A. Licciardi, N. Piana Agostinetti, "A semi-automated method for the detection of seismic anisotropy at depth via receiver function analysis", Geophysical Journal International, 205, 2016, 1589-1612, Source
A. Reid, M. Mathioudakis, J. G. Doyle, E. Scullion, C. J. Nelson, V. Henriques, T. Ray, "MAGNETIC FLUX CANCELLATION IN ELLERMAN BOMBS", The Astrophysical Journal, 823, 2016, 110, Source
A. Vitorino Carvalho, C. Eozenou, G. D. Healey, N. Forde, P. Reinaud, M. Chebrout, L. Gall, N. Rodde, A. Lesage Padilla, C. Giraud Delville, M. Leveugle, C. Richard, I. M. Sheldon, P. Lonergan, G. Jolivet, O. Sandra, "Analysis of STAT1 expression and biological activity reveals interferon-tau-dependent STAT1-regulated SOCS genes in the bovine endometrium", Reproduction, Fertility and Development, 28, 2016, 459, Source
Adam Molloy, Goar Sánchez-Sanz, Declan Gilheany, "PP-Rotation, P-Inversion and Metathesis in Diphosphines Studied by DFT Calculations: Comments on Some Literature Conflicts", Inorganics, 4, 2016, 36, Source
Adam Ralph, Martin Somers, Jonathan Cowman, Bruno Voisin, Emma Hogan, Hannah Dunne, Eimear Dunne, Barry Byrne, Nigel Kent, Antonio J. Ricco, Dermot Kenny, Simon Wong, "Computational Tracking of Shear-Mediated Platelet Interactions with von Willebrand Factor", Cardiovascular Engineering and Technology, 7, 2016, 389-405, Source
Ahmad Ziaee, Drahomir Chovan, Matteo Lusi, John J. Perry, Michael J. Zaworotko, Syed A. M. Tofail, "Theoretical Optimization of Pore Size and Chemistry in SIFSIX-3-M Hybrid Ultramicroporous Materials", Crystal Growth & Design, 16, 2016, 3890-3897, Source
Alvar R. Garrigues, Li Yuan, Lejia Wang, Eduardo R. Mucciolo, Damien Thompon, Enrique del Barco, Christian A. Nijhuis, "A Single-Level Tunnel Model to Account for Electrical Transport through Single Molecule- and Self-Assembled Monolayer-based Junctions", Scientific Reports, 6, 2016, , Source
Andrea Droghetti, Philip Thielen, Ivan Rungger, Norman Haag, Nicolas Großmann, Johannes Stöckl, Benjamin Stadtmüller, Martin Aeschlimann, Stefano Sanvito, Mirko Cinchetti, "Dynamic spin filtering at the Co/Alq3 interface mediated by weakly coupled second layer molecules", Nature Communications, 7, 2016, , Source
Anuradha R. Pallipurath, Francesco Civati, Magdalene Eziashi, Elaf Omar, Patrick McArdle, Andrea Erxleben, "Tailoring Cocrystal and Salt Formation and Controlling the Crystal Habit of Diflunisal", Crystal Growth & Design, 16, 2016, 6468-6478, Source
Aoife B Kehoe, David O Scanlon, Graeme W Watson, "Modelling potential photovoltaic absorbers Cu3MCh4(M = V, Nb, Ta;Ch = S, Se, Te) using density functional theory", Journal of Physics: Condensed Matter, 28, 2016, 175801, Source
Aoife B Kehoe, Elisabetta Arca, David O Scanlon, Igor V Shvets, Graeme W Watson, "Assessing the potential of Mg-doped Cr2O3as a novelp-type transparent conducting oxide", Journal of Physics: Condensed Matter, 28, 2016, 125501, Source
Aoife Crowe, Goar Sánchez-Sanz, Bartlomiej Tywoniuk, Denis C. Shields, Nicolae-Viorel Buchete, "Coarse Master Equation-Based Analysis of N-Methylation and Temperature Effects on the Dynamics of Cyclic Peptides", Biophysical Journal, 110, 2016, 379a, Source
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B. Contro, J. Horner, R. A. Wittenmyer, J. P. Marshall, T. C. Hinse, "Modelling the inner debris disc of HR 8799", Monthly Notices of the Royal Astronomical Society, 463, 2016, 191-204, Source
