@Book{1867616874,
author="Kochetov, Vladislav",
title="Ultrafast electron dynamics in molecules within density-matrix-based configuration interaction framework",
year="2023",
address="Rostock",
abstract="The main goal of this thesis is to present the results of work concerning photon-induced ultrafast spin dynamics being theoretically modeled within the framework of ab-initio calculations. The effect of chemical structure on the ultrafast spin-flip dynamics in core-excited states of transition metal complexes has been studied. Detailed analysis of spin-orbit coupling-driven dynamics in core-excited states, based on the preselection of states and utilizing the Wigner-Eckart theorem, is conducted. A general framework to numerically simulate the ultrafast electron dynamics was developed.<eng>",
school="Universit{\"a}t Rostock",
note="vorgelegt von Vladislav Kochetov",
note="Enth{\"a}lt Zeitschriftenartikel",
note="GutachterInnen: Sergey I. Bokarev (University of Rostock) ; Oliver K{\"u}hn (University of Rostock) ; Jean-Christophe Tremblay (University of Lorraine)",
note="Dissertation Universit{\"a}t Rostock 2023 Kumulative Dissertation",
doi="10.18453/rosdok_id00004451",
url="https://purl.uni-rostock.de/rosdok/id00004451",
url="https://nbn-resolving.org/urn:nbn:de:gbv:28-rosdok_id00004451-9",
url="https://d-nb.info/1308009976/34",
url="https://doi.org/10.18453/rosdok_id00004451",
language="English"
}