26 citations · 26 across the 2 of their papers we have counts for
3 papers
Polyepitaxial grain matching to study the oxidation of uranium dioxide
Jacek Wasik, Joseph Sutcliffe, Renaud Podor +15
Although the principal physical behaviour of a material is inherently connected to its fundamental crystal structure, the behaviours observed in the real-world are often driven by…
High pressure ionic and molecular crystals of ammonia monohydrate within density functional theory
Gareth I. G. Griffiths, Alston J. Misquitta, A. Dominic Fortes +2
A combination of first-principles density functional theory calculations and a search over structures predicts the stability of a proton-transfer modification of ammonia monohydrat…
Post-Cotunnite phase of TeO2
Gareth I. G. Griffiths, Chris J. Pickard, R. J. Needs
We have used first-principles density-functional-theory methods with a random-structure-searching technique to determine the structure of the previously unidentified post-cotunnite…