Nora De Leeuw - Dissemin

Papers authored by Nora De Leeuw

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2019 Longfei Wu

, Alessandro Longo, Nelson Y. Dzade

, Akhil Sharma

, Marco M. R. M. Hendrix, Ageeth A. Bol

, Nora H. Leeuw

, Emiel J. M. Hensen

, Jan P. Hofmann

The Origin of High Activity of Amorphous MoS 2 in the Hydrogen Evolution Reaction

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Saeedeh S. Tafreshi

, Alireza Z. Moshfegh

, Nora H. de Leeuw

Mechanism of Photocatalytic Reduction of CO2 by Ag3PO4(111)/g-C3N4 Nanocomposite: A First-Principles Study

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This paper was not found in any repository; the policy of its publisher is unknown or unclear.

Thobani G. Gambu

, Umberto Terranova

, David Santos-Carballal, Melissa A. Petersen

, Glenn Jones, Eric van Steen

, Nora H. de Leeuw

Thermal Properties and Segregation Behavior of Pt Nanowires Modified with Au, Ag, and Pd Atoms: A Classical Molecular Dynamics Study

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Fabrizio Silveri

, Matthew G. Quesne

, Alberto Roldan

, Nora H. de Leeuw

, C. Richard A. Catlow

Hydrogen adsorption on transition metal carbides: a DFT study

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Hamid Mehdipour, Brendan A. Smith, Ali T. Rezakhani, Saeedeh S. Tafreshi

, Nora H. de Leeuw

, Oleg V. Prezhdo

, Alireza Z. Moshfegh

, Alexey V. Akimov

Dependence of electron transfer dynamics on the number of graphene layers in π-stacked 2D materials: insights from ab initio nonadiabatic molecular dynamics

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Emilia Olsson

, Jonathon Cottom

, Xavier Aparicio-Anglès

, Nora H. de Leeuw

Computational study of the mixed B-site perovskite SmBxCo1−xO3−d (B = Mn, Fe, Ni, Cu) for next generation solid oxide fuel cell cathodes

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This paper is made freely available by the publisher.

Louise M. Botha

, David Santos-Carballal

, Umberto Terranova

, Matthew G. Quesne

, Marietjie J. Ungerer

, Cornelia G. C. E. van Sittert

, Nora H. de Leeuw

Mixing thermodynamics and electronic structure of the Pt_1−xNi_x(0 ≤x≤ 1) bimetallic alloy

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Anna Roffey

, Nathan Hollingsworth, Husn-Ubayda Islam, Wim Bras

, Gopinathan Sankar, Nora H. de Leeuw

, Graeme Hogarth

Fe(ii) and Fe(iii) dithiocarbamate complexes as single source precursors to nanoscale iron sulfides: a combined synthetic and in situ XAS approach

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Claire E. Mitchell

, Umberto Terranova

, Ihfaf Alshibane, David J. Morgan

, Thomas E. Davies

, Qian He, Justin S. J. Hargreaves, Meenakshisundaram Sankar

, Nora H. de Leeuw

Liquid phase hydrogenation of CO2 to formate using palladium and ruthenium nanoparticles supported on molybdenum carbide

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Matthew G. Quesne

, Alberto Roldan

, Nora H. de Leeuw

, C. Richard A. Catlow

Carbon dioxide and water co-adsorption on the low-index surfaces of TiC, VC, ZrC and NbC: a DFT study

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Alberto Roldan

, Nora H. de Leeuw

A density functional theory study of the hydrogenation and reduction of the thio-spinel Fe3S4{111} surface

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2018 Hamid Mehdipour, Alexey V. Akimov

, Joanna Jankowska

, Ali T. Rezakhanai, Saeedeh S. Tafreshi

, Nora H. de Leeuw

, Alireza Z. Moshfegh

, Oleg V. Prezhdo

Persistent Quantum Coherence and Strong Coupling Enable Fast Electron Transfer across the CdS/TiO2 Interface: A Time-Domain ab Initio Simulation

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Abdelaziz Cadi-Essadek

, Alberto Roldan, Xavier Aparicio-Anglès, Nora H. de Leeuw

CO2 and H2 Adsorption and Reaction at Nin/YSZ(111) Interfaces: A Density Functional Theory Study

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Umberto Terranova

, Claire Mitchell, Meenakshisundaram Sankar, David Morgan

, Nora H. de Leeuw

Initial Oxygen Incorporation in the Prismatic Surfaces of Troilite FeS

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Sergio Posada-Pérez

, David Santos-Carballal

, Umberto Terranova

, Alberto Roldan

, Francesc Illas

, Nora H. de Leeuw

CO2 interaction with violarite (FeNi2S4) surfaces: a dispersion-corrected DFT study

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Lisa A. Richards

, Anthony Nash, Max Phipps

, Nora H. de Leeuw

, Nora Henriette De Leeuw

A Molecular Dynamics Study of Plasticiser Migration in Nitrocellulose Binders

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James T. Pegg

, Ashley E. Shields

, Mark T. Storr, Andrew S. Wills, David O. Scanlon

, Nora H. de Leeuw

Hidden magnetic order in plutonium dioxide nuclear fuel

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Lisa A. Richards

, Anthony Nash, Andrew Willetts, Chris Entwistle, Nora H. de Leeuw

Modelling water diffusion in plasticizers: development and optimization of a force field for 2,4-dinitroethylbenzene and 2,4,6-trinitroethylbenzene

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Albert Aniagyei

, Nelson Y. Dzade

, Richard Tia

, Evans Adei, C. R. A. Catlow, Nora H. de Leeuw

Ab initio investigation of O2 adsorption on Ca-doped LaMnO3 cathodes in solid oxide fuel cells

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Nelson Y. Dzade

, Nora H. de Leeuw

Density functional theory characterization of the structures of H3AsO3 and H3AsO4 adsorption complexes on ferrihydrite

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Papers authored by Nora De Leeuw