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We have 17 Synthetic Chemistry (computer) PhD Projects, Programmes & Scholarships

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Synthetic Chemistry (computer) PhD Projects, Programmes & Scholarships

We have 17 Synthetic Chemistry (computer) 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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PhD in Chemistry: Computer simulation of metal-amyloid interaction and its role in plaque formation

Cardiff University Cardiff School of Chemistry
Alzheimer’s disease is one of the greatest healthcare challenges facing 21st century society. AD is associated with formation of fibrils and plaques in brain tissue that impair proper functioning of neurons. Read more
 Supervisor: Prof J Platts
 Year round applications  PhD Research Project  Self-Funded PhD 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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Digital discovery of new photocatalysts for photoredox catalysis (EPSRC CDT PhD studentship in collaboration with AstraZeneca)

University of Liverpool Department of Chemistry
Photoredox catalysis has come to the forefront in organic synthesis as a powerful strategy for the activation of small molecules [1]. Read more
 Supervisors: Dr JW Ward, Prof A Troisi
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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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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Improving the separation and purification of high technology lanthanides (ref: SF22/HLS/APP/LEWIS)

Northumbria University Faculty of Health and Life Sciences
Lanthanides (or ‘rare earths’) are widely used as key components in high technology devices, including smart phones, digital cameras, computer hard disks, fluorescent and light-emitting-diode (LED) lights, flat screen televisions, computer monitors, high performance magnets and electronic displays. Read more
 Supervisor: Dr F Lewis
 Year round applications  PhD Research Project  Self-Funded PhD Students Only
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Responsive biomaterials based on biogenic resources

Freiberg University of Mining and Technology Department of Material Science and Technology
About the stegbauerlab. The mission of the stegbauerlab at the Biogenic Engieering Materials group at TU Bergakademie Freiberg is to transform. Read more
 Supervisor: Prof L Stegbauer
 Year round applications  PhD Research Project  Funded PhD Project (Students Worldwide)
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Design and synthesis of a hybrid compound of RAR and VDR

Medical University of Vienna Institute for Pathophysiologie and Allergy
The doctoral candidate (DC) will perform chemical research on the design and organic synthesis of hybrid compounds at the Medical University of Warsaw, Warsaw, Poland. Read more
 Supervisor: Prof AK Kutner
 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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