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wales1_2015

Self-assembly of mesoscopic structures and nanodevices

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wales2_2015

Free energy landscapes and observation time scales

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wales3_2015

Structure prediction and machine learning for variable pathogens

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sprik1_2015

Density functional theory modelling of electric double layers at oxide/electrolyte interfaces

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sprik2_2015

Development of a single electrode electrochemical cell

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sprik3_2015

Activation of the discharge of species adsorbed on oxide surfaces

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sr_elliott1_2015

Heat control in electronic circuits at the nanoscale

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jenkins1_2015

Non-Collinear Magnetism at Chiral Surfaces

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csanyi_alavi1_2015

Parametrisation of electronic energies via reduced density matrices using machine learning techniques

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jenkins2_2015

Kinetics of Surface Reconstruction

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pickard1_2015

The future of materials visualisation

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pickard2_2015

Structure prediction of interfaces in two-dimensional materials

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pickard3_2015

Structure determination of interfaces in complex oxides

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ja_elliott1_2015

Compaction and flow of organic crystalline powder materials

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ja_elliott2_2015

Mechanical, electrical and thermal properties of carbon nanotube fibres

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ja_elliott3_2015

Multiscale modelling of nanoparticle interactions in rubbers

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artacho1_2015

Theory and simulation of electronic stopping power for radiation damage

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artacho3_2015

Electrons in materials with two-dimensional confinement

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morris1_2015

Ab initio battery materials discovery

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morris2_2015

Defects in simple oxides and semiconductors

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cole1_2015

Materials Discovery for Dye-Sensitized Solar Cells: Coupling Data-Mining with Machine Learning

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cole2_2015

Predicting New Materials for Magnetism: Employing Data Science with Machine Learning

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cole3_2015

Functionalising the Dye-Sensitized Solar Cell : Molecular Dynamics of Dye/TiO2 Interfaces

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rosana1_2015

A new multi-scale model to explore the link between epigenomes and genome organization at the nanoscale level

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rosana2_2015

A new computational strategy to learn how to rationally design novel chromatin nanostructures

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rosana_keyser_2015

Computer simulations to design new responsive DNA origami nanopores

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conduit_2015

Inter-atomic forces in Quantum Monte Carlo

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payne_hasnip_2015

Accelerating first-principles simulations on emerging computer architectures

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