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PhD project themes

Each year we receive funding from UK Research Councils, as well as other sources, such as industry sponsors.

We have a range of research projects with external funding. Check that you meet any specific funding eligibility criteria before applying.

We are also happy to accept applications from UK students who wish to apply for a Postgraduate Doctoral Loan.

The School welcomes international and EU applicants who are either self-funded or have secured funding from an external sponsor.

All applicants should expect to be interviewed by prospective supervisors.

Research projects

We have an extensive list of research projects, listed below, that our supervisors are currently working on. We welcome self-funded applicants interested in these projects.

You are welcome to contact the academics directly for an informal chat, or further information.

Applications should be made via the Cardiff University application service. Quote the project title and supervisor on your application.

In answer to the question ‘How do you plan to fund your studies?’, specify the details and upload any documents providing the evidence (for example: a letter of confirmation of scholarship).

Projects available in catalysis and interfacial science.

SupervisorProject title/s

Professor Graham Hutchings

  • Gold nanoparticles as novel active heterogeneous catalysts
  • Design of selective oxidation and hydrogenation catalysts
  • Design of novel heterogeneous catalysts

Professor Philip Davies

  • Mechanism of photocatalysis and water splitting
  • Surface reaction mechanisms studied with scanning tunnelling microscopy and x-ray photoelectron spectroscopy
  • Nanoparticle stabilisation for heterogeneous catalysis studied with atomic force microscopy and x-ray photoelectron spectroscopy

Professor Stuart Taylor

  • Development of heterogeneous catalysts for environmental protection
  • Heterogeneous catalysts for selective oxidation under mild conditions

Professor Richard Catlow

  • Computational Modelling of Structure and Mechanism of Catalytic Systems
  • Synchrotron Radiation and Neutron Scattering Studies in Catalysis
  • Catalytic Conversion of Carbon Dioxide

Dr Jonathan Bartley

  • New methods for synthesizing metal oxides and mixed metal oxides catalysts
  • Microwave assisted catalysis

Dr Jennifer Edwards

  • Reducing PGM content of heterogeneous catalysts whilst maintaining high activity
  • Biomass valorisation through selective hydrogenation
  • Rapid Synthesis of highly dispersed nanoparticles via microwave synthetic approaches
  • Synthesis of visible light activated antimicrobial/viral nanoparticles
  • Visible light assisted water and air remediation of radical formation

Dr Sankar Meenakshisundaram

  • Supported monometallic and bimetallic nanoparticles catalysts for selective oxidation, selective hydrogenation, coupling reactions and cascade reactions
  • Catalyst development for the valorisation of renewable materials such as CO2, lignocellulosic biomass components (cellulose, hemicellulose and lignin)
  • Towards understanding the structure-activity correlation for catalytic reactions using in situ spectroscopic and kinetic methodologies

Professor Rebecca Melen

  • Radical Approaches to Frustrated Lewis Pairs
  • New p-block Lewis acids for metal-free catalysis
Professor David Willock
  • Periodic DFT calculations for surface catalysis.
  • Monte Carlo and molecular dynamics applied to material properties.
  • Chemical kinetics and mechanism in heterogeneous catalysis.

Dr Alberto Roldan Martinez

  • Circular economy of plastics: catalysts for plastics functionalisation and reuse
  • Innovative heterogeneous catalysts for industially challenging reactions: Biomass valorisation and CO2 utilisation
  • Energy storage: electrolysers and low-temperature ammonia synthesis
  • The last frontier in Computational Chemistry: Unravelling the catalysts' structure-reactivity-durability relationships

Dr Andrew Logsdail

  • Development and application of novel QM, MM and QM/MM methodology
  • Investigation of properties of crystalline materials, and how doping affects these properties
  • Application of materials towards heterogeneous and homogeneous catalysis, such as MTH and biofuel upgrading
  • Simulation of the structure, spectra and reactivity for metal nanoparticles
  • Investigation of the interaction and coupling of multi-compenent catalytic systems (i.e. catalyst, support and solvent), and understanding how this affects reactivity
Dr Thomas Slater
  • Atomic-resolution imaging of catalytic nanoparticles under reaction conditions
  • Development of 3D imaging techniques for nanomaterials using electron microscopy
  • Correlative 3D imaging linking X-ray and electron measurements to understand catalyst structure across length scales
Dr Guto Rhys
  • Enzyme engineering for the green synthesis of molecules
  • Biocatalytic approaches to valorise waste materials
  • Protein design to explore catalysing new-to-nature chemical reactions
Dr Andrea Folli
  • Semiconductor photocatalysts for environmental remediation, biomass valorisation, and water splitting
  • Heterogeneous and hybrid molecular/heterogeneous electrocatalysts and photo-electrocatalysts for the conversion of CO2, ammonia, biomass valorisation, and hydrogen evolution
  • Electrochemistry applied to heterogeneous and homogeneous catalysts
Professor Deborah Kays
  • Complexes of earth abundant transition metals for homogeneous catalysis
  • s-block complexes for homogeneous catalysis

Projects available in materials and energy.

