Aaron Martin, Roisin D. Moriarty, Conor Long, Robert J. Forster, Tia E. Keyes, "Naphthyridyl‐Substituted 4,4‐Difluoro‐4‐bora‐3a,4a‐diaza‐s‐indacene (BODIPY) Luminophores: Photophysics and Application as Molecular Imaging Probes in Live Cells", Asian Journal of Organic Chemistry, 2, 2013, 763-778, Source
Abdallah I. Hassaballah, Mohsen A. Hassan, Azizi N. Mardi, Mohd Hamdi, "An Inverse Finite Element Method for Determining the Tissue Compressibility of Human Left Ventricular Wall during the Cardiac Cycle", PLoS ONE, 8, 2013, e82703, Source
Agnieszka Indiana Olbert, Stephen Nash, Conleth Cunnane, Michael Hartnett, "Tide–surge interactions and their effects on total sea levels in Irish coastal waters", Ocean Dynamics, 63, 2013, 599-614, Source
Alessandro Amato, Gert Aarts, Chris Allton, Pietro Giudice, Simon Hands, Jon-Ivar Skullerud, "Electrical Conductivity of the Quark-Gluon Plasma Across the Deconfinement Transition", Physical Review Letters, 111, 2013, , Source
Alexey Boyarsky, Denys Malyshev, Oleg Ruchayskiy, "Spectral and spatial variations of the diffuse γ-ray background in the vicinity of the Galactic plane and possible nature of the feature at 130 GeV", Physics of the Dark Universe, 2, 2013, 90-96, Source
Alin Marin Elena, Simone Meloni, Giovanni Ciccotti, "Equilibrium and Rate Constants, and Reaction Mechanism of the HF Dissociation in the HF(H2O)7 Cluster by ab Initio Rare Event Simulations", The Journal of Physical Chemistry A, 117, 2013, 13039-13050, Source
Anna Iwaszuk, Michael Nolan, "SnO-nanocluster modified anatase TiO2 photocatalyst: exploiting the Sn(ii) lone pair for a new photocatalyst material with visible light absorption and charge carrier separation", Journal of Materials Chemistry A, 1, 2013, 6670, Source
Anna Iwaszuk, Michael Nolan, "Lead oxide-modified TiO2 photocatalyst: tuning light absorption and charge carrier separation by lead oxidation state", Catalysis Science & Technology, 3, 2013, 2000, Source
Anna Iwaszuk, Michael Nolan, Qiliang Jin, Musashi Fujishima, Hiroaki Tada, "Origin of the Visible-Light Response of Nickel(II) Oxide Cluster Surface Modified Titanium(IV) Dioxide", The Journal of Physical Chemistry C, 117, 2013, 2709-2718, Source
Anna Iwaszuk, P. A. Mulheran, Michael Nolan, "TiO2 nanocluster modified-rutile TiO2 photocatalyst: a first principles investigation", Journal of Materials Chemistry A, 1, 2013, 2515, Source
Apostolos A. Christou, "Orbital clustering of martian Trojans: An asteroid family in the inner Solar System?", Icarus, 224, 2013, 144-153, Source
Aron Walsh, Aoife B. Kehoe, Douglas J. Temple, Graeme W. Watson, David O. Scanlon, "PbO2: from semi-metal to transparent conducting oxide by defect chemistry control", Chem. Commun., 49, 2013, 448-450, Source
Brian K. Meredith, Donagh P. Berry, Francis Kearney, Emma K. Finlay, Alan G. Fahey, Daniel G. Bradley, David J. Lynn, "A genome-wide association study for somatic cell score using the Illumina high-density bovine beadchip identifies several novel QTL potentially related to mastitis susceptibility", Frontiers in Genetics, 4, 2013, , Source
Buket Benek Gursoy, Oliver Mason, Sergeı˘ Sergeev, "The analytic hierarchy process, max algebra and multi-objective optimisation", Linear Algebra and its Applications, 438, 2013, 2911-2928, Source
Buket Gursoy, Steve Kirkland, Oliver Mason, Sergei Sergeev, "On the Markov chain tree theorem in the Max algebra", The Electronic Journal of Linear Algebra, 26, 2013, , Source
C. Hopkins, P.E. McHugh, N.P. O’Dowd, Y. Rochev, J.P. McGarry, "A combined computational and experimental methodology to determine the adhesion properties of stent polymer coatings", Computational Materials Science, 80, 2013, 104-112, Source
C.A. Sweeney, W. Vorster, S.B. Leen, E. Sakurada, P.E. McHugh, F.P.E. Dunne, "The role of elastic anisotropy, length scale and crystallographic slip in fatigue crack nucleation", Journal of the Mechanics and Physics of Solids, 61, 2013, 1224-1240, Source
