Publications
247 results found
Horsfield AP, Finnis M, Foulkes M, et al., 2008, Correlated electron-ion dynamics in metallic systems, Computational Materials Science, Vol: 44, Pages: 16-20
Pruessner G, Sutton AP, 2008, Phase field modelling of interfaces from first principles, Symposium on Interfacial Nanostructures in Ceramics held at the 2007 E-MRS Spring Meeting, Publisher: IOP PUBLISHING LTD, ISSN: 1742-6588
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- Citations: 1
Von Alfthan S, Kaski K, Sutton AP, 2007, Molecular dynamics simulations of temperature-induced structural transitions at twist boundaries in silicon, PHYSICAL REVIEW B, Vol: 76, ISSN: 1098-0121
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- Citations: 43
Zhou Z, Dudarev SL, Jenkins ML, et al., 2007, Diffraction imaging and diffuse scattering by small dislocation loops, 12th International Conference on Fusion Reactor Materials (ICFRM-12), Publisher: ELSEVIER, Pages: 305-310, ISSN: 0022-3115
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- Citations: 9
Rudd RE, Briggs GAD, Sutton AP, et al., 2007, Equilibrium distributions and the nanostructure diagram for epitaxial quantum dots, JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE, Vol: 4, Pages: 335-347, ISSN: 1546-1955
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- Citations: 3
Rudd RE, Mason DR, Sutton AP, 2007, Lanczos and recursion techniques for multiscale kinetic Monte Carlo simulations, PROGRESS IN MATERIALS SCIENCE, Vol: 52, Pages: 319-332, ISSN: 0079-6425
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- Citations: 6
Valladares A, Sutton AP, 2007, First principles simulations of kink defects on the SP 90° partial dislocation in silicon, PROGRESS IN MATERIALS SCIENCE, Vol: 52, Pages: 421-463, ISSN: 0079-6425
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- Citations: 4
Mason DR, Le Page J, Race C, et al., 2007, Electronic damping of atomic dynamics in irradiation damage of metals, J. Phys.: Condens. Matter, Vol: 19, Pages: 436209-1-436209-13
Zhou Z, Jenkins ML, Dudarev SL, et al., 2006, Simulations of weak-beam diffraction contrast images of dislocation loops by the many-beam Howie-Basinski equations, PHILOSOPHICAL MAGAZINE, Vol: 86, Pages: 4851-4881, ISSN: 1478-6435
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- Citations: 32
Kirk MA, Jenkins ML, Zhou Z, et al., 2006, Diffuse elastic scattering of electrons by individual nanometer-sized dislocation loops, PHILOSOPHICAL MAGAZINE, Vol: 86, Pages: 4797-4808, ISSN: 1478-6435
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- Citations: 4
von Alfthan S, Kaski K, Sutton AP, 2006, Order and structural units in simulations of twist grain boundaries in silicon at absolute zero, PHYSICAL REVIEW B, Vol: 74, ISSN: 2469-9950
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- Citations: 28
Hudson TS, Dudarev SL, Caturlas MJ, et al., 2006, Effects of elastic interactions on post-cascade radiation damage evolution in kinetic Monte Carlo simulations, Symposium on Microstructural Process in Irradiated Materials held at the Annual Meeting of the Minerals-Metals-and-Materials-Society, Publisher: TAYLOR & FRANCIS LTD, Pages: 661-675, ISSN: 1478-6435
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- Citations: 29
Jenkins ML, Zhou Z, Dudarev SL, et al., 2006, Electron microscope weak-beam imaging of stacking fault tetrahedra: observations and simulations, 10th Meeting on Frontiers of Electron Microscopy in Materials Science, Publisher: SPRINGER, Pages: 4445-4453, ISSN: 0022-2461
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- Citations: 4
Kumpula JM, Sutton AP, Kaski K, 2006, Using the quantized mean-field method to model Joule heating in a short nano-conductor, CHEMICAL PHYSICS, Vol: 324, Pages: 659-666, ISSN: 0301-0104
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- Citations: 1
Sutton AP, 2006, European Union and The US National Science Foundation - Preface, MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING, Vol: 422, Pages: 1-2, ISSN: 0921-5093
Hudson TS, Nguyen-Manh D, van Duin ACT, et al., 2006, Grand canonical Monte Carlo simulations of intergranular glassy films in β silicon nitride, MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING, Vol: 422, Pages: 123-135, ISSN: 0921-5093
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- Citations: 16
Valladares A, Sutton AP, 2006, First principles simulations of antiphase defects on the SP 90° partial dislocation in silicon, JOURNAL OF PHYSICS-CONDENSED MATTER, Vol: 18, Pages: 3735-3744, ISSN: 0953-8984
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- Citations: 5
von Alfthan S, Haynes PD, Kaski K, et al., 2006, Are the structures of twist grain boundaries in silicon ordered at 0 K?, PHYS REV LETT, Vol: 96, ISSN: 0031-9007
Contrary to previous simulation results on the existence of amorphous intergranular films at high-angle twist grain boundaries (GBs) in elemental solids such as silicon, recent experimental results imply structural order in some high-angle boundaries. With a novel protocol for simulating twist GBs, which allows the number of atoms at the boundary to vary, we have found new low-energy ordered structures. We give a detailed exposition of the results for the simplest boundary. The validity of our results is confirmed by first-principles calculations.