SupervisorsProject title/s

Professor Kenneth Harris

  • Development and application of new strategies for crystal structure determination from powder X-ray diffraction data
  • Understanding fundamentals of crystallization processes by in-situ solid-state NMR
  • Polymorphism in molecular materials
  • Fundamentals and applications of X-ray Birefringence Imaging – a new experimental technique that represents the X-ray analogue of the polarizing optical microscope

Dr Stefano Leoni

  • Crystal Structure Prediction
  • Materials for Energy Storage

Dr Alison Paul

  • Physicochemical characterisation of macromolecules in solution
  • Polymer mediated drug-delivery system
Dr Yi-Lin Wu
  • Heavy metal-free organic redox photosensitizer/photocatalyst
  • Supramolecular control of light-induced properties of molecular materials
  • Organic room-temperature phosphors
  • Functional porous materials
  • New reaction development and mechanistic investigation
Dr Lauren Hatcher
  • Design and understanding of new photoswitchable energy materials via dynamic X-ray diffraction
  • Advanced microcrystallization for serial crystallography at synchrotrons and X-FELs
  • Photocrystallography across the time and length scales: combining single crystal spectroscopy and diffraction studies for in-depth understanding of fast photoswitching phenomena
Professor Deborah Kays
  • Organometallic complexes for energy storage
  • Hydrogen storage materials and catalysis

Projects available in molecular synthesis.

SupervisorProject title/s

Professor Thomas Wirth

  • Development of New Hypervalent Iodine Reagents
  • Iodine-based Catalysis for Drug Synthesis.
  • Microreactor Technology under segmented-flow conditions
  • Flow Electrochemistry for the Green Synthesis of Heterocycles
  • 3D - Printing of New Reactors for Flow Chemistry

Professor Simon Pope

  • Development of luminescent complexes for bioimaging applications
  • Development of hybrid materials for luminescent applications

Dr Angelo Amoroso

  • Development of highly fluorescent lanthanide complexes
  • Design and synthesis of MRI contrast agents

Dr Niklaas Buurma

  • Kinetic and mechanistic studies of Pd-catalysed reactions and their translation to the rational use of enabling technologies
  • Kinetics and mechanistic studies of racemisation of drug-like compounds
  • Optoelectronically active nucleic acid binders as sensitisers in biosensors
  • Directed assembly of functional nanostructures
  • Development of analytical techniques for the design of functional nanostructures
  • Synthesis of optoelectroncically active nucleic acid binders
  • Biophysical studies of nucleic acid binding processes
  • Development of software for the analysis of complex equilibrium systems

Professor Ian Fallis

  • Immuno-histochemical imaging and applications in clinical pathology
  • Synthesis and coordination chemistry of macrocyclic ligands and polydentate Lewis acids

Professor Rebecca Melen

  • Radical approaches to Frustrated Lewis Pairs
  • New p-block Lewis acids for metal-free catalysis

Dr Paul Newman

  • Fused expanded-ring NHCs in coordination chemistry and homogeneous catalysis
  • Development of stereogenic-at-metal complexes for asymmetric catalysis
  • Novel ligand frameworks for the construction of multimetallic systems

Dr Benjamin Ward

  • Asymmetric catalysis using environmentally benign calcium complexes
  • Polymerisation catalysis using Earth-abundant catalysts
  • Polymers containing CO2: benign polymers from abundant feedstocks
  • Asymmetric catalysis using aluminium complexes
Dr Matthew Tredwell
  • Synthetic organic chemistry
  • Organofluorine chemistry
  • Radiochemistry with PET radionuclides
  • Radiotracer design and clinical translation
Dr Fabrizio Pertusati
  • Drug discovery chemistry
  • Synthesis and preclinical evaluation of carbohydrate prodrugs for the treatment of congenital disorders of Glycosylation
  • Design and synthesis of small molecules for the treatment of fungal and parasitic infections
  • Design and synthesis of small molecules for the treatment of lysosomal storage diseases and neurological diseases
  • Synthesis of Drug-conjugates
Dr Heulyn Jones
  • Medicinal chemistry/drug discovery
  • Small molecule therapies for Lysosomal targets
  • Degradation of protein targets (PROTACs, molecular glues etc) and their application to develop therapies for cancer and/or dementia
  • Development of small molecule fluorescent probes to understand the key to healthy ageing
  • Development of synthetic methodology for serendipitus novel reactions
Professor Deborah Kays
  • Structure and reactivity of highly coordinatively and electronically unsaturated complexes
  • Scission and homologation reactions of small molecules, particularly the valorisation of carbon monoxide
  • Multidentate ligand design for heterobimetallic complexes
  • Low-coordinate complexes for single molecule magnetism

Projects available in spectroscopy and dynamics.

SupervisorProject title/s

Professor Damien Murphy

  • Visualisation of weakly interacting molecules in solution by Selective Electron Nuclear DOuble Resonance (ENDOR) spectroscopy
Professor James Platts
  • Metal-protein interactions in Alzheimer's disease
  • Metal-DNA interactions in cancer therapeutics
  • Theoretical studies of non-covalent interactions

Dr Emma Richards

  • EPR spectroscopy of TiO2 photocalalysts
Dr Andrea Folli
  • Electron Paramagnetic Resonance (EPR) spectroscopy and associated hyperfine techniques to study paramagnetic species in heterogeneous and homogenous catalysts, including electron transfer mechanisms and spin dynamics
  • Electrochemical Impedance Spectroscopy to study electron transfer and charge dynamics in photocatalysts and electrocatalysts
  • Development of hardware and novel experimental protocols for operando-EPR and electrochemical-EPR