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Research at St Andrews

Tanja van Mourik

Person

  1. 2021
  2. E-pub ahead of print

    A quinone based single-molecule switch as building block for molecular electronics

    Früchtl, H. A. & van Mourik, T., 4 Jan 2021, In: Physical Chemistry Chemical Physics. In press

    Research output: Contribution to journalArticlepeer-review

  3. 2020
  4. E-pub ahead of print

    A computational study of TyrGly hydration

    Hameed, R. & van Mourik, T., 25 Aug 2020, In: Computational and Theoretical Chemistry. In press, 113011.

    Research output: Contribution to journalArticlepeer-review

  5. Published

    Halogen-bonded guanine base pairs, quartets and ribbons

    Thornton, N. J. & van Mourik, T., 8 Sep 2020, In: International Journal of Molecular Sciences. 21, 18, 15 p., 6571.

    Research output: Contribution to journalArticlepeer-review

  6. Published

    Simulation of electrochemical properties of naturally occurring quinones

    Birkedal Kristensen, S., van Mourik, T., Brunn Pedersen, T., Laurids Sørensen, J. & Muff, J., 11 Aug 2020, In: Scientific Reports. 10, 13571.

    Research output: Contribution to journalArticlepeer-review

  7. 2019
  8. Published

    Crystal structures, Hirshfeld surface analysis and a computational study of four ethyl 2-oxo-2H-chromene-3-carboxylate derivatives: a survey of organyl 2-oxo-2H-chromene-3-carboxylate structures

    Gomes, L. R., Low, J. N., van Mourik, T., da Silveira Pinto, L. S., de Souza, M. V. N. & Wardell, J. L., 25 Feb 2019, In: Zeitschrift fur Kristallographie. 234, 2, p. 85-99 16 p.

    Research output: Contribution to journalArticlepeer-review

  9. Published

    Different substituent effects on the supramolecular arrays in some (E)-halo- and nitro-benzaldehyde oximes: confirmation of attractive π(C=N)···π(phenyl) interactions

    Gomes, L. R., Low, J. N., van Mourik, T., Früchtl, H., De Souza, M. V. N., Da Costa, C. F. & Wardell, J. L., 24 Apr 2019, In: Zeitschrift für Naturforschung B - A Journal of Chemical Sciences. 74, 4, p. 319-334

    Research output: Contribution to journalArticlepeer-review

  10. Published

    Halogen and hydrogen bonding in halogenabenzene/NH3 complexes compared using next-generation QTAIM

    Li, S., Xu, T., van Mourik, T., Früchtl, H., Kirk, S. R. & Jenkins, S., 8 Aug 2019, In: Molecules. 24, 16, 12 p., 2875.

    Research output: Contribution to journalArticlepeer-review

  11. Published

    Halogen bonding with the halogenabenzene bird structure, halobenzene and halocyclopentadiene

    Cates, E. L. & van Mourik, T., 15 Sep 2019, In: Journal of Computational Chemistry. 40, 24, p. 2111-2118

    Research output: Contribution to journalArticlepeer-review

  12. E-pub ahead of print

    Next generation QTAIM for scoring molecular wires in E-fields for molecular electronic devices

    Azizi, A., Momen, R., Fruchtl, H., van Mourik, T., Kirk, S. R. & Jenkins, S., 27 Dec 2019, In: Journal of Computational Chemistry. Early View

    Research output: Contribution to journalArticlepeer-review

  13. Published

    Next generation QTAIM for the design of quinone-based switches

    Tian, T., Xu, T., van Mourik, T., Früchtl, H., Kirk, S. R. & Jenkins, S., May 2019, In: Chemical Physics Letters. 722, p. 110-118 9 p.

    Research output: Contribution to journalArticlepeer-review

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