Hättig Group

Solvent effects on Singlet/Triplet splitting in donor-acceptor compounds with quantum mechanical calculations

About the group:

The Quantum Chemistry (Haettig) Group is active both in applying computational chemistry methods to chemical problems as well as in the development of improved methods and programs. Applications are mostly concerned with solvation effects on electronic spectra (UV-vis, fluorescence, phosphorescence, CD, MCD, and others) and chemical reaction mechanisms e.g. for combustion or heterogeneous catalysis. On the method and code development side, the group is one of the main contributors to the TURBOMOLE program packgae and internationally known for development of a efficient implementation of the approximate coupled-cluster method CC2 for modelling electronic spectroscopies.

What they are looking for in students:

- basic knowledge of quantum mechanics
- good background in MO theory
- should have some experience with electronic structure programs (e.g. DFT)
- should be able to work on computers with the Linux operator system

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Paper related to the topic


HOW To Apply

Apply here

For your application you will need:

  • CV with contact details and affiliation (max. 2 pages)
  • letter of motivation related to Solvation Science (1 page)
  • your research proposal (1 page)
  • your diploma (Bachelor or Master)

Prerequisites: Current Master and PhD students with expiriences in Natural Sciences, Medical Sciences or related topics of Engineering

Start:  3 of December 2024

Deadline: 1 of March 2025

The results will be announced at the end of March 2025. The following selection period will be open at the end of summer 2025.


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Factsheet


Win A research Stay

Subject: conduct your research proposal
Duration: 3 months
Location: Bochum, Germany and local Ruhr RESOLV partner institutions
Language of instruction: English
Costs: RESOLV sponsors travel and a monthly stipend
Period research stay: before August 2025