Visualising potential energy surfaces using dimensionality reduction
25 November 2021
Computational structure prediction has emerged as a highly successful approach to the discovery of new materials. Candidate structures are created by constructing the most stable configurations that can be adopted by a given...
The elements of life under pressure
1 July 2021
First-principles structure prediction sheds light on high-pressure compounds formed from carbon, hydrogen, nitrogen and oxygen.
AIRSS for battery cathode materials
15 June 2021
A team of researchers at Cambridge and University College London have developed a computational framework for battery cathode exploration based on ab initio random structure searching.
Anatase-like Grain Boundary Structure in Rutile Titanium Dioxide
30 April 2021
A collaboration between researchers at Cambridge and AIMR has shed light on grain boundary structures in titania.
Physics World Breakthrough of the Year finalists for 2020
17 December 2020
A paper coauthored by Chris Pickard and Bartomeu Monserrat has been selected as a Top 10 finalist in Physics World's breakthroughs of the year for 2020.
An upper limit for the speed of sound
17 November 2020
A collaboration involving Bartomeu Monserrat and Chris Pickard was featured on both the University website and the Department website .
17 November 2020
Congratulations to Chuck Witt, who began recently as a Schmidt Science Fellow and as a Junior Research Fellow at Christ's College, Cambridge! The Schmidt award is intended to catalyze new research directions and...
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