PhD student (f/m/d) in the field of theoretical catalysis
75 % part-time
Organisationseinheit
Institut für Katalyseforschung und -technologie (IKFT)
Ihre Aufgaben
Chemical reactions in zeolites are to be investigated using quantum chemical methods. The processes unter investigation (methanol-to-olefins, syngas-to-olefins) involve the production of hydrocarbons from renewable raw materials. In addition to periodic density functional theory (DFT), ab initio methods and molecular dynamics (MD) simulations will also be performed for the investigations. Furthermore, machine learning can be tested to accelerate MD simulations.
In this project, you will be responsible for the following tasks in particular:
- Investigation of reaction mechanismus using density functional theory and statistical thermodynamics
- Kinetic modeling using mean-field models and transition state theory
- Conducting MD simulations for the targeted investigation of selected problems
- Publication of research results and participation in international conferences
- Cooperation and exchange with working groups
Eintrittstermin
01.01.2026
Ihre Qualifikation
You bring with you:
- A completed scientific university degree (master's) in chemistry or a related field
- Knowledge of chemistry and quantum chemical methods
- Computer skills in Linux and programming languages (e.g., Python)
- Good communication skills
- Team spirit and the ability to engage in constructive scientific exchange with colleagues
Das bieten wir Ihnen
Become a member of staff of the only German University of Excellence that conducts large-scale research on the national level. Work under excellent working conditions in an interna-tional environment and be active in research and academic education for our future. Benefit from specific training when starting your job and from a wide range of further qualification offers. Use our flexible working time models (flexitime, work from home), our sports and leisure offers, as well as our child and holiday care services. We also pay a share of EUR 25/month in the Job Ticket Baden-Württemberg. Enjoy a large variety of dishes, snacks, and beverages at our canteens.
Salary
Salary category 13 TV-L, depending on the fulfillment of professional and personal requirements.
Contract duration
limited for three years
Application up to
09.11.2025
Contact person in line-management
For further information, please contact Mr Dr. Pleßow, phone +49 721 608-24413.
Bitte bewerben Sie sich online über den unten stehenden Button für die Ausschreibungsnummer 431/2025.
Ausschreibungsnummer: 431/2025
Wir streben eine möglichst gleichmäßige Besetzung der Arbeitsplätze mit Beschäftigten (w/m/d) an und würden uns daher insbesondere über Bewerbungen von Frauen freuen. Bei gleicher Eignung werden anerkannt schwerbehinderte Menschen bevorzugt berücksichtigt.Kontakt
Bei allgemeinen Fragen zur Bewerbung:
Personalservice (PSE) - Personalbetreuung
Frau Rink
Telefon: +49 721 608-25004,
Karlsruher Institut für Technologie (KIT)
Hermann-von-Helmholtz-Platz 1
76344 Eggenstein-Leopoldshafen