Computational Chemistry PhD Research Projects PhD Projects, Programmes & Scholarships in the UK

We have 107 Computational Chemistry PhD Research Projects PhD Projects, Programmes & Scholarships in the UK

Application of Linear-Scaling Quantum Mechanics Methods to Hydrogen Transport Through Complex Materials

University of Southampton Faculty of Engineering and Physical Sciences

Supervisory Team. Chris-Kriton Skylaris (80%) Jeremy Frey (20%). Project Description. The computational simulation of chemical reactions in materials requires an accurate, explicit description of their electrons. Read more

Supervisor: Prof C K Skylaris

31 August 2024 PhD Research Project Competition Funded PhD Project (UK Students Only)

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Design and Synthesis of Peptide-derived Receptors for Binding Small Molecules

University of Edinburgh School of Chemistry

A PhD studentship is available in the groups of Prof. Scott Cockroft and Dr Annamaria Lilienkampf School of Chemistry, The University of Edinburgh; https://www.cockroft.chem.ed.ac.uk in collaboration with DSTL. Read more

Supervisors: Prof S L Cockroft, Dr AL Lilienkampf

Year round applications PhD Research Project Funded PhD Project (European/UK Students Only)

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Electron Driven Chemistry in the Interstellar Medium

University of Edinburgh School of Chemistry

A PhD studentship is available joint between the groups of Cate Anstöter and Ewen Campbell, School of Chemistry, University of Edinburgh, see https://isla-edi.com/ . Read more

Supervisors: Dr C Anstoter, Dr E Campbell

30 August 2024 PhD Research Project Funded PhD Project (UK Students Only)

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Soft & Crystalline Composite Materials: Developing Total Scattering Workflows for the Interrogation of Structure.

University of Birmingham School of Chemistry

An exciting interdisciplinary project for an enthusiastic student to develop a broad range of expertise, combining the experimental and computationally-based characterisation of advanced composite materials. Read more

Supervisor: Dr T Easun

30 May 2024 PhD Research Project Funded PhD Project (European/UK Students Only)

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Accurate and Efficient Modelling of X-ray Spectra for the Nuclear Fuel Cycle

The University of Manchester Department of Chemistry

Leading nations are transitioning to renewable energy and reducing carbon emissions with a major focus on increasing resource efficiency and sustainability. Read more

Supervisors: Dr M Oakley, Dr M Baker

26 April 2024 PhD Research Project Competition Funded PhD Project (Students Worldwide)

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The Physical Organic Chemistry of Non-covalent interactions and Solvent Effects

University of Edinburgh School of Chemistry

A PhD studentship is available in the group of Professor Scott Cockroft, School of Chemistry, the University of Edinburgh, see https://www.cockroft.chem.ed.ac.uk. Read more

Supervisor: Prof S L Cockroft

Year round applications PhD Research Project Funded PhD Project (Students Worldwide)

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Polymeric materials in extreme environments: An exploration of polymer network structure in high-performance epoxy-amine thermosets for use in marine environments (Ref:RDFC24/HLS/APP/UNTHANK)

Northumbria University Faculty of Health and Life Sciences

This fully funded PhD studentship will explore the fundamental material, molecular and network-forming properties that deliver optimal performance in epoxy-amine thermoset polymer coatings. Read more

Supervisors: Prof M Unthank, Dr M Sims

29 April 2024 PhD Research Project Funded PhD Project (UK Students Only)

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Ageing Assessment of Transformer Insulation Systems through Molecular Dynamic Simulation

The University of Manchester Department of Electronic and Electrical Engineering

The accurate assessment of the remaining lifetime of transformer insulation systems has always been a challenge faced by the transformer industry. Read more

Supervisors: Prof Z.D Wang, Dr S Matharage

30 April 2024 PhD Research Project Funded PhD Project (Students Worldwide)

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Digital Routes to Next Generation Solid Oxide Electrolysis Cells

University of Liverpool Department of Chemistry

A key technology in the drive towards net-zero emissions is the production of green hydrogen by electrolysis powered by renewable energy. Read more

Supervisors: Prof M J Rosseinsky, Dr B Peng

30 June 2024 PhD Research Project Funded PhD Project (Students Worldwide)

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Digital Exploration of Novel Polymeric Materials for Structural Composites

University of Liverpool Department of Chemistry

Structural composites materials are used in a vast number of applications from aerospace to sport and recreation. Read more

Supervisors: Dr N Berry, Dr T Hasell

30 June 2024 PhD Research Project Funded PhD Project (Students Worldwide)

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Computational exploration of substrates and interfaces for thin film solar cells

University of Liverpool Department of Chemistry

To address the challenge of net-zero carbon a diverse energy generation landscape is required of which photovoltaics (PV) is a major constituent. Read more

Supervisors: Dr M Dyer, Dr T Manning

31 May 2024 PhD Research Project Funded PhD Project (Students Worldwide)

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AI-directed discovery of self-assembled peptide-peptoid acoustics materials

University of Strathclyde Department of Pure and Applied Chemistry

Overview. Read more

Supervisors: Dr K.H.A Lau, Prof T Tuttle

Year round applications PhD Research Project Funded PhD Project (UK Students Only)

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Operando Photoelectrochemical-X-Ray-Spectroscopies-Led Rational Discovery of New Pyrochlore Oxides for Water Electrolysis (DIA24/EE/MPEE/TIWARI)

Northumbria University Faculty of Engineering and Environment

The Scientific Premise. Amid escalating climate changes linked to global warming, the quest to efficiently convert solar energy into chemical fuel has never been more critical. Read more

Supervisor: Dr D Tiwari

7 May 2024 PhD Research Project Funded PhD Project (UK Students Only)

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Property-driven generative machine learning for tailored materials design

University of Warwick Department of Chemistry

A fully funded 4-year PhD project in property-driven generative machine learning for tailored materials design is available with a flexible 2023-2024 start date. Read more

Supervisor: Dr R J Maurer

17 May 2024 PhD Research Project Funded PhD Project (Students Worldwide)

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Molecular Simulations and Data-driven Modelling for Polymer Nanocomposite Membranes

University of Edinburgh School of Engineering

The urgent need to mitigate climate change has led to increased focus on sustainable energy solutions. This includes the development of mixed matrix membranes (MMMs) for gas separation in net-zero applications. Read more

Supervisor: Dr ER Ricci

26 May 2024 PhD Research Project Funded PhD Project (Students Worldwide)

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We have 107 Computational Chemistry PhD Research Projects PhD Projects, Programmes & Scholarships in the UK

Computational Chemistry PhD Research Projects PhD Projects, Programmes & Scholarships in the UK

We have 107 Computational Chemistry PhD Research Projects PhD Projects, Programmes & Scholarships in the UK

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