DAY RESEARCH GROUP SITE

Computational materials discovery

Graeme Day

Professor of Chemical Modelling

Chemistry, University of Southampton

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Our group develops computational approaches to improve our understanding of molecular materials, and to accelerate the discovery of functional materials.

A central method to our work is crystal structure prediction, computational methods to predict how molecules pack from first principles.

The is a wide range of work going on in the group. See below for more (some of the sections are still in development).