Zhou Z, Sutton AP, Dudarev SL, et al., 2005, Simulations of electron elastic diffuse scattering patterns from individual nanometre-sized dislocation loops. I. Kinematical methodology, PROCEEDINGS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, Vol: 461, Pages: 3935-3953, ISSN: 1364-5021
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- Citations: 6
Valladares A, Sutton AP, 2005, The equilibrium structures of the 90° partial dislocation in silicon, JOURNAL OF PHYSICS-CONDENSED MATTER, Vol: 17, Pages: 7547-7559, ISSN: 0953-8984
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- Citations: 11
Mason DR, Sutton AP, 2005, Computational steering in Monte Carlo simulations of thin film polystyrene, PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, Vol: 363, Pages: 1961-1974, ISSN: 1364-503X
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- Citations: 3
Zhou Z, Dudarev SL, Jenkins ML, et al., 2005, On the atomic displacement fields of small interstitial dislocation loops, Intenational Conference on Fundamentals of Plastic Deformation, Publisher: ELSEVIER SCIENCE SA, Pages: 80-83, ISSN: 0921-5093
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- Citations: 5
von Alfthan S, Sutton AP, Kuronen A, et al., 2005, Stability and crystallization of amorphous clusters in crystalline Si, JOURNAL OF PHYSICS-CONDENSED MATTER, Vol: 17, Pages: 4263-4270, ISSN: 0953-8984
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- Citations: 1
Mason DR, Hudson TS, Sutton AP, 2005, Fast recall of state-history in kinetic Monte Carlo simulations utilizing the Zobrist key, COMPUTER PHYSICS COMMUNICATIONS, Vol: 165, Pages: 37-48, ISSN: 0010-4655
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- Citations: 11
Dudarev SL, Zhou Z, Sutton AP, et al., 2005, Electron Dynamical Diffraction Imaging and Diffuse Scattering by Small Dislocation Loops, Publisher: INT UNION CRYSTALLOGRAPHY, Pages: C116-C116, ISSN: 2053-2733
Burlakov VM, Briggs GAD, Sutton AP, et al., 2004, Modeling phase separation in nonstoichiometric silica, PHYSICAL REVIEW LETTERS, Vol: 93, ISSN: 0031-9007
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- Citations: 17
Hudson TS, Dudarev SL, Sutton AP, 2004, Confinement of interstitial cluster diffusion by oversized solute atoms, PROCEEDINGS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, Vol: 460, Pages: 2457-2475, ISSN: 1364-5021
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- Citations: 23
Hudson TS, Dudarev SL, Sutton AP, 2004, Suppression of interstitial cluster diffusion by oversized solute atoms, 11th International Conference on Fusion Reactor Materials (ICFRM), Publisher: ELSEVIER, Pages: 971-976, ISSN: 0022-3115
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- Citations: 4
Mason DR, Rudd RE, Sutton AP, 2004, Atomistic modelling of diffusional phase transformations with elastic strain, JOURNAL OF PHYSICS-CONDENSED MATTER, Vol: 16, Pages: S2679-S2697, ISSN: 0953-8984
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- Citations: 18
Mason DR, Rudd RE, Sutton AP, 2004, Stochastic kinetic Monte Carlo algorithms for long-range Hamiltonians, COMPUTER PHYSICS COMMUNICATIONS, Vol: 160, Pages: 140-157, ISSN: 0010-4655
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- Citations: 31
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