Trinity College Dublin

Publications 1996

15. Zhang X., Xu S.Y., Lu W.H., Ong C.K., Parker S.C. and Watson G.W.
    'Pressure induced structural changes in HgBa ₂ CaCu ₂ O _6+delta'
    Physica C 266, 165-172 (1996)
    


14. De Boer K., Jansen A.P.J., van Santen R.A., Watson G.W. and Parker S.C.
    'Free-energy calculations of thermodynamic, vibrational and structural properties of alpha-quartz at variable pressures and temperatures'
    Phys. Rev. B 54, 826-835 (1996)
    


13. Harris D.J., Watson G.W. and Parker S.C.
    'Atomistic simulation of the effect of temperature and pressure on the [001] symmetric tilt grain boundaries of MgO'
    Philosophical Magazine A 74, 407-418 (1996)
    


12. de Leeuw N.H., Watson G.W. and Parker S.C.
    'Atomistic simulation of adsorption of water on three-, four- and five-coordinated surface sites of magnesium oxide'
    Journal of the Chemical Society, Faraday Transactions 92, 2081-2091 (1996)
    


11. Watson G.W., Kelsey E.T., de Leeuw N.H., Harris D.J. and Parker S.C.
    'Atomistic simulation of dislocations, surfaces and interfaces in MgO'
    J. Chem. Soc., Faraday Trans., 92, 433-438 (1996)