Weak Hydrogen Bonds to Molecular Nitrogen and Oxygen as Experimental Benchmarks for Quantum Chemistry
von Sönke Oswald
Datum der mündl. Prüfung:2019-02-28
Erschienen:2019-03-22
Betreuer:Prof. Dr. Martin A. Suhm
Gutachter:Prof. Dr. Martin A. Suhm
Gutachter:Prof. Dr. Alec Wodtke
Dateien
Name:Dissertation_Oswald.pdf
Size:46.1Mb
Format:PDF
Description:Dissertation
Zusammenfassung
Englisch
Small molecular complexes in the gas phase weakly bound by hydrogen bonds to molecular nitrogen and oxygen are studied by vibrational and rotational spectroscopy. The obtained experimental data are used as benchmarks for quantum chemical electronic structure calculations.
Keywords: Vibrational Spectroscopy; Molecular Clusters; Rotational Spectroscopy; Hydrogen Bonding; Quantum Chemistry; Intermolecular Interactions; Benchmarking