All Stories

  1. On the lubricity of transition metal dichalcogenides: an ab initio study

    Article • Nanoscale, January 2017, Royal Society of Chemistry

    Dr Benjamin J Irving

  2. A Copper(I)-Arene Complex With an Unsupported η6Interaction

    Article • Angewandte Chemie International Edition, January 2015, Wiley

    Dr Benjamin J Irving

  3. Communication: A density functional investigation of structure-property evolution in the tetrakis hexahedral C4Al14 nanocluster

    Article • The Journal of Chemical Physics, October 2014, American Institute of Physics

    Dr Benjamin J Irving

  4. Computational Cogitation of Cn@Al12 Clusters

    Article • ChemPhysChem, October 2014, Wiley

    Dr Benjamin J Irving

  5. A computational study of ‘Al-kanes’ and ‘Al-kenes’

    Article • Physical Chemistry Chemical Physics, January 2014, Royal Society of Chemistry

    Dr Benjamin J Irving

  6. On multiple adsorptions of hydrogen atoms on graphene

    Article • Physica Scripta, July 2011, Institute of Physics Publishing

    Dr Benjamin J Irving

  7. Structure–Activity Relationship Refinement and Further Assessment of Indole‐3‐glyoxylamides as a Lead Series against Prion Disease

    Article • ChemMedChem, December 2010, Wiley

    Dr Benjamin J Irving

  8. Comparison of ring currents evaluated consistently at density functional and Hartree–Fock levels

    Article • Molecular Physics, December 2009, Taylor & Francis

    Dr Remco W.A. Havenith, Dr Benjamin J Irving