activity
19952023
most citedScalable Quantum Simulation of Molecular Energies

806 citations · 4.3k across the 83 of their papers we have counts for

collaborators
Showing 2014Show all

5 papers · 1 filter

cs.DC2014

Weighted decomposition in high-performance lattice-Boltzmann simulations: are some lattice sites more equal than others?

Derek Groen, David Abou Chacra, Rupert W. Nash +3

Obtaining a good load balance is a significant challenge in scaling up lattice-Boltzmann simulations of realistic sparse problems to the exascale. Here we analyze the effect of wei…

cond-mat.soft2014★ 70 cited

Assembling Ellipsoidal Particles at Fluid Interfaces using Switchable Dipolar Capillary Interactions

Gary B. Davies, Timm Krueger, Peter V. Coveney +2

The fabrication of novel soft materials is an important scientific and technological challenge. We investigate the response of magnetic ellipsoidal particles adsorbed at fluid-flui…

cond-mat.soft2014★ 68 cited

Detachment Energies of Spheroidal Particles from Fluid-Fluid Interfaces

Gary B. Davies, Timm Krüger, Peter V. Coveney +1

The energy required to detach a single particle from a fluid-fluid interface is an important parameter for designing certain soft materials, for example, emulsions stabilised by co…

cond-mat.soft2014★ 151 cited

Deformability-based red blood cell separation in deterministic lateral displacement devices - a simulation study

Timm Krüger, David Holmes, Peter V. Coveney

We show, via three-dimensional immersed-boundary-finite-element-lattice-Boltzmann simulations, that deformability-based red blood cell (RBC) separation in deterministic lateral dis…

cond-mat.soft2014★ 41 cited

Interface deformations affect the orientation transition of magnetic ellipsoidal particles adsorbed at fluid-fluid interfaces

Gary B. Davies, Timm Krüger, Peter V. Coveney +2

Manufacturing new soft materials with specific optical, mechanical and magnetic properties is a significant challenge. Assembling and manipulating colloidal particles at fluid inte…