Brian J. Golden, Dong-Feng Li, Yina Guo, Peter Tiernan, Sean B. Leen, Noel P. O'Dowd, "Microscale deformation of a tempered martensite ferritic steel: Modelling and experimental study of grain and sub-grain interactions", Journal of the Mechanics and Physics of Solids, 86, 2016, 42-52, Source
Brían L. O’Reilly, Claire Conway, J. Patrick McGarry, Peter E. McHugh, "Arterial and Atherosclerotic Plaque Biomechanics with Application to Stent Angioplasty Modeling", Studies in Mechanobiology, Tissue Engineering and Biomaterials, , 2016, 193-231, Source
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Carlo Motta, Fedwa El-Mellouhi, Stefano Sanvito, "Exploring the cation dynamics in lead-bromide hybrid perovskites", Physical Review B, 93, 2016, , Source
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Cathal O�Donoghue, Alistair McKinstry, Stuart Green, Reamonn Fealy, Kevin Heanue, Mary Ryan, Kevin Connolly, J. C. Desplat, Brendan Horan, "A blueprint for a big data analytical solution to low farmer engagement with financial management.", International Food and Agribusiness Management Review 19, no. 1030-2016-83143 2016. Source
Cathal T. Leahy, Ronan D. Murphy, Gerhard Hummer, Edina Rosta, Nicolae-Viorel Buchete, "Coarse Master Equations for Binding Kinetics of Amyloid Peptide Dimers", The Journal of Physical Chemistry Letters, 7, 2016, 2676-2682, Source
Chong-Wen Zhou, John M. Simmie, William J. Pitz, Henry J. Curran, "Toward the Development of a Fundamentally Based Chemical Model for Cyclopentanone: High-Pressure-Limit Rate Constants for H Atom Abstraction and Fuel Radical Decomposition", The Journal of Physical Chemistry A, 120, 2016, 7037-7044, Source
Colm P. Coughlan, Denise C. Gabuzda, "High resolution VLBI polarization imaging of AGN with the maximum entropy method", Monthly Notices of the Royal Astronomical Society, 463, 2016, 1980-2001, Source
Cristina Trujillo, Goar Sánchez-Sanz, Ibon Alkorta, José Elguero, "An insight on the aromatic changes in closed shell icosagen, tetrel, and pnictogen phenalenyl derivatives", Structural Chemistry, 28, 2016, 345-355, Source
Cristina Trujillo, Viola Previtali, Isabel Rozas, "A theoretical model of the interaction between phosphates in the ATP molecule and guanidinium systems", Theoretical Chemistry Accounts, 135, 2016, , Source
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David Quiñonero, Antonio Bauzá, Goar Sánchez-Sanz, Cristina Trujillo, Ibon Alkorta, José Elguero, "Weak interactions within nitryl halide heterodimers", New Journal of Chemistry, 40, 2016, 9060-9072, Source
Dong-Feng Li, Richard A. Barrett, Padraic E. O’Donoghue, Chris J. Hyde, Noel P. O’Dowd, Sean B. Leen, "Micromechanical finite element modelling of thermo-mechanical fatigue for P91 steels", International Journal of Fatigue, 87, 2016, 192-202, Source
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Fergus E. Poynton, James P. Hall, Páraic M. Keane, Christine Schwarz, Igor V. Sazanovich, Michael Towrie, Thorfinnur Gunnlaugsson, Christine J. Cardin, David J. Cardin, Susan J. Quinn, Conor Long, John M. Kelly, "Direct observation by time-resolved infrared spectroscopy of the bright and the dark excited states of the [Ru(phen)2(dppz)]2+ light-switch compound in solution and when bound to DNA", Chemical Science, 7, 2016, 3075-3084, Source
Gilles Civario, Se�n Delaney, Michael Lysaght, "Preparing a Seismic Imaging Code for the Intel Knights Landing Xeon Phi processor", Parallel Computing: On the Road to Exascale, vol.7, IOS Press, 2016. Source
