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computational science PhD Projects, Programmes & Scholarships

We have 388 computational science PhD Projects, Programmes & Scholarships

Shape the Future of Computational Science – 10+ Fully Funded PhD Opportunities available at HetSys at Warwick

University of Warwick

School of Engineering

Bringing together cutting-edge research in computational modelling of complex, heterogeneous systems, spanning scales from quantum and atomistic to continuum models with projects addressing exciting challenges in materials, molecules, and beyond—pushing the boundaries of science, maths and engineering. Read more

Funded PhD Programme (UK Students Only) EPSRC Centre for Doctoral Training

Last chance to apply

A Plug and Play Computational Framework for Efficient Virtual Prototyping in Science and Engineering (Ref: MA/MD-SF1/2026)

Loughborough University

Department of Mathematical Sciences

Virtual prototyping is central to modern science and engineering, enabling rapid exploration of design options while reducing the cost and time associated with experimental testing. Read more

Supervisor: Dr M Discacciati

30 June 2026 PhD Research Project Self-Funded PhD Students Only

Data-driven Approaches to Viscoelastic Flow Control

The University of Manchester

Department of Mechanical and Aerospace Engineering

Many liquids in industry and biology are viscoelastic (like paints, blood, saliva, and DNA suspensions among many others), displaying a mixture of both viscous and elastic properties. Read more

Supervisors: Dr M Beneitez, Dr J King

Year round applications PhD Research Project Funded PhD Project (UK Students Only)

Structural Biology & Computational Chemistry

Adelaide University

School of Chemical Engineering

Fully Funded PhD Opportunity in Computational Structural Biology and Protein Engineering. Location. The University of Adelaide (Australia). Read more

Supervisor: Mr LG Gerstweiler

30 August 2026 PhD Research Project Funded PhD Project (Students Worldwide)

Cognitive Science Ph.D.

Rochester Institute of Technology USA

Explore the human mind through psychology, neuroscience, AR, and more in RIT’s interdisciplinary Ph.D. Why Pursue a Cognitive Science Ph.D. Read more

Funded PhD Programme (Students Worldwide) PhD Research Programme

EPSRC Centre for Doctoral Training in Aerosol Science

University of Bristol

EPSRC Centre for Doctoral Training in Aerosol Science

Fully-funded 4-year PhD studentships are available as part of the EPSRC Centre for Doctoral training in Aerosol Science. Read more

Funded PhD Programme (European/UK Students Only) EPSRC Centre for Doctoral Training

Computability and Constrained Equations in Free Semigroups (Ref: CO/JD-SF1/2026)

Loughborough University

Department of Computer Science

Given a finite set A, and an associative binary operation o, a semigroup is a set which contains A and is closed under o. If |A| n, the free semigroup A+ is a particular example of a semigroup. Read more

Supervisor: Dr J Day

1 January 2027 PhD Research Project Self-Funded PhD Students Only

Advanced Modelling of Waste Immobilisation Materials for Long‑Term Nuclear Waste Storage (Ref: CM/KJ-SF1/2026)

Loughborough University

Department of Chemistry

Reprocessing spent nuclear fuel generates waste that contains long‑lived radioactive isotopes capable of remaining hazardous for thousands of years. Read more

Supervisor: Dr K Jolley

1 April 2027 PhD Research Project Self-Funded PhD Students Only

Indoor plant effects on aerosol behaviour and exposure in residential environments

University of Bristol

School of Chemistry

Applications are invited for a 4 year PhD studentship starting in Autumn 2026 as part of the EPSRC CDT in Aerosol Science. Project description. Read more

Supervisors: Prof P Kumar, Prof CP Pfrang, Dr T Blanusa, Mr B. M. McCallan

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

PhD Position in Interpretable AI for Coupled Multiphysics of Geomaterials

Ecole Polytechnique Federale de Lausanne (EPFL)

Civil and Environmental Engineering

The Data-Driven Mechanics Laboratory invites applications for a fully funded PhD position at the intersection of computational mechanics, multiphysics of geomaterials, and interpretable machine learning. Read more

Supervisor: Prof K Karapiperis

14 July 2026 PhD Research Project Funded PhD Project (Students Worldwide)

Multi‑Scale Simulations and Generative Design for Net Zero Built Environment

Edinburgh Napier University

School of Computing, Engineering & the Built Environment

The built environment is responsible for approximately 40% of global carbon emissions [1], making it a critical frontier in the global pursuit of net zero targets. Read more

Supervisor: Dr M Sajjadian

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

Full-time PhD studentship (Lasso Group)

University College London

UCL School of Life and Medical Sciences

We are looking for a PhD student with strong computational skills interested in structural bioinformatics, and infection biology. Read more

Supervisor: Dr G Lasso

12 July 2026 PhD Research Project Funded PhD Project (UK Students Only)

Microscale Mechanisms: The Influence of Particle Geometry on Aerodynamic Resuspension

University of Bristol

School of Chemistry

Applications are invited for a 4 year PhD studentship starting in Autumn 2026 as part of the EPSRC CDT in Aerosol Science. Project Overview. Read more

Supervisors: Dr M. D. W. Davies Wykes, Dr R. T. Thomas, Dr E. K. Kruger

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

Investigating cellular mechanisms underlying lung fibrosis using omics approaches

University of Southampton

School of Biological Sciences

Lung fibrosis kills thousands annually with no curative treatment. This project decodes the cellular and molecular mechanisms driving fibrosis initiation and progression, combining human models, spatial multi-omics, and AI/ML-based computational analysis of patient lung tissue. Read more

Supervisors: Dr K N Natarajan, Dr M Jones

15 July 2026 PhD Research Project Funded PhD Project (UK Students Only)

AI and Data Science for Electoral Integrity and Democratic Governance

Cardiff University

Cardiff School of Computer Science & Informatics

Project Description. Aims and Methods . This thesis develops and evaluates AI- and data science–based tools to protect electoral integrity and the free formation of voters’ will from algorithmic manipulation. Read more

Supervisors: Dr F Liberatore, Dr JC Camacho Collados, Prof L Q Sánchez

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

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