Chong-Wen Zhou, Jorge Mendes, Henry J. Curran, "Theoretical and Kinetic Study of the Reaction of Ethyl Methyl Ketone with HȮ2 for T = 600–1600 K. Part II: Addition Reaction Channels", The Journal of Physical Chemistry A, 117, 2013, 4526-4533, Source
Chong-Wen Zhou, Stephen J. Klippenstein, John M. Simmie, Henry J. Curran, "Theoretical kinetics for the decomposition of iso-butanol and related reactions", Proceedings of the Combustion Institute, 34, 2013, 501-509, Source
Christopher J. Bean, Louis De Barros, Ivan Lokmer, Jean-Philippe Métaxian, Gareth O’ Brien, Shane Murphy, "Long-period seismicity in the shallow volcanic edifice formed from slow-rupture earthquakes", Nature Geoscience, 7, 2013, 71-75, Source
Ciara Moran, Gemma K Kinsella, Zai-Rong Zhang, Sarah Perrett, Gary W Jones, "Mutational Analysis of Sse1 (Hsp110) Suggests an Integral Role for this Chaperone in Yeast Prion PropagationIn Vivo", G3 Genes|Genomes|Genetics, 3, 2013, 1409-1418, Source
Claire C Morgan, Ann M Mc Cartney, Mark TA Donoghue, Noeleen B Loughran, Charles Spillane, Emma C Teeling, Mary J O’Connell, "Molecular adaptation of telomere associated genes in mammals", BMC Evolutionary Biology, 13, 2013, , Source
Claire C. Morgan, Peter G. Foster, Andrew E. Webb, Davide Pisani, James O. McInerney, Mary J. O’Connell, "Heterogeneous Models Place the Root of the Placental Mammal Phylogeny", Molecular Biology and Evolution, 30, 2013, 2145-2156, Source
D. Katsikadakos, C.-W. Zhou, J.M. Simmie, H.J. Curran, P.A. Hunt, Y. Hardalupas, A.M.K.P. Taylor, "Rate constants of hydrogen abstraction by methyl radical from n-butanol and a comparison of CanTherm, MultiWell and Variflex", Proceedings of the Combustion Institute, 34, 2013, 483-491, Source
D. Khoza, A.G. Jones, M.R. Muller, R.L. Evans, S.J. Webb, M. Miensopust, "Tectonic model of the Limpopo belt: Constraints from magnetotelluric data", Precambrian Research, 226, 2013, 143-156, Source
D. Sharma, L. Ansari, B. Feldman, M. Iakovidis, J. C. Greer, G. Fagas, "Transport properties and electrical device characteristics with the TiMeS computational platform: Application in silicon nanowires", Journal of Applied Physics, 113, 2013, , Source
D. Weidt, Ł. Figiel, "Predictions of Energy Absorption of Aligned Carbon Nanotube/Epoxy Composites", Structural Nanocomposites, , 2013, 207-224, Source
D.C. O'Mahoney, K.B. Katnam, N.P. O'Dowd, C.T. McCarthy, T.M. Young, "Taguchi analysis of bonded composite single-lap joints using a combined interface–adhesive damage model", International Journal of Adhesion and Adhesives, 40, 2013, 168-178, Source
D.J. O’Dwyer, N.P. O’Dowd, C.T. McCarthy, "Micromechanical investigation of damage processes at composite-adhesive interfaces", Composites Science and Technology, 86, 2013, 61-69, Source
Damien Thompson, Mateusz Sikora, Piotr Szymczak, Marek Cieplak, "A multi-scale molecular dynamics study of the assembly of micron-size supraparticles from 30 nm alkyl-coated nanoparticles", Physical Chemistry Chemical Physics, 15, 2013, 8132, Source
Dario Marrocchelli, Mathieu Salanne, Graeme W Watson, "Effects of Li-ion vacancies on the ionic conduction mechanism of LiMgSO4F", Modelling and Simulation in Materials Science and Engineering, 21, 2013, 074003, Source
Dario Marrocchelli, Sean R. Bishop, John Kilner, "Chemical expansion and its dependence on the host cation radius", Journal of Materials Chemistry A, 1, 2013, 7673, Source
Darren Fayne, "Ligand‐Based Molecular Design Using Pseudoreceptors", De novo Molecular Design, , 2013, 227-244, Source
Darren Fayne, "De-peptidising protein–protein interactions – big jobs for small molecules", Drug Discovery Today: Technologies, 10, 2013, e467-e474, Source
