1 citations · 1 across the 2 of their papers we have counts for
4 papers
The Effect of Crystal Symmetries on the Locality of Screw Dislocation Cores
Julian Braun, Maciej Buze, Christoph Ortner
In linearised continuum elasticity, the elastic strain due to a straight dislocation line decays as , where denotes the distance to the defect core. It is shown in E…
Incommensurate Heterostructures in Momentum Space
Daniel Massatt, Stephen Carr, Mitchell Luskin +1
To make the investigation of electronic structure of incommensurate heterostructures computationally tractable, effective alternatives to Bloch theory must be developed. In Massatt…
Polytypism in the ground state structure of the Lennard-Jonesium
Lívia B. Pártay, Christoph Ortner, Albert P. Bartók +2
We present a systematic study of the stability of nineteen different periodic structures using the finite range Lennard-Jones potential model discussing the effects of pressure, po…
A universal preconditioner for simulating condensed phase materials
David Packwood, James Kermode, Letif Mones +5
We introduce a universal sparse preconditioner that accelerates geometry optimisation and saddle point search tasks that are common in the atomic scale simulation of materials. Our…