Publications 2008

2008 (59 articles)

A. Droghetti, C. D. Pemmaraju, S. Sanvito, " Predictingd0magnetism: Self-interaction correction scheme", Phys. Rev. B, 78, 2008 , , Source
Ahmed M. El-Nahas, John M. Simmie, Maria V. Navarro, Joseph W. Bozzelli, Grainne Black, Henry J. Curran, " Thermochemistry and kinetics of acetonylperoxy radical isomerisation and decomposition: a quantum chemistry and CVT/SCT approach", Phys. Chem. Chem. Phys., 10, 2008 , 7139, Source
Amy FitzGerald, Diarmuid P. ODonoghue, " Genetic Repair for Optimization under Constraints Inspired by Arabidopsis Thaliana", Parallel Problem Solving from Nature - PPSN X, book, 2008 , 399--408, Source
Angela McCann, James A. Cotton, James O. McInerney, " The tree of genomes: An empirical comparison of genome phylogeny reconstruction methods.", BMC Evolutionary Biology, 8, 2008 , 312, Source
B. Reville, S. O'Sullivan, P. Duffy, J. G. Kirk, " The transport of cosmic rays in self-excited magnetic turbulence", Monthly Notices of the Royal Astronomical Society, 386, 2008 , 509--515, Source
C. D. Pemmaraju, R. Hanafin, T. Archer, H. B. Braun, S. Sanvito, " Impurity-ion pair induced high-temperature ferromagnetism in Co-doped ZnO", Phys. Rev. B, 78, 2008 , , Source
C. D. Pemmaraju, S. Sanvito, K. Burke, " Polarizability of molecular chains: A self-interaction correction approach", Phys. Rev. B, 77, 2008 , , Source
Christopher Bean, Ivan Lokmer, Gareth O'Brien, " Influence of near-surface volcanic structure on long-period seismic signals and on moment tensor inversions: Simulated examples from Mount Etna", Journal of Geophysical Research, 113, 2008 , , Source
Colin Torney, Zoltan Neufeld, " Phototactic Clustering of Swimming Microorganisms in a Turbulent Velocity Field", Phys. Rev. Lett., 101, 2008 , , Source
C. Toher, S. Sanvito, " Effects of self-interaction corrections on the transport properties of phenyl-based molecular junctions", Phys. Rev. B, 77, 2008 , , Source
Damien Thompson, Charlotte Miller, Florence O. McCarthy, " Computer Simulations Reveal a Novel Nucleotide-Type Binding Orientation for Ellipticine-Based Anticancer c-kit Kinase Inhibitors", Biochemistry, 47, 2008 , 10333--10344, Source
David A Fitzpatrick, Mary E Logue, Geraldine Butler, " Evidence of recent interkingdom horizontal gene transfer between bacteria and Candida parapsilosis", BMC Evolutionary Biology, 8, 2008 , 181, Source
Dmitriy S. Ivanov, Baerbel Rethfeld, Gerard M. OConnor, Thomas J. Glynn, Alexey N. Volkov, Leonid V. Zhigilei, " The mechanism of nanobump formation in femtosecond pulse laser nanostructuring of thin metal films", Applied Physics A, 92, 2008 , 791--796, Source
D Thirumalai, N Buchete, J Straub, " On the Development of Coarse-Grained Protein Models", Coarse-Graining of Condensed Phase and Biomolecular Systems, book, 2008 , 141--156, Source
D. Thompson, " The Effective Concentration of Unbound Ink Anchors at the Molecular Printboard", J. Phys. Chem. B, 112, 2008 , 4994--4999, Source
E. Chikoidze, M. Nolan, M. Modreanu, V. Sallet, P. Galtier, " Effect of chlorine doping on electrical and optical properties of ZnO thin films", Thin Solid Films, 516, 2008 , 8146--8149, Source
Erez N. Ribak, Szymon Gladysz, " Fainter and closer: finding planets by symmetry breaking", Optics Express, 16, 2008 , 15553, Source
Fergal P. Casey, Gerard Cagney, Nevan J. Krogan, Denis C. Shields, " Optimal stepwise experimental design for pairwise functional interaction studies", Bioinformatics, 24, 2008 , 2733--2739, Source
Gary W. Delaney, Stefan Hutzler, Tomaso Aste, " Relation Between Grain Shape and Fractal Properties in Random Apollonian Packing with Grain Rotation", Physical Review Letters, 101, 2008 , , Source