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Hadi H. Arefi, Michael Nolan, Giorgos Fagas, "Binary functionalization of H:Si(111) surfaces by alkyl monolayers with different linker atoms enhances monolayer stability and packing", Physical Chemistry Chemical Physics, 18, 2016, 12952-12963, Source
Henriette Heer, Gary McGuire, Oisín Robinson, "JKL-ECM: an implementation of ECM using Hessian curves", LMS Journal of Computation and Mathematics, 19, 2016, 83-99, Source
J. Cowman, N. Quinn, S. Geoghegan, S. Müllers, I. Oglesby, B. Byrne, M. Somers, A. Ralph, B. Voisin, A.J. Ricco, E.J. Molloy, D. Kenny, "Dynamic platelet function on von Willebrand factor is different in preterm neonates and full‐term neonates: changes in neonatal platelet function", Journal of Thrombosis and Haemostasis, 14, 2016, 2027-2035, Source
J. J. Carey, M. Nolan, "Cation doping size effect for methane activation on alkaline earth metal doping of the CeO2 (111) surface", Catalysis Science & Technology, 6, 2016, 3544-3558, Source
J. M. Simmie, J. N. Sheahan, "Validation of a Database of Formation Enthalpies and of Mid-Level Model Chemistries", The Journal of Physical Chemistry A, 120, 2016, 7370-7384, Source
J. Shetye, J. G. Doyle, E. Scullion, C. J. Nelson, D. Kuridze, V. Henriques, F. Woeger, T. Ray, "High-cadence observations of spicular-type events on the Sun", Astronomy & Astrophysics, 589, 2016, A3, Source
James Fannon, Jean-Christophe Loiseau, Prashant Valluri, Iain Bethune, Lennon Ó Náraigh, "High-performance computational fluid dynamics: a custom-code approach", European Journal of Physics, 37, 2016, 045001, Source
Jian-Yao Zheng, Hongjun Xu, Jing Jing Wang, Sinéad Winters, Carlo Motta, Ertuğrul Karademir, Weigang Zhu, Eswaraiah Varrla, Georg S. Duesberg, Stefano Sanvito, Wenping Hu, John F. Donegan, "Vertical Single-Crystalline Organic Nanowires on Graphene: Solution-Phase Epitaxy and Optical Microcavities", Nano Letters, 16, 2016, 4754-4762, Source
John Bugler, Kieran P. Somers, John M. Simmie, Felix Güthe, Henry J. Curran, "Modeling Nitrogen Species as Pollutants: Thermochemical Influences", The Journal of Physical Chemistry A, 120, 2016, 7192-7197, Source
John J. Carey, Merid Legesse, Michael Nolan, "Low Valence Cation Doping of Bulk Cr2O3: Charge Compensation and Oxygen Vacancy Formation", The Journal of Physical Chemistry C, 120, 2016, 19160-19174, Source
John J. Carey, Michael Nolan, "Dissociative adsorption of methane on the Cu and Zn doped (111) surface of CeO2", Applied Catalysis B: Environmental, 197, 2016, 324-336, Source
Jon-Ivar Skullerud, Gert Aarts, Chris Allton, Alessandro Amato, Yannis Burnier, P. Wynne M. Evans, Pietro Giudice, Simon Hands, Tim Harris, Aoife Kelly, Seyong Kim, Maria Paola Lombardo, Mehmet B. Oktay, Alexander Rothkopf, Sinéad M. Ryan, "Quark–gluon plasma phenomenology from anisotropic lattice QCD", AIP Conference Proceedings, , 2016, , Source
L. Ansari, G. Fagas, F. Gity, J. C. Greer, "A sub kBT/q semimetal nanowire field effect transistor", Applied Physics Letters, 109, 2016, , Source
Lida Ansari, Farzan Gity, James C Greer, "Electronic and structural properties of rhombohedral [1 1 1] and [1 1 0] oriented ultra-thin bismuth nanowires", Journal of Physics: Condensed Matter, 29, 2016, 065301, Source
