Datasets
- 20 results
Search results
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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: 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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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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Computational Supporting Dataset: Atomic Insights into Aluminium-Ion Insertion in Defective Hydroxyfluorinated Anatase for Batteries
Morgan, B. (Creator), University of Bath, 10 Jul 2020
DOI: 10.15125/BATH-00815
Dataset
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DFT Dataset for "Mechanistic Origin of Superionic Lithium Diffusion in Anion-Disordered Li6PS5X Argyrodites"
Morgan, B. (Creator), University of Bath, 21 Dec 2020
DOI: 10.15125/BATH-00814
Dataset
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Dataset for "Anion-polarisation–directed short-range-order in antiperovskite Li2FeSO"
Coles, S. (Creator), Squires, A. (Creator), McColl, K. (Creator), Islam, S. (Creator) & Morgan, B. (Creator), University of Bath, 12 Apr 2023
DOI: 10.15125/BATH-01260, https://doi.org/10.5281/zenodo.7828909
Dataset
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Data Analysis for "Interfacial Strain Effects on Lithium Diffusion Pathways in the Spinel Solid Electrolyte Li-Doped MgAl2O4"
O'Rourke, C. (Creator) & Morgan, B. (Creator), Zenodo, 1 Dec 2017
DOI: 10.5281/zenodo.1069417, https://github.com/bjmorgan/data_NEB_spinel
Dataset
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Dataset for "Low electronic conductivity of Li₇La₃Zr₂O₁₂ solid electrolytes from first principles"
Squires, A. (Creator), Davies, D. (Creator) & Morgan, B. (Creator), University of Bath, 1 Aug 2022
DOI: 10.15125/BATH-01167
Dataset
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Dataset for "Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4"
Mercadier, B. (Creator), Coles, S. (Creator), Duttine, M. (Creator), Legein, C. (Creator), Body, M. (Creator), Borkiewicz, O. (Creator), Lebedev, O. (Creator), Morgan, B. (Creator), Masquelier, C. (Creator) & Dambournet, D. (Creator), University of Bath, 16 Oct 2023
DOI: 10.15125/BATH-01309
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
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Dataset for "Transition metal migration and O2 formation underpin voltage hysteresis in oxygen-redox disordered rocksalt cathodes"
McColl, K. (Creator), Squires, A. (Project Member), Coles, S. (Project Member), Morgan, B. (Supervisor) & Islam, S. (Supervisor), University of Bath, 7 Sept 2022
DOI: 10.15125/BATH-01189
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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Variation in Surface Energy and Reduction Drive of a Metal Oxide Lithium-Ion Anode with Stoichiometry: A DFT Study of Lithium Titanate Spinel Surfaces
Teobaldi, G. (Creator), Carrasco, J. (Project Member) & Morgan, B. (Researcher), University of Liverpool, 12 Oct 2016
DOI: 10.17638/datacat.liverpool.ac.uk/209
Dataset
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DFT Dataset for "Interfacial Strain Effects on Lithium Diffusion Pathways in the Spinel Solid Electrolyte Li-Doped MgAl2O4"
O'Rourke, C. (Creator) & Morgan, B. (Creator), University of Bath, 8 Mar 2018
DOI: 10.15125/BATH-00438, https://doi.org/10.5281/zenodo.1170749
Dataset
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Dataset for "Native Defects and their Doping Response in the Lithium Solid Electrolyte Li7La3Zr2O12"
Squires, A. G. (Creator), Scanlon, D. O. (Creator) & Morgan, B. (Creator), University of Bath, 23 Dec 2019
DOI: 10.15125/BATH-00691
Dataset
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Supporting data for Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li7La3Zr2O12
Burbano, M. (Creator), Carlier, D. (Creator), Boucher, F. (Creator), Morgan, B. (Creator) & Salanne, M. (Creator), University of Bath, 2017
DOI: 10.15125/BATH-00366
Dataset
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Computational Supporting Dataset for "Exploiting Cationic Vacancies for Increased Energy Densities in Dual-Ion Batteries"
Morgan, B. (Creator), University of Bath, 24 Oct 2019
DOI: 10.15125/BATH-00689
Dataset
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Computational Dataset for "Reversible Magnesium and Aluminium-ions Insertion in Cation-Deficient Anatase TiO2"
Morgan, B. (Creator), Salanne, M. (Creator) & Dambournet, D. (Creator), University of Bath, 11 Jul 2017
DOI: 10.15125/BATH-00397
Dataset
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DFT dataset: X=(Li,Na,Ca,Mg,Al) Intercalation into (F/OH)-Substituted Anatase TiO2
Morgan, B. (Creator), University of Bath, 29 Mar 2018
DOI: 10.15125/BATH-00473
Dataset