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Results: 1-25/34
Authors:
Sayle, DC
Watson, GW
Citation: Dc. Sayle et Gw. Watson, The atomistic structures of MgO/SrTiO3(001) and BaO/SrTiO3(001) using simulated amorphization and recrystallization, J PHYS CH B, 105(23), 2001, pp. 5506-5514
Authors:
Watson, GW
Wells, RPK
Willock, DJ
Hutchings, GJ
Citation: Gw. Watson et al., A comparison of the adsorption and diffusion of hydrogen on the {111} surfaces of Ni, Pd, and Pt from density functional theory calculations, J PHYS CH B, 105(21), 2001, pp. 4889-4894
Authors:
Maicaneanu, SA
Sayle, DC
Watson, GW
Citation: Sa. Maicaneanu et al., Evolution and atomistic structure of dislocations defects and clusters within CeO2 supported on ZrO2 (pg 289, 2001), CHEM COMMUN, (6), 2001, pp. 507-507
Authors:
Maicaneanu, SA
Sayle, DC
Watson, GW
Citation: Sa. Maicaneanu et al., Evolution and atomistic structure of dislocations defects and clusters within CeO2 supported on ZrO2 (pg 289, 2001), CHEM COMMUN, (5), 2001, pp. 507-507
Authors:
Watson, GW
Willock, DJ
Citation: Gw. Watson et Dj. Willock, The enumeration of structures for gamma-alumina based on a defective spinel structure, CHEM COMMUN, (12), 2001, pp. 1076-1077
Evolution and atomistic structure of dislocations defects and clusters within CeO2 supported on ZrO2
Authors:
Maicaneanu, SA
Sayle, DC
Watson, GW
Citation: Sa. Maicaneanu et al., Evolution and atomistic structure of dislocations defects and clusters within CeO2 supported on ZrO2, CHEM COMMUN, (03), 2001, pp. 289-290
Authors:
Read, MSD
Islam, MS
Watson, GW
Hancock, FE
Citation: Msd. Read et al., Surface structures and defect properties of pure and doped La2NiO4, J MAT CHEM, 11(10), 2001, pp. 2597-2602
Authors:
Harris, DJ
Watson, GW
Parker, SC
Citation: Dj. Harris et al., Atomistic simulation studies on the effect of pressure on diffusion at theMgO 410/[001] tilt grain boundary - art. no. 134101, PHYS REV B, 6413(13), 2001, pp. 4101
Authors:
Watson, GW
Oliver, PM
Parker, SC
Citation: Gw. Watson et al., Atomistic simulation of crystal growth at the a < 1 0 0 > screw dislocation terminating at the {100} surface of MgO, SURF SCI, 474(1-3), 2001, pp. L185-L190
Authors:
Sayle, DC
Watson, GW
Citation: Dc. Sayle et Gw. Watson, Structural exploration of thin-film oxide interfaces via 'simulated amorphisation and recrystallisation', SURF SCI, 473(1-2), 2001, pp. 97-107
Authors:
Foldi, I
Watson, GW
Citation: I. Foldi et Gw. Watson, A new pest scale insect on avocado trees in Colombia, Laurencella colombiana, sp n. (Hemiptera : Coccoidea : Margarodidae), ANN SOC ENT, 37(3), 2001, pp. 367-374
Authors:
Watson, GW
Citation: Gw. Watson, The origin of the electron distribution in SnO, J CHEM PHYS, 114(2), 2001, pp. 758-763
Authors:
Jepson, NJA
Moynihan, PJ
Kelly, PJ
Watson, GW
Thomason, JM
Citation: Nja. Jepson et al., Caries incidence following restoration of shortened lower dental arches ina randomized controlled trial, BR DENT J, 191(3), 2001, pp. 140-144
Authors:
Watson, GW
Wells, RPK
Willock, DJ
Hutchings, GJ
Citation: Gw. Watson et al., Density functional theory calculations on the interaction of ethene with the {111} surface of platinum, J PHYS CH B, 104(27), 2000, pp. 6439-6446
Authors:
Robinson, DJ
Davies, L
McGuire, N
Lee, DF
McMorn, P
Willock, DJ
Watson, GW
Page, PCB
Bethell, D
Hutchings, GJ
Citation: Dj. Robinson et al., Oxidation of thioethers and sulfoxides with hydrogen peroxide using TS-1 as catalyst, PHYS CHEM P, 2(7), 2000, pp. 1523-1529
Authors:
Sayle, DC
Watson, GW
Citation: Dc. Sayle et Gw. Watson, Dislocations, lattice slip, defects and rotated domains: The effect of a lattice misfit on supported thin-film metal oxides, PHYS CHEM P, 2(23), 2000, pp. 5491-5499
Authors:
Watson, GW
Wells, RPK
Willock, DJ
Hutchings, GJ
Citation: Gw. Watson et al., Ab initio simulation of the interaction of hydrogen with the {111} surfaces of platinum, palladium and nickel. A possible explanation for their difference in hydrogenation activity, CHEM COMMUN, (8), 2000, pp. 705-706
Authors:
Harris, DJ
Harding, JH
Watson, GW
Citation: Dj. Harris et al., Computer simulation of the reactive element effect in NiO grain boundaries, ACT MATER, 48(12), 2000, pp. 3039-3048
Authors:
Sayle, DC
Catlow, CRA
Harding, JH
Healy, MJF
Maicaneanu, SA
Parker, SC
Slater, B
Watson, GW
Citation: Dc. Sayle et al., Atomistic simulation methodologies for modelling the nucleation, growth and structure of interfaces, J MAT CHEM, 10(6), 2000, pp. 1315-1324
Authors:
Sayle, DC
Watson, GW
Citation: Dc. Sayle et Gw. Watson, Simulated amorphisation and recrystallisation: nanocrystallites within meso-scale supported oxides, J MAT CHEM, 10(10), 2000, pp. 2241-2243
Authors:
Read, MSD
Islam, MS
Watson, GW
King, F
Hancock, FE
Citation: Msd. Read et al., Defect chemistry and surface properties of LaCoO3, J MAT CHEM, 10(10), 2000, pp. 2298-2305
Authors:
Watson, GW
Wall, A
Parker, SC
Citation: Gw. Watson et al., Atomistic simulation of the effect of temperature and pressure on point defect formation in MgSiO3 perovskite and the stability of CaSiO3 perovskite, J PHYS-COND, 12(39), 2000, pp. 8427-8438
Authors:
Bankhead, M
Watson, GW
Hutchings, GJ
Scott, J
Willock, DJ
Citation: M. Bankhead et al., Calculation of the energy profile for the fluorination of dichloromethane over an alpha-alumina catalyst, APP CATAL A, 200(1-2), 2000, pp. 263-274
Authors:
Watson, GW
Wells, RPK
Willock, DJ
Hutchings, GJ
Citation: Gw. Watson et al., pi adsorption of ethene on to the {111} surface of copper - A periodic ab initio study of the effect of k-point sampling on the energy, atomic and electronic structure, SURF SCI, 459(1-2), 2000, pp. 93-103
Authors:
de Leeuw, NH
Purton, JA
Parker, SC
Watson, GW
Kresse, G
Citation: Nh. De Leeuw et al., Density functional theory calculations of adsorption of water at calcium oxide and calcium fluoride surfaces, SURF SCI, 452(1-3), 2000, pp. 9-19