1 dag geleden - Technische Universiteit Eindhoven - Eindhoven
numerically-oriented PhD student position in Unraveling the effect of microstructure statistics on failure of multi-phase steels.(UNFAIL) A PhD vacancy is av…
Modelling the piezo- and ferroelectric properties of metal-organic frameworks
The PhD position is part of a larger project in which ferroelectrics based on metal-organic frameworks will be developed. Ferroelectrics are here targeted to be used as physically flexible memories and mechanical energy harvesters. These can be used in (biocompatible) sensors for the Internet of Things. The European Research Council has awarded a prestigious ERC Starting Grant to Monique A. van der Veen for this research.
You will work in a team of experimentalists and theorists to achieve this common goal. Your specific PhD project is focused on modelling the piezo- and ferroelectric properties of metal-organic frameworks. You will use quantum mechanical methods and develop more empirical methods so that you can screen potentially good piezo-and ferroelectrics from larger libraries of MOFs. Collaboration with the experimental team members will be vital for your research. You will use their experimental results to verify and refine your methods, and in return use your results to suggest potentially good ferroelectrics for synthesis. If you are interested, the project can have an experimental component where you also gather electronic characterisation data that you use to benchmark your theoretical models.
The candidate must hold an MSc degree in Chemistry, Chemical Engineering, Materials Science, Physics or an equivalent field. The candidate must have a keen interest in theory and the analysis and interpretation of complex, experimental data.
Delft University of Technology (the TU Delft) is a multifaceted institution offering education and carrying out research in the technical sciences at an internationally recognised level. Education, research and design are strongly oriented towards applicability. The TU Delft develops technologies for future generations, focusing on sustainability, safety and economic vitality. At the TU Delft you will work in an environment where technical sciences and society converge. The TU Delft comprises eight faculties, unique laboratories, research institutes and schools.
The Department of Chemical Engineering promotes the pursuit and dissemination of knowledge in chemical engineering, with a focus on materials for energy and health applications. We aspire to improve the quality of life in a sustainable society through discovery and innovation, the quality of life of our graduates through inspiration and teaching, and the quality of life of our peers through collaboration and exchange. With a proud heritage in chemical engineering, the department seeks to break new ground in areas where molecular understanding and engineering design meet.
The PhD student will work under the guidance of Monique A. van der Veen and collaborate with Francois-Xavier Coudert. The van der Veen group focuses on the development of metal-organic frameworks for photocatalysis and electronics. An important component of research in the van der Veen group is the use of advanced optical spectroscopy to gain new insight into the structure and function of nanoporous materials. Francois-Xavier Coudert's group from Chimie ParisTech in Paris is a computational chemistry group that is leading in the modelling of the flexibility of metal-organic frameworks.