George A. Gravvanis, " High Performance Inverse Preconditioning", Archives of Computational Methods in Engineering, 16, 2008 , 77--108, Source
G. Gannon, J. A. Larsson, J. C. Greer, D. Thompson, " Guanidinium Chloride Molecular Diffusion in Aqueous and Mixed Water-Ethanol Solutions", J. Phys. Chem. B, 112, 2008 , 8906--8911, Source
Giovanni Bellesia, Maxim V. Fedorov, Edward G. Timoshenko, " Structural transitions in model $upbeta$-sheet tapes,", The Journal of Chemical Physics, 128, 2008 , 195105, Source
G. Kells, A. T. Bolukbasi, V. Lahtinen, J. K. Slingerland, J. K. Pachos, J. Vala, " Topological Degeneracy and Vortex Manipulation in Kitaevs Honeycomb Model", Phys. Rev. Lett., 101, 2008 , , Source
G. S. O'Brien, C. J. Bean, " Seismicity on volcanoes generated by gas slug ascent", Geophysical Research Letters, 35, 2008 , , Source
G. S. O'Brien, " Discrete visco-elastic lattice methods for seismic wave propagation", Geophysical Research Letters, 35, 2008 , , Source
Ivan Lokmer, Gilberto Saccorotti, Bellina Di Lieto, Christopher J. Bean, " Temporal evolution of long-period seismicity at Etna Volcano", Earth and Planetary Science Letters, 266, 2008 , 205--220, Source
Ivan Rungger, Stefano Sanvito, " Algorithm for the construction of self-energies for electronic transport calculations based on singularity elimination and singular value decomposition", Phys. Rev. B, 78, 2008 , , Source
James M. Rondinelli, Nuala M. Caffrey, Stefano Sanvito, Nicola A. Spaldin, " Electronic properties of bulk and thin filmSrRuO3: Search for the metal-insulator transition", Phys. Rev. B, 78, 2008 , , Source
J. Andreas Larsson, Simon D. Elliott, James C. Greer, Jascha Repp, Gerhard Meyer, Rolf Allenspach, " Orientation of individualC60molecules adsorbed on Cu(111): Low-temperature scanning tunneling microscopy and density functional calculations", Phys. Rev. B, 77, 2008 , , Source
John M. Simmie, Grainne Black, Henry J. Curran, John P. Hinde, " Enthalpies of Formation and Bond Dissociation Energies of Lower Alkyl Hydroperoxides and Related Hydroperoxy and Alkoxy Radicals", J. Phys. Chem. A, 112, 2008 , 5010--5016, Source
John M. Simmie, Wayne K. Metcalfe, Henry J. Curran, " Ketene Thermochemistry", ChemPhysChem, 9, 2008 , 700--702, Source
K. Muthukumar, J. A. Larsson, " A Density Functional Study of Ce@C82:~ Explanation of the Ce Preferential Bonding Site", J. Phys. Chem. A, 112, 2008 , 1071--1075, Source
K. Muthukumar, J. A. Larsson, " Explanation of the different preferential binding sites for Ce and La in M2@C80 (M ", Journal of Materials Chemistry, 18, 2008 , 3347, Source
Konstantinos Drakakis, Scott Rickard, James K. Beard, Rodrigo Caballero, Francesco Iorio, Gareth O'Brien, John Walsh, " Results of the Enumeration of Costas Arrays of Order 27", IEEE Transactions on Information Theory, 54, 2008 , 4684--4687, Source
Maria Stamenova, Tchavdar N. Todorov, Stefano Sanvito, " Newtonian origin of the spin motive force in ferromagnetic atomic wires", Phys. Rev. B, 77, 2008 , , Source
M. E. Dieckmann, P. K. Shukla, L. O. C. Drury, " The Formation of a Relativistic Partially Electromagnetic Planar Plasma Shock", The Astrophysical Journal, 675, 2008 , 586--595, Source
M. E. Dieckmann, " The formation of relativistic plasma structures and their potential role in the generation of cosmic ray electrons", Nonlinear Processes in Geophysics, 15, 2008 , 831--846, Source
M. Grimaldi, F. Cummins, " Speaker Identification Using Instantaneous Frequencies", IEEE Transactions on Audio, 16, 2008 , 1097--1111, Source
Michael Nolan, " Defects in Cu2O", Thin Solid Films, 516, 2008 , 8130--8135, Source
Michael Nolan, Simon D. Elliott, James S. Mulley, Roger A. Bennett, Mark Basham, Paul Mulheran, " Electronic structure of point defects in controlled self-doping of theTiO2(110) surface: Combined photoemission spectroscopy and density functional theory study", Phys. Rev. B, 77, 2008 , , Source
