SIMULATION ON THE EDGE

Project: Research council

Project Details

StatusFinished
Effective start/end date16/02/0515/02/08

Funding

  • Engineering and Physical Sciences Research Council

Research Output

Structural characterization of amorphous alumina and its polymorphs from first-principles XPS and NMR calculations

Lizarraga, R., Holmstrom, E., Parker, S. C. & Arrouvel, C., 14 Mar 2011, In : Physical Review B. 83, 9, 094201.

Research output: Contribution to journalArticle

  • 69 Citations (Scopus)

    The structure and dynamics of hydrated and hydroxylated magnesium oxide nanoparticles

    Spagnoli, D., Allen, J. P. & Parker, S. C., 1 Mar 2011, In : Langmuir. 27, 5, p. 1821-1829 9 p.

    Research output: Contribution to journalArticle

  • 32 Citations (Scopus)

    Atomistic modelling of adsorption and segregation at inorganic solid interfaces

    Allen, J. P., Gren, W., Molinari, M., Arrouvel, C., Maglia, F., Parker, S. C. & Francis, P. (ed.), 2009, In : Molecular Simulation. 35, 7, p. 584-608 25 p.

    Research output: Contribution to journalArticle

  • 18 Citations (Scopus)