Research Fellow in Theoretical Quantum Chemistry

About the role

This post is available to join an exciting new research team developing novel electronic structure theory at University College London. The objective of this research is to develop accurate and low-scaling computational methods to predict open-shell ground and excited electronic states in molecules. This project builds on our group’s recent advances in low-spin open-shell mean-field theory by investigating the inclusion of electron correlation through effective many-body interactions and the integration with density functional approximations. This project will combine pen-and-paper theory with the design and implementation of computational algorithms, and will include applications to ground-state properties and the electronic spectra of open-shell molecules.

The appointee will also share responsibility for designing and maintaining research software within the group, and assisting the development of future funding proposals.

The appointment is for 24 months, starting as soon as possible. The candidate will join the Molecular Quantum Theory Group led by Dr Hugh Burton in the Department of Chemistry at the Bloomsbury Campus of University College London.

Information about the group can be found at

About you

The postholder will be required to carry out research into:

• Prediction of excited-state energy surfaces and spectra using open-shell mean-field theory • Quasiparticle theory of open-shell diradicals and polyradicals

• Integration of open-shell mean-field theory with density functional approximations Key Requirements The successful candidates will have a PhD degree (or be about to be awarded a PhD) in an area of Theoretical Chemistry, Physics, or a related subject.

The successful candidates will be required to work in a collaborative team and have effective written and verbal communication skills in English.

What we offer

As well as the exciting opportunities this role presents, we also offer some great benefits some of which are below:

• 41 Days holiday (27 days annual leave 8 bank holiday and closure days)

• Additional 5 days’ annual leave purchase scheme defined benefit career average revalued earnings pension scheme (CARE)

• Cycle to work scheme and season ticket loan

• Immigration Loan Relocation scheme for certain posts

• On-Site nursery

• On-Site gym

• Enhanced maternity, paternity and adoption pay

• Employee assistance programme: Staff Support Service Discounted medical insurance