Publications en collaboration avec des chercheurs de Imperial College London (18)

2023

  1. Microstructure-driven annihilation effects and dispersive excited state dynamics in solid-state films of a model sensitizer for photon energy up-conversion applications

    Chemical Science, Vol. 14, Núm. 8, pp. 2009-2023

2022

  1. Electronic Conduction Channels Engineered in Topological Insulator Sputtered Thin Films

    ACS Applied Electronic Materials, Vol. 4, Núm. 12, pp. 5789-5798

2021

  1. Anomalous Motion of Charged Domain Walls and Associated Negative Capacitance in Copper–Chlorine Boracite

    Advanced Materials, Vol. 33, Núm. 16

2020

  1. Entropic bonding of the type 1 pilus from experiment and simulation

    Royal Society Open Science, Vol. 7, Núm. 4

  2. The CECAM electronic structure library and the modular software development paradigm

    The Journal of chemical physics, Vol. 153, Núm. 2, pp. 024117

2018

  1. Mechanical architecture and folding of E. coli type 1 pilus domains

    Nature Communications, Vol. 9, Núm. 1

2017

  1. Acoustic terahertz graphene plasmons revealed by photocurrent nanoscopy

    Nature Nanotechnology, Vol. 12, Núm. 1, pp. 31-35

2016

  1. Continuous melting through a hexatic phase in confined bilayer water

    Physical Review E, Vol. 93, Núm. 6

  2. Enhanced Configurational Entropy in High-Density Nanoconfined Bilayer Ice

    Physical Review Letters, Vol. 116, Núm. 8

  3. Harnessing a Quantum Design Approach for Making Low-Loss Superlenses

    Nano Letters, Vol. 16, Núm. 3, pp. 1609-1613

  4. Structural and configurational properties of nanoconfined monolayer ice from first principles

    Scientific Reports, Vol. 6

2015

  1. Model of two-dimensional electron gas formation at ferroelectric interfaces

    Physical Review B - Condensed Matter and Materials Physics, Vol. 92, Núm. 3

2013

  1. Vortex state suppression in a hexagonal array of interacting py triangular rings

    Acta Physica Polonica A

2010

  1. Electronic structure computations of Newton Black Films

    Journal of Materials Chemistry, Vol. 20, Núm. 46, pp. 10351-10358

2004

  1. Simulations of minerals using density-functional theory based on atomic orbitals for linear scaling

    Physics and Chemistry of Minerals, Vol. 31, Núm. 1, pp. 12-21

2002

  1. The SIESTA method for ab initio order-N materials simulation

    Journal of Physics Condensed Matter, Vol. 14, Núm. 11, pp. 2745-2779

2000

  1. A computational exploration of cation locations in high- silica Ca-chabazite

    Studies in Surface Science and Catalysis, Vol. 128, pp. 89-98

  2. The structure and dynamics of crystalline durene by neutron scattering and numerical modelling using density functional methods

    Chemical Physics, Vol. 261, Núm. 1-2, pp. 189-203