Michael Nolan, Simon D. Elliott, " Tuning the electronic structure of the transparent conducting oxide Cu2O", Thin Solid Films, 516, 2008 , 1468--1472, Source
Michael Nolan, Simon D. Elliott, " Tuning the Transparency of Cu2O with Substitutional Cation Doping", Chemistry of Materials, 20, 2008 , 5522--5531, Source
Michael Nolan, Victor Soto Verdugo, Horia Metiu, " Vacancy formation and CO adsorption on gold-doped ceria surfaces", Surface Science, 602, 2008 , 2734--2742, Source
Niall J. English, " Effect of electrostatics techniques on the estimation of thermal conductivity via equilibrium molecular dynamics simulation: application to methane hydrate", Molecular Physics, 106, 2008 , 1887--1898, Source
Noeleen B Loughran, Brendan O'Connor, Ciaran O'Fagain, Mary J O'Connell, " The phylogeny of the Mammalian Heme Peroxidases and the evolution of their diverse functions", BMC Evolutionary Biology, 8, 2008 , 101, Source
Pierre-Franccois Roux, David Marsan, Jean-Philippe Metaxian, Gareth OBrien, Luc Moreau, " Microseismic activity within a serac zone in an alpine glacier (Glacier dArgenti`ere", Journal of Glaciology, 54, 2008 , 157--168, Source
Rubik Asatryan, Joseph W. Bozzelli, John M. Simmie, " Thermochemistry of Methyl and Ethyl Nitro", J. Phys. Chem. A, 112, 2008 , 3172--3185, Source
S. Dooley, H.J. Curran, J.M. Simmie, " Autoignition measurements and a validated kinetic model for the biodiesel surrogate", Combustion and Flame, 153, 2008 , 2--32, Source
Shiyu Wang, Ray McGrath, Jenny Hanafin, Peter Lynch, Tido Semmler, Paul Nolan, " The impact of climate change on storm surges over Irish waters", Ocean Modelling, 25, 2008 , 83--94, Source
Susan Steele-Dunne, Peter Lynch, Ray McGrath, Tido Semmler, Shiyu Wang, Jenny Hanafin, Paul Nolan, " The impacts of climate change on hydrology in Ireland", Journal of Hydrology, 356, 2008 , 28--45, Source
Szymon Gladysz, Julian C. Christou, " Detection of Faint Companions through Stochastic Speckle Discrimination", The Astrophysical Journal, 684, 2008 , 1486--1495, Source
Szymon Gladysz, Julian C. Christou, L. William Bradford, Lewis C. Roberts, " Temporal Variability and Statistics of the Strehl Ratio in Adaptive-Optics Images", Publications of the Astronomical Society of the Pacific, 120, 2008 , 1132--1143, Source
Thomas Archer, Ruairi Hanafin, Stefano Sanvito, " Magnetism of CoO polymorphs: Density functional theory and Monte Carlo simulations", Phys. Rev. B, 78, 2008 , , Source
Tido Semmler, Saji Varghese, Ray McGrath, Paul Nolan, Shiyu Wang, Peter Lynch, Colin O'Dowd, " Regional model simulation of North Atlantic cyclones: Present climate and idealized response to increased sea surface temperature", Journal of Geophysical Research, 113, 2008 , , Source
T Semmler, S Varghese, R McGrath, P Nolan, S Wang, P Lynch, C O’Dowd, " Regional climate model simulations of North Atlantic cyclones: frequency and intensity changes", Climate Research, 36, 2008 , 1--16, Source
Ville Lahtinen, Graham Kells, Angelo Carollo, Tim Stitt, Jiri Vala, Jiannis K. Pachos, " Spectrum of the non-abelian phase in Kitaevs honeycomb lattice model", Annals of Physics, 323, 2008 , 2286--2310, Source
W. GyHorffy, R. J. Bartlett, J. C. Greer, " Monte Carlo configuration interaction predictions for the electronic spectra of Ne", J. Chem. Phys., 129, 2008 , 064103, Source
Zhonglai Li, J. Andreas Larsson, Peter Larsson, Rajeev Ahuja, Joseph M. Tobin, Justin OByrne, Michael A. Morris, Gary Attard, Justin D. Holmes, " Copper/Molybdenum Nanocomposite Particles as Catalysts for the Growth of Bamboo-Structured Carbon Nanotubes", J. Phys. Chem. C, 112, 2008 , 12201--12206, Source

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