Monday 8th September Time Chair : Steve Parker 12.55-13.00 13.00-13.45 Speaker/Event Title Steve Parker Neil Allan 13.45-14.10 Patrick Kiley 14.10-14.35 Stephen Yeandel 14.35-15.00 Dmytro Antypov Welcome from CCP5 chair Some adventures over energy landscapes of oxides, phosphides and nitrides. Effect of Interfacial Energy on Nanostructure and Dynamics: Solvent Stress and Solute Strain. Modelling the Thermal Conductivity of Nanostructured Oxide Materials. Modelling structural transitions and adsorption in peptide-based porous materials. 15.00-15.30 Refreshments Chair : Colin Freeman 15.30-15.55 Sergey Karabasov 15.55-16.20 Carlos Avendano 16.20-16.45 David Cooke 16.45-17.10 Jasmine Desmond 17.10-17.35 Ricardo Grau-Crespo 19.30 Dinner in Restaurant Concurrent multiscale modelling of atomistic and hydrodynamic processes in liquids. Directed self-assembly of anisotropic colloidal particles via confinement Atomistic Simulation of the Interaction of amino acids and peptides with magnetites surfaces. Adsorption at the Aqueous Electrolyte-Natively Oxidised Silicon Interface. Tuning the properties of 2D carbon-doped boron nitride via compositional and configurational optimisation