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Research

Dr Michael Peach

Lecturer

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  1. 2009
  2. Published

    Mechanistic insights into the cytochrome P450-mediated oxidation and rearrangement of littorine in tropane alkaloid biosynthesis

    Nasomjai, P., Reed, D. W., Tozer, D. J., Peach, M. J. G., Slawin, A. M. Z., Covello, P. S. & O'Hagan, D., 21/09/2009, In: ChemBioChem. 10, 14, p. 2382-2393 12 p.

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

  3. Published

    TDDFT diagnostic testing and functional assessment for triazene chromophores

    Peach, M. J. G., Le Sueur, C. R., Ruud, K., Guillaume, M. & Tozer, D. J., 2009, In: Physical Chemistry Chemical Physics. 11, 22, p. 4465-4470 6 p.

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

  4. Published

    Time-dependent density functional theory calculations of near-edge X-ray absorption fine structure with short-range corrected functionals

    Besley, N. A., Peach, M. J. G. & Tozer, D. J., 2009, In: Physical Chemistry Chemical Physics. 11, 44, p. 10350-10358 9 p.

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

  5. 2008
  6. Published

    Adiabatic connection forms in density functional theory: H(2) and the He isoelectronic series

    Peach, M. J. G., Miller, A. M., Teale, A. M. & Tozer, D. J., 14/08/2008, In: Journal of Chemical Physics. 129, 6, 7 p., ARTN 064105.

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

  7. Published

    Excitation energies in density functional theory: An evaluation and a diagnostic test

    Peach, M. J. G., Benfield, P., Helgaker, T. & Tozer, D. J., 28/01/2008, In: Journal of Chemical Physics. 128, 4, 8 p., ARTN 044118.

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

  8. 2007
  9. Published

    Structural and electronic properties of polvacetylene and polyyne from hybrid and coulomb-attenuated density functionals

    Peach, M. J. G., Tellgren, E. I., Salek, P., Helgaker, T. & Tozer, D. J., 22/11/2007, In: Journal of Physical Chemistry A. 111, 46, p. 11930-11935 6 p.

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

  10. Published

    Modeling the adiabatic connection in H-2

    Peach, M. J. G., Teale, A. M. & Tozer, D. J., 28/06/2007, In: Journal of Chemical Physics. 126, 24, 9 p., 244104.

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

  11. Published

    An electrostatic gauche effect in beta-fluoro- and beta-hydroxy-N-ethylpyridinium cations

    Gooseman, N. E. J., O'Hagan, D., Peach, M. J. G., Slawin, A. M. Z., Tozer, D. J. & Young, R. J., 2007, In: Angewandte Chemie International Edition. 46, 31, p. 5904-5908 5 p.

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

  12. 2006
  13. Published

    Assessment of a Coulomb-attenuated exchange-correlation energy functional

    Peach, MJG., Helgaker, T., Salek, P., Keal, TW., Lutnaes, OB., Tozer, DJ. & Handy, NC., 7/02/2006, In: Physical Chemistry Chemical Physics. 8, 5, p. 558-562 5 p.

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

  14. Published

    Influence of Coulomb-attenuation on exchange-correlation functional quality

    Peach, M. J. G., Cohen, A. J. & Tozer, D. J., 2006, In: Physical Chemistry Chemical Physics. 8, 39, p. 4543-4549 7 p.

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

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