real-time solution of the TDDFT equation.
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