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  1. 2018
  2. Published

    Probing Hydrogen and Halogen-Oxo Interactions in Uranyl Coordination Polymers: A Combined Crystallographic and Computational Study

    Carter, K., Kalaj, M., Kerridge, A. & Cahill, C., 14/09/2018, In: CrystEngComm. 20, 34, p. 4916-4925 10 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  3. Published

    The influence of molecular conformation on the photophysics of organic room temperature phosphorescent luminophores

    Huang, R., Ward, J. S., Kukhta, N. A., Avó, J., Gibson, J., Penfold, T., Lima, J. C., Batsanov, A. S., Berberan-Santos, M. N., Bryce, M. R. & Dias, F. B., 14/09/2018, In: Journal of Materials Chemistry C. 6, 34, p. 9238-9247 10 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  4. Published

    Elucidation of the inverse trans influence in uranyl, its imido and carbene analogues via quantum chemical simulation

    Fryer-Kanssen, I. & Kerridge, A., 11/09/2018, In: Chemical Communications. 54, 70, p. 9761-9764 4 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  5. Published

    A 3D Organically Synthesised Porous Carbon Material for Lithium Ion Batteries

    Zhao, Z., Das, S., Xing, G., Fayon, P. C., Heasman, P., Jay, M., Bailey, S. W. D., Lambert, C. J., Yamada, H., Wakihara, T., Trewin, A. E., Ben, T., Qiu, S. & Valtchev, V., 10/09/2018, In: Angewandte Chemie International Edition. 57, 37, p. 11952-11956 5 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  6. Published

    Quantifying structure dependent responses in Li-ion cells with excess Li spinel cathodes: matching voltage and entropy profiles through mean field models

    Schlueter, S., Geseiner, R., Richards, D., Hoster, H. E. & Mercer, M., 7/09/2018, In: Physical Chemistry Chemical Physics. 20, 33, p. 21417-21429 13 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  7. Published

    Formation of the Solid Electrolyte Interphase at Constant Potentials: a Model Study on Highly Oriented Pyrolytic Graphite

    Antonopoulos, B. K., Maglia, F., Schmidt-Stein, F., Hoster, H. E. & Schmidt, J. P., 09/2018, In: Batteries & Supercaps. 1, 3, p. 110-121 12 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  8. Published

    Decomposition of d- and f-shell contributions to uranium bonding from the quantum theory of atoms in molecules: Application to uranium and uranyl halides

    Tanti, J., Lincoln, M. & Kerridge, A., 30/08/2018, In: Inorganics. 6, 3, 19 p., 88.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  9. Published

    Solubility prediction from first principles: a density of states approach

    Boothroyd, S., Kerridge, A., Broo, A., Buttar, D. & Anwar, J., 28/08/2018, In: Physical Chemistry Chemical Physics. 20, 32, p. 20981-20987 7 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  10. Published

    Fine-tuning polyoxometalate non-linear optical chromophores: a molecular electronic “Goldilocks” effect

    Al-Yasari, A., Spence, P., El Moll, H., van Steerteghem, N., Horton, P. N., Brunschwig, B. S., Clays, K. & Fielden, J., 21/08/2018, In: Dalton Transactions. 47, 31, p. 10415-10419 5 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  11. Published

    Epigallocatechin-3-gallate remodels apolipoprotein A-I amyloid fibrils into soluble oligomers in the presence of heparin

    Townsend, D., Hughes, E., Akien, G., Stewart, K. L., Radford, S. E., Rochester, D. & Middleton, D. A., 17/08/2018, In: Journal of Biological Chemistry. 293, 33, p. 12877-12893 17 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

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