Research output per year
Research output per year
Collaborations and top research areas from the last five years
Recent external collaboration on country/territory level. Dive into details by clicking on the dots or
Profiles
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Nicholas Chilton, MRSC
- Computational and Theoretical Chemistry - Professor of Computational and Theoretical Chemistry
Person: Academic
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Nikolas Kaltsoyannis
- Computational and Theoretical Chemistry - Professor & Head of Comp & Theor Chem
Person: Academic
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Paul Popelier
- Computational and Theoretical Chemistry - Professor of Computational Chemistry
Person: Academic
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A catalytic alkene insertion approach to bicyclo[2.1.1]hexane bioisosteres
Agasti, S., Beltran, F., Pye, E., Kaltsoyannis, N., Crisenza, G. E. M. & Procter, D. J., 13 Feb 2023, In: Nature Chemistry. 15, 4, p. 535-541 7 p.Research output: Contribution to journal › Article › peer-review
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A combined BET and IQA–REG study of the activation energy of non-polar zw-type [3+2] cycloaddition reactions
Ríos-Gutiérrez, M., Falcioni, F., Domingo, L. R. & Popelier, P. L. A., 28 Mar 2023, In: Physical Chemistry Chemical Physics. 25, 15, p. 10853-10865 13 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile24 Downloads (Pure) -
Actinide-Actinide Bonding: Electron Delocalisation and σ Aromaticity in the Tri-Thorium Cluster [{Th(η8-C8H8)(μ-Cl)2}3K2]
Tomecek, J., Liddle, S. & Kaltsoyannis, N., 26 Jun 2023, In: ChemPhysChem. 24, e202300366.Research output: Contribution to journal › Article › peer-review
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Adduct Ions as Diagnostic Probes of Metallosupramolecular Complexes Using Ion Mobility Mass Spectrometry
Geue, N., Bennett, T. S., Ramakers, L. A. I., Timco, G. A., McInnes, E. J. L., Burton, N. A., Armentrout, P. B., Winpenny, R. E. P. & Barran, P. E., 13 Feb 2023, In: Inorganic Chemistry. 62, 6, p. 2672-2679 8 p.Research output: Contribution to journal › Article › peer-review
Open Access -
A Low‐Temperature Synthetic Route Toward a High‐Entropy 2D Hexernary Transition Metal Dichalcogenide for Hydrogen Evolution Electrocatalysis
Qu, J., Elgendy, A., Cai, R., Buckingham, M. A., Papaderakis, A. A., De Latour, H., Hazeldine, K., Whitehead, G. F. S., Alam, F., Smith, C. T., Binks, D. J., Walton, A., Skelton, J. M., Dryfe, R. A. W., Haigh, S. J. & Lewis, D. J., 17 May 2023, In: Advanced Science. 10, 14, 2204488.Research output: Contribution to journal › Article › peer-review
Open Access
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Evolving quantum mechanical tunnelling in enzymes
Hay, S., Green, A. & Johannissen, L.
1/04/23 → 31/03/26
Project: Research
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Catechol-O-methyltransferase (COMT): Resolving the mechanism of an archetypical methyl transferase with new experimental tools
1/12/18 → 31/05/22
Project: Research
Activities
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Internal Examiner of PhD Thesis: "Computational study of actinide-noble gas systems"
Jonathan Skelton (Examiner)
16 May 2023Activity: Examination › Research
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External Examiner of PhD Thesis: "Materials Modelling of Layered Crystals for Energy Storage"
Jonathan Skelton (Examiner)
1 Mar 2023Activity: Examination › Research
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External Examiner of PhD Thesis: "Atomic motion and rearrangement in functional materials"
Jonathan Skelton (Examiner)
10 Feb 2023Activity: Examination › Research
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External Examiner of PhD Thesis: "First-principles modelling of functional perovskites"
Jonathan Skelton (Examiner)
12 Sept 2022Activity: Examination › Research
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Solid-State Chemistry Group Christmas Meeting 2021
Jonathan Skelton (Participant)
20 Dec 2021 → 21 Dec 2021Activity: Participating in or organising event(s) › Participating in a conference, workshop, exhibition, performance, inquiry, course etc › Research
Datasets
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Data for: Phase stability of the tin monochalcogenides SnS and SnSe: a quasi-harmonic lattice-dynamics study
Skelton, J. (Creator) & Pallikara, I. (Contributor), Mendeley Data, 20 Jun 2023
DOI: 10.17632/fsghbfmj4w.1, https://data.mendeley.com/datasets/fsghbfmj4w
Dataset
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Data for: Lattice dynamics of Pnma Sn[S(1-x)Se(x)] solid solutions: energetics, phonon spectra and thermal transport
Skelton, J. (Creator), Mendeley Data, 13 Jul 2020
DOI: 10.17632/m34bnmpkpx.1, https://data.mendeley.com/datasets/m34bnmpkpx
Dataset
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Magnetic Exchange Interactions in Symmetric Lanthanide Dimetallics
Chilton, N. (Creator), Mendeley Data, 18 Sept 2020
DOI: 10.17632/63gyhm6y9n.1, https://data.mendeley.com/datasets/63gyhm6y9n
Dataset
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Data for: Structural Dynamics, Phonon Spectra and Thermal Transport in the Silicon Clathrates
Skelton, J. (Creator), Wei, B. (Contributor) & Flitcroft, J. (Contributor), Mendeley Data, 2 Feb 2023
DOI: 10.17632/9hywbzt8zd.1, https://data.mendeley.com/datasets/9hywbzt8zd
Dataset
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Research data for "Structural evolution of paramagnetic lanthanide compounds in solution compared to time- and ensemble-average structures from paramagnetic NMR"
Chilton, N. (Creator), University of Manchester Figshare, 7 Feb 2023
DOI: 10.48420/22015322, https://figshare.manchester.ac.uk/articles/dataset/Research_data_for_Structural_evolution_of_paramagnetic_lanthanide_compounds_in_solution_compared_to_time-_and_ensemble-average_structures_from_paramagnetic_NMR_/22015322 and one more link, https://figshare.manchester.ac.uk/articles/dataset/Research_data_for_Structural_evolution_of_paramagnetic_lanthanide_compounds_in_solution_compared_to_time-_and_ensemble-average_structures_from_paramagnetic_NMR_/22015322/1 (show fewer)
Dataset
Press/Media
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Press release for the publication: "Blood, sweat, and tears: extraterrestrial regolith biocomposites with in vivo binders"
Aled Roberts, Dominic Whittall, Rainer Breitling, Eriko Takano, Jonny Blaker, Sam Hay & Nigel Scrutton
13/09/21 → 14/09/21
16 items of Media coverage
Press/Media: Research