David Martin, Fergal Boyle, "Finite element analysis of balloon‐expandable coronary stent deployment: Influence of angioplasty balloon configuration", International Journal for Numerical Methods in Biomedical Engineering, 29, 2013, 1161-1175, Source
Dong-Feng Li, Catrin M. Davies, Shu-Yan Zhang, Calum Dickinson, Noel P. O’Dowd, "The effect of prior deformation on subsequent microplasticity and damage evolution in an austenitic stainless steel at elevated temperature", Acta Materialia, 61, 2013, 3575-3584, Source
Emer M Feerick, Xiangyi (Cheryl) Liu, Patrick McGarry, "Anisotropic mode-dependent damage of cortical bone using the extended finite element method (XFEM)", Journal of the Mechanical Behavior of Biomedical Materials, 20, 2013, 77-89, Source
Emer M. Feerick, Jim Kennedy, Hannan Mullett, David FitzPatrick, Patrick McGarry, "Investigation of metallic and carbon fibre PEEK fracture fixation devices for three-part proximal humeral fractures", Medical Engineering & Physics, 35, 2013, 712-722, Source
Enda P. Dowling, J. Patrick McGarry, "Influence of Spreading and Contractility on Cell Detachment", Annals of Biomedical Engineering, 42, 2013, 1037-1048, Source
Enda P. Dowling, William Ronan, J. Patrick McGarry, "Computational investigation of in situ chondrocyte deformation and actin cytoskeleton remodelling under physiological loading", Acta Biomaterialia, 9, 2013, 5943-5955, Source
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Eva Rivera, Daniel Montemayor, Marco Masia, David F. Coker, "Influence of Site-Dependent Pigment–Protein Interactions on Excitation Energy Transfer in Photosynthetic Light Harvesting", The Journal of Physical Chemistry B, 117, 2013, 5510-5521, Source
Fernando Blanco, Brendan Kelly, Goar Sánchez-Sanz, Cristina Trujillo, Ibon Alkorta, Jose Elguero, Isabel Rozas, "Non-Covalent Interactions: Complexes of Guanidinium with DNA and RNA Nucleobases", The Journal of Physical Chemistry B, 117, 2013, 11608-11616, Source
Francesco Carbone, Denys Dutykh, John M. Dudley, Frédéric Dias, "Extreme wave runup on a vertical cliff", Geophysical Research Letters, 40, 2013, 3138-3143, Source
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Harish Kumar Chakravarty, Ravi X. Fernandes, "Reaction Kinetics of Hydrogen Abstraction Reactions by Hydroperoxyl Radical from 2-Methyltetrahydrofuran and 2,5-Dimethyltetrahydrofuran", The Journal of Physical Chemistry A, 117, 2013, 5028-5041, Source
Heather Doyle, Stefan Lohfeld, Peter McHugh, "Predicting the Elastic Properties of Selective Laser Sintered PCL/β-TCP Bone Scaffold Materials Using Computational Modelling", Annals of Biomedical Engineering, 42, 2013, 661-677, Source
J.A. Grogan, S.B. Leen, P.E. McHugh, "Influence of statistical size effects on the plastic deformation of coronary stents", Journal of the Mechanical Behavior of Biomedical Materials, 20, 2013, 61-76, Source
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Jennifer F. Courtney, Peter Lynch, Conor Sweeney, "High resolution forecasting for wind energy applications using Bayesian model averaging", Tellus A: Dynamic Meteorology and Oceanography, 65, 2013, 19669, Source
Jeremy Lucid, Simone Meloni, Donal MacKernan, Eckhard Spohr, Giovanni Ciccotti, "Probing the Structures of Hydrated Nafion in Different Morphologies Using Temperature-Accelerated Molecular Dynamics Simulations", The Journal of Physical Chemistry C, 117, 2013, 774-782, Source
Jeremy P. Allen, David O. Scanlon, Louis F. J. Piper, Graeme W. Watson, "Understanding the defect chemistry of tin monoxide", Journal of Materials Chemistry C, 1, 2013, 8194, Source
Jeremy P. Allen, John J. Carey, Aron Walsh, David O. Scanlon, Graeme W. Watson, "Electronic Structures of Antimony Oxides", The Journal of Physical Chemistry C, 117, 2013, 14759-14769, Source
Joachim Wagner, Jennifer Foster, Josef Van Genabith, "Judging Grammaticality", CALICO Journal, 26, 2013, 474-490, Source
