Projects per year
Personal profile
Research interests
My research consists of development and application of techniques for modelling functional materials. My current focus is the transport of ions through solids, with the goal of explaining the factors that control performance of lithium-ion battery materials.
Research interests
- Lithium-ion solid electrodes and electrolytes.
- Theory of complex ionic transport in solids.
- The behaviour of crystal defects at surfaces and solid–solid interfaces "nanoionic" phenomena.
- Phase stability and polymorphism in nanostructured materials.
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
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Collaborations and top research areas from the last five years
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CATMAT phase 2
Engineering and Physical Sciences Research Council
1/10/23 → 30/09/25
Project: Research council
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DESTINY - Marie Curie COFUND (Coord - France) - new application
1/10/20 → 30/09/25
Project: EU Commission
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RS Enhanced Research Expenses - Modelling Transport in Solid Electrolytes using Machine-Learning Potentials
1/12/21 → 30/09/22
Project: Research council
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Faraday Institution - - Multi-scale modelling - follow on funding
Morgan, B. & Islam, S.
Engineering and Physical Sciences Research Council
1/04/21 → 31/03/23
Project: Research council
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Computational Discovery of Conduction Mechanisms in Lithium-Ion Solid Electrolytes
1/10/19 → 30/09/22
Project: Research council
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Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4
Mercadier, B., Coles, S. W., Duttine, M., Legein, C., Body, M., Borkiewicz, O. J., Lebedev, O., Morgan, B. J., Masquelier, C. & Dambournet, D., 1 Nov 2023, In: Journal of the American Chemical Society. 145, 43, p. 23739-23754 16 p.Research output: Contribution to journal › Article › peer-review
Open Access -
Anion-polarisation–directed short-range-order in antiperovskite Li2FeSO
Coles, S., Falkowski, V., Geddes, H., Pérez, G., Booth, S., Squires, A., O'Rourke, C., McColl, K., Goodwin, A., Cussen, S., Clarke, S., Saiful Islam, M. & Morgan, B., 28 Jun 2023, In: Journal of Materials Chemistry A. p. 13016 13026 p.Research output: Contribution to journal › Article › peer-review
Open Access1 Downloads (Pure) -
Delocalized electron holes on oxygen in a battery cathode
House, R. A., Rees, G. J., McColl, K., Marie, J. J., Garcia-Fernandez, M., Nag, A., Zhou, K. J., Cassidy, S., Morgan, B. J., Saiful Islam, M. & Bruce, P. G., 16 Feb 2023, In: Nature Energy. 8, 4, p. 351-360 10 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile5 Citations (SciVal)144 Downloads (Pure) -
py-sc-fermi: Self-consistent Fermi Energies and Defect Concentrations from Electronic Structure Calculations
Squires, A., Scanlon, D. & Morgan, B., 3 Feb 2023, In: The Journal of Open Source Software. 8, 82, 4962.Research output: Contribution to journal › Article › peer-review
Open Access -
kinisi: Bayesian analysis of mass transport from molecular dynamics simulations
Mccluskey, A., Squires, A., Coles, S. & Morgan, B., 17 Aug 2023, (Submitted) In: The Journal of Open Source Software.Research output: Contribution to journal › Article › peer-review
File39 Downloads (Pure)
Datasets
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Dataset for "Evidence for the existence of an inductive effect in superionic conductors"
Squires, A. G. (Creator) & Morgan, B. (Creator), University of Bath, 7 Dec 2020
DOI: 10.15125/BATH-00798
Dataset
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DFT Dataset: Mg Intercalation into (OH,F)-Substituted Anatase TiO2
Morgan, B. (Creator), University of Bath, 17 Aug 2018
DOI: 10.15125/BATH-00545
Dataset
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DFT dataset: Impact of Anionic Vacancies on the Local and Electronic Structures of Iron-based Oxyfluoride Electrodes
Morgan, B. (Creator), University of Bath, 19 Dec 2018
DOI: 10.15125/BATH-00576
Dataset
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Dataset for "The Impact of Solution Chemistry on Growth and Structural Features of Mo-substituted Spinel Iron Oxides"
Squires, A. (Creator) & Morgan, B. (Creator), University of Bath, 6 May 2021
DOI: 10.15125/BATH-00993
Dataset
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Dataset for "Lattice-Geometry Effects in Garnet Solid Electrolytes: A Lattice-Gas Monte Carlo Simulation Study"
Morgan, B. (Creator), Zenodo, 2 Jul 2017
Dataset