Ian R. McDonald
Affiliations: | Physical Chemistry | University of Cambridge, Cambridge, England, United Kingdom |
Website:
http://www-jmg.ch.cam.ac.uk/oldchem/staff/irm.htmlGoogle:
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Publications
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Sergi A, Ferrario M, Buda F, et al. (2000) Structure of phosphorus-selenium glasses: Results from ab initio molecular dynamics simulations Molecular Physics. 98: 701-707 |
Sergi A, Ferrario M, Buda F, et al. (1996) First-principles simulation of phosphorus - Selenium systems Chemical Physics Letters. 259: 301-306 |
Ferrario M, Klein ML, McDonald IR. (1995) Cation transport in lithium sulphate based crystals Molecular Physics. 86: 923-938 |
Sergi A, Ferrario M, Elliott SR, et al. (1995) Molecular dynamics study of the plastic-crystalline phase transition of tetraphosphorus triselenide Molecular Physics. 84: 727-742 |
Ferrario M, Lynden-Bell RM, McDonald IR. (1994) Structural fluctuations and the order-disorder phase transition in calcite Journal of Physics: Condensed Matter. 6: 1345-1358 |
Ryckaert JP, Klein ML, McDonald IR. (1994) Computer simulations and the interpretation of incoherent neutron scattering experiments on the solid rotator phases of long-chain alkanes Molecular Physics. 83: 439-458 |
Siepmann JI, McDonald IR. (1993) Monte Carlo simulation of the mechanical relaxation of a self-assembled monolayer. Physical Review Letters. 70: 453-456 |
Ilja Siepmann J, McDonald IR. (1993) Monte carlo study of the properties of self-assembled monolayers formed by adsorption of CH3(CH2)15 SH on the (111) surface of gold Molecular Physics. 79: 457-473 |
Hammonds KD, McDonald IR, Tildesley DJ. (1993) Computational studies of the structure of monolayers of chlorine physisorbed on the basal plane of graphite Molecular Physics. 78: 173-189 |
Siepmann JI, McDonald IR. (1993) Domain formation and system-size dependence in simulations of self-assembled monolayers Langmuir. 9: 2251-2355 |