The studentship will cover fees up to €5,500k pa and a tax-free stipend of €18,500k pa from Sept/October 2019 for four years. Funding is also available for training and travel as part of the studentship.
Terahertz spectroscopy of 2,4,6-trinitrotoluene molecular solids from first principles: Beilstein J. Org. Chem., 2018, 14, 381–388.
Use of crystal structure informatics for defining the conformational space needed for predicting crystal structures of pharmaceutical molecules: J. Chem. Theory Comput., 2017, 13, 5163–5171.
First-Principles Modeling of Molecular Crystals: Structures and Stabilities, Temperature and Pressure: WIRES Comp. Mol. Sci., 2017, 7, e1294.
Role of Dispersion Interactions in the Polymorphism and Entropic Stabilization of the Aspirin Crystal. Phys. Rev. Lett., 2014, 113, 055701.