John M. Simmie, Kieran P. Somers, Kenji Yasunaga, Henry J. Curran, "A Quantum Chemical Study of the Abnormal Reactivity of 2‐Methoxyfuran", International Journal of Chemical Kinetics, 45, 2013, 531-541, Source
John M. Simmie, Kieran P. Somers, Wayne K. Metcalfe, Henry J. Curran, "Substituent effects in the thermochemistry of furans: A theoretical (CBS-QB3, CBS-APNO and G3) study", The Journal of Chemical Thermodynamics, 58, 2013, 117-128, Source
Jonathan Mackey, Andrew J. Lim, "Effects of strong magnetic fields on photoionised clouds", High Energy Density Physics, 9, 2013, 1-7, Source
Jorge Mendes, Chong-Wen Zhou, Henry J. Curran, "Theoretical and Kinetic Study of the Reactions of Ketones with HȮ2 Radicals. Part I: Abstraction Reaction Channels", The Journal of Physical Chemistry A, 117, 2013, 4515-4525, Source
Jorge Mendes, Chong-Wen Zhou, Henry J. Curran, "Theoretical and Kinetic Study of the Hydrogen Atom Abstraction Reactions of Esters with HȮ2 Radicals", The Journal of Physical Chemistry A, 117, 2013, 14006-14018, Source
K.P. Somers, J.M. Simmie, F. Gillespie, U. Burke, J. Connolly, W.K. Metcalfe, F. Battin-Leclerc, P. Dirrenberger, O. Herbinet, P.-A. Glaude, H.J. Curran, "A high temperature and atmospheric pressure experimental and detailed chemical kinetic modelling study of 2-methyl furan oxidation", Proceedings of the Combustion Institute, 34, 2013, 225-232, Source
Kevin A. McDonnell, Nitin Wadnerkar, Niall J. English, Mahfujur Rahman, Denis Dowling, "Photo-active and optical properties of bismuth ferrite (BiFeO3): An experimental and theoretical study", Chemical Physics Letters, 572, 2013, 78-84, Source
Kieran P. Somers, John M. Simmie, Fiona Gillespie, Christine Conroy, Gráinne Black, Wayne K. Metcalfe, Frédérique Battin-Leclerc, Patricia Dirrenberger, Olivier Herbinet, Pierre-Alexandre Glaude, Philippe Dagaut, Casimir Togbé, Kenji Yasunaga, Ravi X. Fernandes, Changyoul Lee, Rupali Tripathi, Henry J. Curran, "A comprehensive experimental and detailed chemical kinetic modelling study of 2,5-dimethylfuran pyrolysis and oxidation", Combustion and Flame, 160, 2013, 2291-2318, Source
L. Bocher, E. Popova, M. Nolan, A. Gloter, E. Chikoidze, K. March, B. Warot-Fonrose, B. Berini, O. Stéphan, N. Keller, Y. Dumont, "Direct Evidence of-Charge Ordering in the Ferrimagnetic Hematite-IlmeniteThin Films", Physical Review Letters, 111, 2013, , Source
L. Coleman, D. Martin, S. Varghese, S.G. Jennings, C.D. O'Dowd, "Assessment of changing meteorology and emissions on air quality using a regional climate model: Impact on ozone", Atmospheric Environment, 69, 2013, 198-210, Source
Laura Caboni, Billy Egan, Brendan Kelly, Fernando Blanco, Darren Fayne, Mary J. Meegan, David G. Lloyd, "Structure–Activity Relationships in Non-Ligand Binding Pocket (Non-LBP) Diarylhydrazide Antiandrogens", Journal of Chemical Information and Modeling, 53, 2013, 2116-2130, Source
Louis De Barros, Ivan Lokmer, Christopher J. Bean, "Origin of spurious single forces in the source mechanism of volcanic seismicity", Journal of Volcanology and Geothermal Research, 262, 2013, 1-6, Source
Mahdi Shirazi, Simon D. Elliott, "Multiple Proton Diffusion and Film Densification in Atomic Layer Deposition Modeled by Density Functional Theory", Chemistry of Materials, 25, 2013, 878-889, Source
Mahdi Shirazi, Simon D. Elliott, "Atomistic kinetic Monte Carlo study of atomic layer deposition derived from density functional theory", Journal of Computational Chemistry, 35, 2013, 244-259, Source
Marc Casals, Sam Dolan, Adrian C. Ottewill, Barry Wardell, "Self-force and Green function in Schwarzschild spacetime via quasinormal modes and branch cut", Physical Review D, 88, 2013, , Source
Maria Stamenova, Stefano Sanvito, "Dynamical exchange interaction from time-dependent spin density functional theory", Physical Review B, 88, 2013, , Source
