Physical Chemistry (machine learning) PhD Projects, Programmes & Scholarships

We have 24 Physical Chemistry (machine learning) PhD Projects, Programmes & Scholarships

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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Machine Learning and Molecular Modelling in Mass Spectrometry

University of Leeds Faculty of Biological Sciences

This PhD project will harness the power of computational modelling and machine learning (A.I.) to analyse data obtained by mass spectrometry experiments and predict structural characteristics of biomolecules and their interactions. Read more

Supervisors: Prof F. Sobott, Dr A Kalli, Dr H Wang

Year round applications PhD Research Project Self-Funded PhD Students Only

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Machine learning analysis of large-scale crystal structure prediction

University of Southampton Chemistry

Supervisory Team: Prof. Graeme Day. Project description. A fully funded 3.5-year PhD studentship is available in the area of computational materials discovery, as part of a prestigious international Synergy grant funded by the European Research Council. Read more

Supervisor: Prof G Day

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

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Predicting drug solubility in different solvents using molecular simulation and machine learning

University of Strathclyde Department of Chemical and Process Engineering

Predicting the solubility of complex drug-like molecules is crucial at several stages of the drug discovery and manufacture. In particular, solvent selection has been highlighted as a crucial step in process design and optimisation [1]. Read more

Supervisors: Dr M Jorge, Prof C Price

Year round applications PhD Research Project Self-Funded PhD 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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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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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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Particle properties by design

University of Leeds Faculty of Engineering and Physical Sciences

Research Group: School of Chemical and Process Engineering

This interdisciplinary project presents an exciting opportunity for an ambitious scientist or engineer to work across the boundaries of chemistry, physics and engineering, with opportunities to develop a broad portfolio of skills. Read more

Supervisor: Dr A R Pallipurath

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

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PhD Studentships - Process Industries: Net Zero Data Driven Optimisation for Process Scale-up

Newcastle University School of Engineering

Award summary. These studentships provide 100% fees (Home & international), a minimum tax-free annual living allowance of £18,622 (2023/24 UKRI rate), and a research training support grant of £20,000. Read more

Supervisor: Prof A Harvey

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

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Experimental Discovery of New Ionic Conducting Materials Towards Net-Zero Technologies

University of Liverpool Department of Chemistry

Materials that allow the rapid motion of ions are essential for the new energy technologies needed to meet the challenge of net zero, such as batteries, fuel cells and electrolysers for green hydrogen. Read more

Supervisors: Prof M J Rosseinsky, Dr J Claridge

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

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Simulating Dynamic Battery Interfaces: In Search of Next Generation Lithium Batteries

University of Liverpool School of Engineering

Improving battery technologies is essential to power the next generation of electric vehicles, and for future energy storage systems that will facilitate the transition to net-zero. Read more

Supervisors: Dr AF Finney, Prof LH Hardwick

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

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PhD student position: deciphering the molecular basis of allostery in CRISPR associated proteins using single-molecule experiments

University of Basel Department of Chemistry

- Level of employment / possibly date of entry. 100%, starting summer (negotiable). . - Intro. The Biomolecular Nano-Dynamics group at the Dept. Read more

Supervisor: Prof S Schmid

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

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High-throughput discovery of new materials as functional coatings on glass for net-zero applications

University of Liverpool Department of Chemistry

This studentship will develop and implement a high-throughput magnetron sputtering workflow for optoelectronic materials discovery as thin film coatings on glass. Read more

Supervisors: Prof M J Rosseinsky, Dr T Manning, Dr R Potter, Prof P R Chalker

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

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Discovery of Functional Inorganic Materials for Net Zero Applications using High-Throughput Synthesis

University of Liverpool Department of Chemistry

This project will use high-throughput solid state synthesis methods developed in the group (Hampson 2023) to accelerate the discovery of new functional inorganic (oxide) materials for applications towards net zero technologies e.g. Read more

Supervisors: Prof M J Rosseinsky, Dr J Claridge, Dr T Manning

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

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Experimental discovery of new Inorganic Materials for Net Zero Technologies

University of Liverpool Institute of Life Course and Medical Sciences

The experimental discovery of new inorganic materials shows us how crystal structure and chemical composition control physical and chemical properties. Read more

Supervisors: Prof M J Rosseinsky, Dr LD Daniels, Dr J Claridge

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

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We have 24 Physical Chemistry (machine learning) PhD Projects, Programmes & Scholarships

Physical Chemistry (machine learning) PhD Projects, Programmes & Scholarships

We have 24 Physical Chemistry (machine learning) PhD Projects, Programmes & Scholarships

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