Projects from Prof. Dr. Martin Brehm
Untersuchung von Struktur, Dynamik und Schwingungsspektren komplexer Flüssigkeiten durch atomistische Simulation (Heisenberg-Professur)
Duration: 05/2023 - 12/2026
Der Effekt r?umlicher Korrelation auf Schwingungsspektren der flüssigen Phase
Within this project, the influence of spatial correlation on the vibrational spectra (infrared, Raman, VCD, ROA) of condensed phase systems shall be investigated. It is well known in the literature that spatial correlation plays a significant role for the signal intensity in vibrational spectroscopy, but there does not yet exist a generally ...
Duration: 01/2023 - 12/2026
Untersuchung des Solvatationsverhaltens von Biopolymeren in Ionischen Flüssigkeiten mit Hilfe von Methoden der Multiskalen-Simulation und Theoretischen Spektroskopie
Within this project, the microscopic solvation characteristics of cellulose in ionic liquids shall be investigated by means of multiscale molecular dynamics simulations, complemented by computational spectroscopy. The aim of the project is to gain a molecular picture of the interactions between cellulose and a series of ionic liquids and to ...
Duration: 01/2017 - 04/2023