Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

PhD in Quantum Simulations for Electronic Structure Calculations in Molecules and Materials

University College London Faculty of Mathematical and Physical Sciences

Do you have a passion for computational chemistry and are eager to employ quantum computing methods to study complex chemical systems?. Read more

Supervisors: Prof P Coveney, Prof A Hoekstra

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

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Functional Materials Discovery Using Artificial Intelligence

University of Strathclyde Department of Chemistry

A fully funded PhD studentship (3 years) in computational chemistry (materials discovery) is open at the University of Strathclyde commencing October 2024. . Read more

Supervisor: Dr T Nematiaram

31 May 2024 PhD Research Project Funded PhD Project (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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PhD Studentship in Understanding non-equilibrium dynamics using Quantum dynamics

Newcastle University School of Natural and Environmental Sciences

Award summary . 100% of home fees covered, and a minimum tax-free annual living allowance of £19,237 (2024/25 UKRI rate). . Read more

Supervisor: Prof T J Penfold

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

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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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Spin-based quantum sensing beyond magnetic fields

University of Glasgow College of Science and Engineering

Quantum sensing with optically addressable electronic spins in the solid state holds great potential to push the limits of conventional sensing methods. Read more

Supervisor: Dr S Bayliss

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

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PhD in Spin-mechanical coupling towards quantum sensing

University of Glasgow College of Science and Engineering

Local mechanical deformation has profound impacts in a range of areas. Read more

Supervisors: Dr S Bayliss, Prof MV Vassalli

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

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Quantum algorithm development for correlated electrons

King’s College London Department of Physics

Project Description . Applicants are invited to apply for a PhD project in the development of quantum computing algorithms for correlated electrons. Read more

Supervisors: Dr G Booth, Dr J Bhaseen

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

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CDT-QTE: Magnetic Resonance Spectroscopy & Imaging at the Quantum Mechanical Performance Limit

University of Southampton Faculty of Engineering and Physical Sciences

Supervisory Team: Prof Ilya Kuprov, Dr Marina Carravetta. Project description: This project is part of the EPSRC Centre for Doctoral Training in Quantum Technology Engineering at the University of Southampton. Read more

Supervisor: Dr I Kuprov

31 August 2024 PhD Research Project Competition Funded PhD Project (Students Worldwide)

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Development of High-Data-Rate Quantum Gravity Sensors (with Toyota Motor Europe)

University of Birmingham EPSRC Centre for Doctoral Training

Project Description. The University of Birmingham, in partnership with Toyota Motor Europe, is offering a PhD position for developing a high-data-rate quantum gravimeter for gravity map-matching navigation and other applications. Read more

Supervisor: Dr YH Lien

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

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CDT-QTE: Quantum Spin Dynamics and How to Make it Faster

University of Southampton Faculty of Engineering and Physical Sciences

Supervisory Team: Prof Ilya Kuprov, Dr Marina Carravetta. Project description: This project is part of the EPSRC Centre for Doctoral Training in Quantum Technology Engineering at the University of Southampton. Read more

Supervisor: Dr I Kuprov

31 August 2024 PhD Research Project Competition Funded PhD Project (Students Worldwide)

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CDT-QTE: Quantum control of magnetic processes

University of Southampton Faculty of Engineering and Physical Sciences

Supervisory Team: Prof Ilya Kuprov, Dr Marina Carravetta. Project description: This project is part of the EPSRC Centre for Doctoral Training in Quantum Technology Engineering at the University of Southampton. Read more

Supervisor: Dr I Kuprov

31 August 2024 PhD Research Project Competition Funded PhD Project (Students Worldwide)

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(MRC DTP CASE) Prediction of substrate binding geometry and strength in promiscuous enzymes: computational chemistry applicable to the design of pharmaceuticals and agrochemicals

The University of Manchester Faculty of Biology, Medicine and Health

We are often taught about the power of enzymes to select particular substrates from the biological milieu and of their ability to perform highly selective reactions on those substrates. Read more

Supervisors: Dr A Leach, Dr S De Visser, Dr C Trujillo

13 May 2024 PhD Research Project Competition Funded PhD Project (UK Students Only)

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Multiple PhD Positions at the International Max Planck Research School (IMPRS) for Quantum Dynamics and Control (QDC) in Dresden, Germany

Max Planck Institute for the Physics of Complex Systems

We are looking for highly talented and motivated students from all around the world. The standard. entrance qualification is a master's degree (or an equivalent university degree, e.g., German “Diplom”). Read more

Awaiting Funding Decision/Possible External Funding Max Planck Research Programme

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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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We have 28 Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

We have 28 Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

PhD in Quantum Simulations for Electronic Structure Calculations in Molecules and Materials

Functional Materials Discovery Using Artificial Intelligence

Machine learning algorithms for ab initio-based paramagnetic NMR analysis

PhD Studentship in Understanding non-equilibrium dynamics using Quantum dynamics

Property-driven generative machine learning for tailored materials design

Spin-based quantum sensing beyond magnetic fields

PhD in Spin-mechanical coupling towards quantum sensing

Quantum algorithm development for correlated electrons

CDT-QTE: Magnetic Resonance Spectroscopy & Imaging at the Quantum Mechanical Performance Limit

Development of High-Data-Rate Quantum Gravity Sensors (with Toyota Motor Europe)

CDT-QTE: Quantum Spin Dynamics and How to Make it Faster

CDT-QTE: Quantum control of magnetic processes

(MRC DTP CASE) Prediction of substrate binding geometry and strength in promiscuous enzymes: computational chemistry applicable to the design of pharmaceuticals and agrochemicals

Multiple PhD Positions at the International Max Planck Research School (IMPRS) for Quantum Dynamics and Control (QDC) in Dresden, Germany

High-throughput first-principle simulations of charge transport in organic semiconductors

We have 28 Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

We have 28 Computer Science (quantum chemistry) PhD Projects, Programmes & Scholarships

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