Computational Chemistry (tax) PhD Projects, Programmes & Scholarships

We have 18 Computational Chemistry (tax) PhD Projects, Programmes & Scholarships

Atomistic Simulations of Surface Chemistry underpinning the Atomic-Scale Processing of Materials for AI-driven Nanoelectronics Applications

University of Warwick Department of Chemistry

Project description. Atomic layer deposition (ALD) and atomic layer etching (ALE) are crucial technologies in semiconductor processing, especially as nanoelectronics devices become smaller and more complex. Read more

Supervisor: Dr BK Karasulu

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

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PhD Studentship: Polyoxoniobates for Catalysis in Green Chemical Processes

Newcastle University School of Natural and Environmental Sciences

Award summary . 100% fees covered, and a minimum tax-free annual living allowance of £19,237 (2024/25 UKRI rate). The studentship includes attendance at international conferences and annual placements at Mitsubishi Chemical UK, Wilton. . Read more

Supervisor: Dr R.J. Errington

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

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PhD Studentship in Understanding non-equilibrium dynamics using Quantum dynamics

Newcastle University School of Natural and Environmental Sciences

Award summary . 100% of home fees covered, and a minimum tax-free annual living allowance of £19,237 (2024/25 UKRI rate). . Read more

Supervisor: Prof T J Penfold

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

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Uncertainty quantification for machine learning models of chemical reactivity

University of Nottingham School of Chemistry

In this PhD project, we will develop and implement approaches for estimating the uncertainty in AI predictions of chemical reactivity, to help strengthen the interaction between human chemists and machine learning algorithms and to assess when AI predictions are likely to be correct and when, for example, first principles quantum chemical calculations might be helpful. Read more

Supervisors: Prof J D Hirst, Dr S Preston

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

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In Silico targeting of unstructured extracellular histones: En route to a new horizon of drug discovery to target disordered proteins) – second call for applications

Maastricht University Cardiovascular Research Institute Maastricht (CARIM)

Applications can only be submitted via our website. The specific position for Doctoral Candidate 6 (DC6) in the consortium, which is part of Work Package 2 (WP2), aims. Read more

Supervisor: Dr G Nicolaes

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

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Pushing the scale boundaries for degradation simulations of industrially relevant materials

University of Southampton Chemistry

Supervisory Team: Chris-Kriton Skylaris. 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

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

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3 Year Funded Kennedy Trust IMPACT Inflammation MB-PhD

The University of Manchester Faculty of Biology, Medicine and Health

Combine the vocational training of a medical degree with the research expertise of a PhD. The Kennedy Trust IMPACT Inflammation MB-PhD is a funded three-year programme for undergraduate medical students who wish to train as clinician scientists. Read more

Funded PhD Programme (Students Worldwide) Clinical PhD Programme

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Understanding shale rock swelling for energy systems: novel integrated modelling and experimental approaches

The University of Manchester Department of Chemistry

A fully funded PhD position is available in the group of Professor Carbone (Department of Chemistry) and Professor Taylor (Department of Earth Science) at the University of Manchester starting from September 2024. Read more

Supervisors: Dr P Carbone, Prof K Taylor

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

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Using Natural Language Processing and molecular simulations to build polymer databases

The University of Manchester Department of Chemistry

A fully funded PhD position in multiscale modelling of polymer composites is available in the group of Professor Carbone at the University of Manchester from October 2024. Read more

Supervisor: Dr P Carbone

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

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Design and Evolution of Enzymes with New Catalytic Functions

The University of Manchester Department of Chemistry

A fully funded studentship is available, based at the Manchester Institute of Biotechnology under the supervision of Prof Anthony Green. Read more

Supervisor: Prof A Green

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

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Building Enzymes with New Catalytic Functions & Design and Evolution of Enzymes with New Catalytic Functions

The University of Manchester Department of Chemistry

A fully funded studentship is available, based at the Manchester Institute of Biotechnology under the supervision of Prof Anthony Green. Read more

Supervisor: Prof A Green

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

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Development of NMR Methods for the Study of Dynamics in Solids

University of Liverpool Department of Chemistry

One fully funded PhD studentship is available in the area of nuclear magnetic resonance (NMR) of solids. The position is available for 42-months starting in October 2024. Read more

Supervisor: Prof F Blanc

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

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High-throughput characterization and engineering of nucleotide synthases for production of nucleoside analogues

The University of Manchester Department of Chemistry

Nucleotides are the building blocks of life, modulating diverse processes from protein production to cell signalling. It is therefore unsurprising that synthetic nucleoside analogues have been developed as therapeutics for the treatment of a wide range of diseases including cancers and viral infections. Read more

Supervisors: Dr S Lovelock, Dr C Markin

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

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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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EPSRC Doctoral Training Partnership 2024/25: Chemistry

University of Leeds Faculty of Engineering and Physical Sciences

Research Group: School of Chemistry

Becoming an innovator in the School of Chemistry at the University of Leeds!. For 2024/25 entry, we are offering you the opportunity to join our thriving community of leading researchers within the School of Chemistry. Read more

Supervisor: Ms L Moyles

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

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We have 18 Computational Chemistry (tax) PhD Projects, Programmes & Scholarships

Computational Chemistry (tax) PhD Projects, Programmes & Scholarships

We have 18 Computational Chemistry (tax) PhD Projects, Programmes & Scholarships

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