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

We have 13 Inorganic Chemistry (computing science) PhD Projects, Programmes & Scholarships

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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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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The Development of Noval and Sustainable Surface Preparation Processes for Steels Using Environmentally Friendly Solutions

Sheffield Hallam University Materials and Engineering Research Institute

The Industry and Innovation Research Institute (I2Ri) draws on talents, expertise and facilities across Sheffield Hallam University. Read more

Supervisors: Dr MK Kitchen, Dr OL Lewis

10 May 2024 PhD Research Project Competition Funded PhD Project (Students Worldwide)

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Development of Perovskite-Based Solid Oxygen Carriers Towards Clean Air and Carbon Neutrality

Sheffield Hallam University Materials and Engineering Research Institute

The Industry and Innovation Research Institute (I2Ri) draws on talents, expertise and facilities across Sheffield Hallam University. Read more

Supervisors: Dr AS Scrimshire, Dr RJ Janani, Dr F Clegg, Dr DM Majumder

10 May 2024 PhD Research Project Competition 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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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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Soft & Crystalline Composite Materials: Developing Total Scattering Workflows for the Interrogation of Structure.

University of Birmingham School of Chemistry

An exciting interdisciplinary project for an enthusiastic student to develop a broad range of expertise, combining the experimental and computationally-based characterisation of advanced composite materials. Read more

Supervisor: Dr T Easun

30 May 2024 PhD Research Project Funded PhD Project (European/UK Students Only)

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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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Bismuth-doped Fibre Amplifiers for Extended Transmission Bands in Optical Communications

University of Southampton Faculty of Engineering and Physical Sciences

Supervisory Team: Prof Jayanta Sahu . Project Description. Global internet traffic has been growing exponentially over the past two decades with a predicted growth rate of around 40% year-on-year. Read more

Supervisor: Prof J Sahu

Year round applications PhD Research Project Competition Funded PhD Project (Students Worldwide)

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Novel Superprotonic Materials for Hydrogen Technologies

Aberdeen University School of Natural and Computing Sciences

These projects are open to students worldwide, but have no funding attached. Therefore, the successful applicant will be expected to fund tuition fees at the relevant level (home or international) and any applicable additional research costs. Read more

Supervisors: Dr S Fop, Prof A McLaughlin

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

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We have 13 Inorganic Chemistry (computing science) PhD Projects, Programmes & Scholarships

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

We have 13 Inorganic Chemistry (computing science) PhD Projects, Programmes & Scholarships

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