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Martin B. Peters, Enda O’Brien, Alastair McKinstry, Adam Ralph, "Wind Forecasting Using HARMONIE with Bayes Model Averaging for Fine-tuning", Energy Procedia, 40, 2013, 95-101, Source
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Merid Legesse, Michael Nolan, Giorgos Fagas, "Revisiting the Dependence of the Optical and Mobility Gaps of Hydrogenated Amorphous Silicon on Hydrogen Concentration", The Journal of Physical Chemistry C, 117, 2013, 23956-23963, Source
Michael A. McCarthy, Emmett M. Byrne, Nathan P. O’Brien, Tony Murmu, "Improved Mechanical Performance of CNTs and CNT Fibres in Nanocomposites Through Inter-Wall and Inter-Tube Coupling", Springer Series in Materials Science, , 2013, 1-56, Source
Michael Nolan, "Modifying ceria (111) with a TiO2 nanocluster for enhanced reactivity", The Journal of Chemical Physics, 139, 2013, , Source
Mohamed K. Awad, Morad M. El-Hendawy, Tarek A. Fayed, Safaa Eldin H. Etaiw, Niall J. English, "Aromatic ring size effects on the photophysics and photochemistry of styrylbenzothiazole", Photochemical & Photobiological Sciences, 12, 2013, 1220-1231, Source
Morad M. El-Hendawy, Niall J. English, Damian A. Mooney, "Comparative studies for evaluation of CO2 fixation in the cavity of the Rubisco enzyme using QM, QM/MM and linear-scaling DFT methods", Journal of Molecular Modeling, 19, 2013, 2329-2334, Source
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N.P. O’Brien, M.A. McCarthy, W.A. Curtin, "Improved inter-tube coupling in CNT bundles through carbon ion irradiation", Carbon, 51, 2013, 173-184, Source
N.P. O’Brien, M.A. McCarthy, W.A. Curtin, "A theoretical quantification of the possible improvement in the mechanical properties of carbon nanotube bundles by carbon ion irradiation", Carbon, 53, 2013, 346-356, Source
Nader Haghighipour, Stephanie Capen, Tobias C. Hinse, "Detection of Earth-mass and super-Earth Trojan planets using transit timing variation method", Celestial Mechanics and Dynamical Astronomy, 117, 2013, 75-89, Source
Neil T.M. Duffy, John A. Eaton, "Investigation of factors affecting channelling in fixed-bed solid fuel combustion using CFD", Combustion and Flame, 160, 2013, 2204-2220, Source
Niall English, "Massively-Parallel Molecular Dynamics Simulation of Clathrate Hydrates on Blue Gene Platforms", Energies, 6, 2013, 3072-3081, Source
Niall J. English, "Dynamical properties of physically adsorbed water molecules at the TiO2 rutile-(110) surface", Chemical Physics Letters, 583, 2013, 125-130, Source
Nicola Varini, Davide Ceresoli, Layla Martin-Samos, Ivan Girotto, Carlo Cavazzoni, "Enhancement of DFT-calculations at petascale: Nuclear Magnetic Resonance, Hybrid Density Functional Theory and Car–Parrinello calculations", Computer Physics Communications, 184, 2013, 1827-1833, Source
Nimalan Thavandiran, Nicole Dubois, Alexander Mikryukov, Stéphane Massé, Bogdan Beca, Craig A. Simmons, Vikram S. Deshpande, J. Patrick McGarry, Christopher S. Chen, Kumaraswamy Nanthakumar, Gordon M. Keller, Milica Radisic, Peter W. Zandstra, "Design and formulation of functional pluripotent stem cell-derived cardiac microtissues", Proceedings of the National Academy of Sciences, 110, 2013, , Source
Nisachol Nerngchamnong, Li Yuan, Dong-Chen Qi, Jiang Li, Damien Thompson, Christian A. Nijhuis, "The role of van der Waals forces in the performance of molecular diodes", Nature Nanotechnology, 8, 2013, 113-118, Source
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Nuala M. Caffrey, Daniel Fritsch, Thomas Archer, Stefano Sanvito, Claude Ederer, "Spin-filtering efficiency of ferrimagnetic spinels CoFeOand NiFeO", Physical Review B, 87, 2013, , Source
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