Year 2009
-
Ring currents in azulene
A. T. Paxton, T. N. Todorov and A. M. Elena, Chemical Physics Letters,
483, 154-8
- Atomistic
studies of <101] screw dislocation core structures and glide in γ-TiAl
I. H. Katzarov and A. T. Paxton, Philosophical Magazine, 89, 1731-1750
- Atomistic
studies of interactions between the dominant lattice
dislocations and γ / γ lamellar boundaries in
γ-TiAl
I. H. Katzarov and A. T. Paxton, Acta Materialia, 57, 3349-3366
- An introduction to the tight binding
approximation---implementation by diagonalisation
A. T. Paxton, Lecture notes
Winter School: Multiscale Simulation Methods in Molecular Sciences,
Forschungszentrum Jülich, 2-6 March 2009
Year 2008
Year 2007
Year 2006
Year 2005
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Proceedings of the Eleventh International Conference on Intergranular and Interphase Boundaries 2004
A. T. Paxton and M. W. Finnis, Guest Editors,
J. Mat. Sci., 40, 3045-3257
-
Stability of Sr adatom model structures for SrTiO3 (001) surface reconstructions
Leandro M. Liborio, Cristián G. Sánchez, A. T. Paxton and M. W. Finnis
J. Phys.: Condens. Matter, Letters, 17, L223-L230
- Theory of the near K-edge structure in electron energy loss spectroscopy,
A. T. Paxton
J. Electron Spectroscopy and Related Phenomena, 143/2-3, 53-66
Year 2004
Year 2003
- Study of Dislocations and Stress in Silicon-On-Insulator tubs using
Transmission Electron Microscopy and Finite Element modelling.
A.J. McMullan, D. O'Mahoney, W.A. Nevin, A.T.Paxton and J.M. Gregg
Semiconductor Wafer Bonding VII: Science, Technology,
and Applications eds.: F. S. Bengtsson, H. Baumgart,
C. E. Hunt, and T. Suga,
(The Electrochemical Society, Pennington, NJ)
- Bandstructure approach to near edge structure
AT Paxton, AJ Craven, JM Gregg and DW McComb,
J. Microscopy, 210, 35
Year 2002
- A stabilisation mechanism of zirconia based on oxygen vacancies only
S Fabris, AT Paxton and MW Finnis
Acta Materialia 50, 5171-5178
- The use of XANES and ELNES for the
characterisation of stabilised zirconia
DW McComb, S Ostanin, D Vlachos, AJ Craven, MW Finnis, AT Paxton and A Alavi
in "Electrically Based Microstructural Characterization III,"
volume 699 from the MRS Symposium Proceedings Series (2001 Fall Meeting) Edited by Rosario A. Gerhardt et al. (Materials Research Society, Warrendale, PA, USA) R8.2.1-6
- Electron energy loss near edge shape as a probe to investigate the stabilisation of yttria-stabilised zirconia
S Ostanin, AJ Craven, DW McComb, D Vlachos, A Alavi, AT Paxton and MW Finnis
Phys. Rev. B 65, 224109
Year 2001
- Material effects on stress-induced defect generation in trenched silicon-on-insulator
WA Nevin, K Somasundram, P McCann, S Magee and AT
Paxton
J. Electrochem. Soc., 148, G649-G654
- Free energy and molecular dynamics calculations for the cubic-tetragonal phase transition in zirconia
S Fabris, AT Paxton and MW Finnis
Phys. Rev. B 63, 94101-94114
- Simulation of a grain boundary in zirconia
MW Finnis and AT Paxton
in "Structure-property relationships of oxide surfaces and interfaces,"
volume 654 from the MRS Symposium Proceedings Series (2000 Fall Meeting) Edited by CB Carter et al. (Materials Research Society, Warrendale, PA, USA) AA1.5.1-7
- Effect of relaxation on the oxygen K-edge electron
energy loss near edge structure in yttria-stabilised
zirconia
S Ostanin, AJ Craven, DW McComb, D Vlachos, A Alavi,
MW Finnis and AT Paxton
Phys. Rev. B, 62, 14728
Year 2000
- Effect of material properties on stress-induced defect
generation in trenched silicon-on-insulator
WA Nevin, K Somasundram, S Blackstone, S Magee and
AT Paxton
6th International conference on High Purity Silicon,
Phoenix, Oct 2000
-
The near-edge structure in energy loss spectroscopy:
many-electron and magnetic effects in transition metal
nitrides and carbides
AT Paxton, M van Schilfgaarde, M MacKenzie and
AJ Craven
J. Phys.: Condens. Matter, 12, 729-750
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Relative energetics and structural properties of zirconia using a self-consistent tight-binding model
S. Fabris, AT Paxton and MW Finnis
Phys. Rev. B, 61, 6617-6630
Year 1999
Year 1998
- Electronic structure of reduced titanium dioxide
AT Paxton and L Thiên-Nga
Phys. Rev. B, 57, 1579-84
- Rôle of planar fault energies in the yield stress anomaly in intermetallics
AT Paxton and YQ Sun
Phil. Mag. A, 78, 85-103
- Self-consistent tight-binding approximation including polarisable ions
M.W. Finnis, A.T. Paxton, M. Methfessel and M van Schilfgaarde,
in 'Tight binding approach to computational materials science,' volume
491 from the MRS Symposium Proceedings Series (1997 Fall Meeting)
Edited by PEA Turchi et al.
(Materials Research Society, Warrendale, PA, USA)
- Electronic structure of 5d transition metals adsorbed on the stoichiometric (110) rutile surface
L Thiên-Nga and AT Paxton
Phys. Rev. B, 58, 13233-41
- The stabilising rôle of itinerant ferromagnetism in inter-granular cohesion in iron
D Yesilleten, M Nastar, TA Arias, AT Paxton and S Yip
Phys. Rev. Letters, 81, 2988-92
- The crystal structures of zirconia from first principles and self consistent tight binding
MW Finnis, AT Paxton, M Methfessel and M van Schilfgaarde
Phys. Rev. Letters, 81 5149-52
Year 1997
Year 1996
- Atomic Structure of metallic interfaces
AT Paxton
J. Phys. D: Appl. Phys., 29, 1689-98
- Ballistic conductance in magnetic multilayers
EY Tsymbal, AM Bratkovsky, AT Paxton and DG Pettifor
Presented at MRS Spring Meeting, San Francisco
Year 1995
- How dislocations affect transport
AT Paxton, A Sher, M Berding, M van Schilfgaarde
and MW Muller
J. Electronic Materials, 24, 525--532
- The impossibility of pseudotwinning in B2 alloys
AT Paxton
Acta Metall. et Mater., 43, 2133--6
- On the phase stability of transition metal
trialuminide compounds
D Nguyen Manh, AT Paxton, DG Pettifor and A Pasturel
Intermetallics, 3, 9-14
- Electronic-structure and phase-stability study in the Ni-Ti system
A Pasturel, C Colinet, D Nguyen Manh, AT Paxton, M van Schilfgaarde
Phys. Rev. B, 52, 15176-90
Tony Paxton