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We have 16 Inorganic Chemistry (computational science) PhD Projects, Programmes & Scholarships

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

We have 16 Inorganic Chemistry (computational science) PhD Projects, Programmes & Scholarships

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Computational Modelling of Organometallic Reactivity and Catalysis

University of St Andrews School of Chemistry
A PhD position is available in the group of Prof. Stuart Macgregor to work on the computational modelling of organometallic reactivity and catalysis. Read more
 Supervisor: Prof S Macgregor
 26 April 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Accurate and Efficient Modelling of X-ray Spectra for the Nuclear Fuel Cycle

The University of Manchester Department of Chemistry
Leading nations are transitioning to renewable energy and reducing carbon emissions with a major focus on increasing resource efficiency and sustainability. Read more
 Supervisors: Dr M Oakley, Dr M Baker
 26 April 2024  PhD Research Project  Competition 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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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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Geochemical Controls on Radionuclide Transport and Fate in Sedimentary Rock – A combined experimental and modelling study

The University of Manchester Department of Earth and Environmental Sciences
Context. The UK has been generating electricity from nuclear power for over sixty years. Consequently, the safe disposal of the UK’s existing ~750,000 m3 of radioactive waste is a clear priority. Read more
 Supervisors: Prof S Shaw, Prof K Morris, Dr LL Abrahamsen-Mills
 30 April 2024  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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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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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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Rational design of photo/electrocatalysts towards Green Nitrogen Fixation and Ammonia Production

The University of Manchester Department of Chemical Engineering
In an era marked by the urgent need for sustainable solutions, this project stands at the forefront of innovation in catalysis, focusing on the rational design of photo/electrocatalysts for nitrogen fixation and ammonia production. Read more
 Supervisors: Dr S Xu, Prof C Hardacre, Prof R Catlow
 Year round applications  PhD Research Project  Funded PhD Project (Students Worldwide)
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Predictive molecular models of high-performance elastomers in demanding environments

University of Liverpool Department of Chemistry
High-performance elastomers enable some of the most sophisticated modern technology. They are designed to operate in the often-punishing environments such as those encountered in aerospace industries. Read more
 Supervisor: Prof R Boulatov
 30 June 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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Rational design of photo/electrocatalysts towards Green Nitrogen Fixation and Ammonia Production

The University of Manchester Department of Chemical Engineering
In an era marked by the urgent need for sustainable solutions, this project stands at the forefront of innovation in catalysis, focusing on the rational design of photo/electrocatalysts for nitrogen fixation and ammonia production. Read more
 Supervisors: Dr S Xu, Prof C Hardacre
 Year round applications  PhD Research Project  Funded PhD Project (Students Worldwide)
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Accelerated Inorganic Materials Discovery Driven by Magnetic Resonance

University of Liverpool Department of Chemistry
This studentship will explore experimental and computational Nuclear Magnetic Resonance (NMR) spectroscopy approaches to probe the fast oxide ion transport (e.g., self-diffusion coefficients, diffusion pathways, dimensionality of motion) of oxide in inorganic materials aimed at establishing design rules for the discovery of next generation fast conductors. Read more
 Supervisors: Prof F Blanc, Dr M Dyer
 30 April 2024  PhD Research Project  Funded PhD Project (Students Worldwide)
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PhD in Chemistry: Enhancing organic room-temperature phosphorescence through supramolecular approaches

Cardiff University Cardiff School of Chemistry
Dr Yi-Lin Wu - People - Cardiff University is looking for a PhD student to work on the research project “Enhancing organic room-temperature phosphorescence through supramolecular approaches.” The project involves the design and synthesis of triplet-forming organic chromophores and the investigation of their photophysical properties induced by supramolecular interactions. Read more
 Supervisor: Dr Y Wu
 Year round applications  PhD Research Project  Self-Funded PhD Students Only
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New methods for modelling radionuclide binding proteins

The University of Manchester Department of Chemistry
The management of radioactively contaminated land and water is a multi-billion pound, 100+ year grand challenge that requires innovation to minimise costs. Read more
 Supervisors: Prof S Hay, Dr L Natrajan
 Year round applications  PhD Research Project  Competition Funded PhD Project (UK Students Only)
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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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