Eintrag weiter verarbeiten
Theoretical high-resolution spectroscopy for reactive molecules in astrochemistry and combustion processes
Gespeichert in:
Erscheint auch als: | Schröder, Benjamin, 1987 - , Theoretical high-resolution spectroscopy for reactive molecules in astrochemistry and combustion processes, Göttingen, 2019, vi, 272 Seiten |
---|---|
Personen und Körperschaften: | , , , , , , |
Titel: | Theoretical high-resolution spectroscopy for reactive molecules in astrochemistry and combustion processes/ submitted by Benjamin Schröder ; Reviewer: Prof. Dr. Ricardo A. Mata, Secomd Reviewer: Dr. Thomas Zeuch, Further members of the Examination Board: Prof. Dr. Götz Eckold, Prof. Dr. Alec M. Wodtke, Prof. Dr. Burkhard Geil, Prof. Dr. Konrad Koszinowski |
Hochschulschriftenvermerk: | Dissertation, Georg-August-Universität Göttingen, 2019 |
veröffentlicht: |
Göttingen:
2019
|
Umfang: | 1 Online-Ressource; Illustrationen, Diagramme |
Zusammenfassung: | Rovibrational spectroscopy is a prime tool for the indirect investigation of molecular potential energy surfaces (PES). Naturally, theoretical predictions of molecular spectra have been the focus of numerous works since the early days of quantum chemistry. With the formulation of modern ab initio methods and ever increasing computing power of modern high-performance computing facilities it has become possible to calculate the PES with unprecedented accuracy. On the other hand, such a high-level PES requires also an accurate treatment of the rovibrational problem. For molecules with up to 3 ... |
Format: | E-Book Hochschulschrift |
Quelle: |
Verbunddaten SWB Lizenzfreie Online-Ressourcen |
Sprache: | Englisch |