Research project

Beyond design and discovery of materials – navigating chemical space for function

Staff

Lead researchers

Professor Graeme Day

Professor of Chemical Modelling

Research interests

  • crystal structure prediction
  • materials discovery
  • computational chemistry
Connect with Graeme

Collaborating research institutes, centres and groups

Research outputs

Patrick Walter Villers Butler, Roohollah Hafizi & Graeme M. Day, 2024, Journal of Physical Chemistry A, 128(5), 945–957
Type: article