Professor Nora De Leeuw
Prosiectau fel Prif Ymchwiliwr
1 o 2
- A co-ordinated, comprehensive approach to carbon capture and utilisation (01.01.2015 - 06.09.2017)
- Bio-inspired sulphide nanocatalysts: From proof of concept to 'real' catalysis (01.01.2015 - 31.10.2017)
- Computational catalysis: A sustainable UK-South Africa partnership in high performance computing (08.11.2015 - 07.05.2019)
- Energy materials: Computational solutions (01.02.2015 - 19.05.2019)
- EPSRC GCRF Institutional Sponsorship Funding (01.07.2017 - 31.03.2018)
Prosiectau fel Cyd-Ymchwiliwr
1 o 2
- Materials Chemistry High End Computing Consortium (01.11.2013 - 31.10.2018)
- A computational study exploring the molecular basis of anaesthesia (02.04.2018 - 31.03.2022)
- Computational Nano-materials and Catalysis (01.10.2017 - 30.09.2020)
- Computational study of zeolites as catalysts for the chemical conversion of lignin-derived compounds (07.04.2014 - 30.03.2018)
- Computer aided design of conducting polymers for solar cell application (01.10.2016 - 30.09.2019)
Setiau Data Ymchwil
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- Adsorption of Oxygen on Low Miller index Surfaces of hcp Cobalt - Farkas B, Cadi-Essadek A, Santos Carballal D, et al. (2018). Cardiff University. 10.17035/d.2018.0052762507. Computational chemistry Molecular modelling Charge Density
- Altering the conductivity of CuO through the formation of intrinsic defects - data - Živković A, de Leeuw NH (2020). Cardiff University. 10.17035/d.2019.0089582693. Photovoltaic Systems Materials Sciences
- Atomistic molecular dynamics simulations of propofol and fentanyl in phosphatidylcholine lipid bilayers - data - Faulkner C, Santos-Carballal D, Plant DF, et al. (2020). Cardiff University. 10.17035/d.2020.0092362446. Molecular dynamics Computational chemistry Lipid Bilayers
- AuCo nanoparticles: ordering, magnetisation, and morphology trends predicted by DFT - data - Farkas B, de Leeuw NH (2022). Cardiff University. 10.17035/d.2022.0164147661. Computational chemistry
- Behaviour of S, SO and SO3 on Pt (001), (011) and (111) surfaces: A DFT Study - data - Ungerer MJ, van Sittert CGCE, de Leeuw NH (2021). Cardiff University. 10.17035/d.2021.0126222709. Monolayer Surfaces Adsorption Intramolecular Interactions Simulations
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