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We have 15 Inorganic Chemistry (computer science) PhD Projects, Programmes & Scholarships

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Inorganic Chemistry (computer science) PhD Projects, Programmes & Scholarships

We have 15 Inorganic Chemistry (computer science) PhD Projects, Programmes & Scholarships

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High-throughput solid state synthesis of functional inorganic materials for net zero applications

University of Liverpool Department of Chemistry
The discovery of new functional materials to drive technologies for the net zero transition, such as batteries, solar absorbers, rare-earth-free magnets for wind power and a myriad of other unmet needs, is a scientific and societal grand challenge. Read more
 Supervisors: Prof M J Rosseinsky, Dr L Daniels
 31 December 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Computationally driving automated functional materials discovery for net zero technologies with machine reasoning and decision-making

University of Liverpool Department of Chemistry
This project, suited to a student with a Computer Science or Mathematics background, will formally define the nature and consequences of the decisions that need to be made in the automated workflow and identify both the optimal combination of existing methods and tools to accelerate discovery and the gaps in capability that currently exist. Read more
 Supervisors: Prof RIJ Ibsen-Jensen, Prof M J Rosseinsky
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Automated experimental functional materials discovery for net zero technologies

University of Liverpool Department of Chemistry
The discovery of materials that will drive technologies for the net zero transition, such as batteries, solar absorbers, rare-earth-free magnets for wind power and myriad other unmet needs, is a scientific and societal grand challenge that requires experimental realisation of materials in the laboratory. Read more
 Supervisor: Prof M J Rosseinsky
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Harnessing waste-heat from challenging environments with flexible electronics, sponsored by BAE Systems

University of Southampton Faculty of Engineering and Physical Sciences
Supervisory Team. Dr Katrina Morgan, Dr Ioannis Zeimpekis, Prof Nick Harris, Prof Steve Beeby. Project description. This PhD is a sought after industrial Cooperative Award in Science and Techology (iCASE), with sponsorship from BAE Systems Ltd. Read more
 Supervisor: Dr K Morgan
 31 August 2024  PhD Research Project  Competition Funded PhD Project (European/UK Students Only)
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Machine learning algorithms for ab initio-based paramagnetic NMR analysis

University of Bath Department of Chemistry
The University of Bath is inviting applications for the following PhD project under the supervision of Dr Elizaveta Suturina in the Department of Chemistry. Read more
 Supervisor: Dr E A Suturina
 28 April 2024  PhD Research Project  Funded PhD Project (UK Students Only)
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Accelerating energy landscape exploration through optimisation, approximation and parallelisation

University of Liverpool School of Electrical Engineering, Electronics and Computer Science
Many heuristic methods (random walks, probabilistic selection, genetic algorithms) for energy landscape exploration in Crystal Structure Prediction (CSP) [1] are very important material discovery tools [2]. Read more
 Supervisor: Prof I Potapov
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Deploying safer robot chemists in real laboratory environments

University of Liverpool School of Electrical Engineering, Electronics and Computer Science
Robotic chemists [1] are a totally new and disruptive development in human-centric labs, and these systems are already beginning to carry out complex experiments that require skills beyond sample transportation (e.g., sample weighing [2] and scraping samples from vials [3]. Read more
 Supervisor: Dr G Pizzuto
 30 June 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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Development of bespoke algorithms for autonomous optimisation in flow

University of Liverpool Department of Chemistry
A key challenge in materials science is how to efficiently and sustainably arrive at the optimal conditions for material production. Read more
 Supervisor: Dr A Slater
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Non-Metal Organic Frameworks for proton and ion conduction

University of Liverpool Department of Chemistry
We have recently developed a novel class of porous materials, non-metal organic frameworks [1], that display remarkable proton and ion conduction properties. Read more
 Supervisors: Prof A I Cooper, Dr LJ Hardwick
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Explaining structure-property relations in the materials space

University of Liverpool Department of Chemistry
This project aims to explain important materials properties from geometric invariants of crystal structures. Read more
 Supervisors: Dr V Kurlin, Prof A I Cooper
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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High-throughput first-principle simulations of charge transport in organic semiconductors

University of Liverpool Department of Mathematical Sciences
This project focuses on application of first-principle, fully quantum simulation methods such as Hybrid Monte-Carlo to study charge transport in a vast class of quasi-2D molecular organic semiconductors (rubrene, pentacene, and >4000 other materials). Read more
 Supervisors: Dr P Buividovich, Prof A Troisi
 30 June 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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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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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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