Lida Ansari, Farzan Gity, James C. Greer, "Atomic-scale simulation of semimetal-to-semiconductor transition in bismuth nanowires for future generation of nanoelectronic devices", 2016 IEEE 16th International Conference on Nanotechnology (IEEE-NANO), , 2016, , Source
Linda W. Wangoh, Yiqing Huang, Ryan L. Jezorek, Aoife B. Kehoe, Graeme W. Watson, Fredrick Omenya, Nicholas F. Quackenbush, Natasha A. Chernova, M. Stanley Whittingham, Louis F. J. Piper, "Correlating Lithium Hydroxyl Accumulation with Capacity Retention in V2O5 Aerogel Cathodes", ACS Applied Materials & Interfaces, 8, 2016, 11532-11538, Source
Lutz Vogeley, Toufic El Arnaout, Jonathan Bailey, Phillip J. Stansfeld, Coilin Boland, Martin Caffrey, "Structural basis of lipoprotein signal peptidase II action and inhibition by the antibiotic globomycin", Science, 351, 2016, 876-880, Source
M. Fremling, J. Fulsebakke, N. Moran, J. K. Slingerland, "Energy projection and modified Laughlin states", Physical Review B, 93, 2016, , Source
M. P. Jiang, M. Trigo, I. Savić, S. Fahy, É. D. Murray, C. Bray, J. Clark, T. Henighan, M. Kozina, M. Chollet, J. M. Glownia, M. C. Hoffmann, D. Zhu, O. Delaire, A. F. May, B. C. Sales, A. M. Lindenberg, P. Zalden, T. Sato, R. Merlin, D. A. Reis, "The origin of incipient ferroelectricity in lead telluride", Nature Communications, 7, 2016, , Source
Marco Fronzi, Anna Iwaszuk, Aoife Lucid, Michael Nolan, "Metal oxide nanocluster-modified TiO2as solar activated photocatalyst materials", Journal of Physics: Condensed Matter, 28, 2016, 074006, Source
Marco Fronzi, William Daly, Michael Nolan, "Reactivity of metal oxide nanocluster modified rutile and anatase TiO2: Oxygen vacancy formation and CO2 interaction", Applied Catalysis A: General, 521, 2016, 240-249, Source
Marco Fronzi, Yoshitaka Tateyama, Nicola Marzari, Michael Nolan, Enrico Traversa, "First-principles molecular dynamics simulations of proton diffusion in cubic BaZrO $$_3$$ 3 perovskite under strain conditions", Materials for Renewable and Sustainable Energy, 5, 2016, , Source
Maria Stamenova, Jacopo Simoni, Stefano Sanvito, "Role of spin-orbit interaction in the ultrafast demagnetization of small iron clusters", Physical Review B, 94, 2016, , Source
Melissabye Gunnoo, Pierre‐André Cazade, Albert Galera‐Prat, Michael A. Nash, Mirjam Czjzek, Marek Cieplak, Beatriz Alvarez, Marina Aguilar, Alon Karpol, Hermann Gaub, Mariano Carrión‐Vázquez, Edward A. Bayer, Damien Thompson, "Nanoscale Engineering of Designer Cellulosomes", Advanced Materials, 28, 2016, 5619-5647, Source
Michael Nolan, Anna Iwaszuk, Aoife K. Lucid, John J. Carey, Marco Fronzi, "Design of Novel Visible Light Active Photocatalyst Materials: Surface Modified TiO2", Advanced Materials, 28, 2016, 5425-5446, Source
Michael Nolan, M.Verónica Ganduglia-Pirovano, "Enhanced oxidation activity from modified ceria: MnOx–ceria, CrOx–ceria and Mg doped VOx–ceria", Applied Catalysis B: Environmental, 197, 2016, 313-323, Source
Michael Nolan, N. Aaron. Deskins, Kevin C. Schwartzenberg, Kimberly A. Gray, "Local Interfacial Structure Influences Charge Localization in Titania Composites: Beyond the Band Alignment Paradigm", The Journal of Physical Chemistry C, 120, 2016, 1808-1815, Source
Michela McMullan, Aintzane García-Bea, Patricia Miranda-Azpiazu, Luis F. Callado, Isabel Rozas, "Substituted conformationally restricted guanidine derivatives: Probing the α2-adrenoceptors’ binding pocket", European Journal of Medicinal Chemistry, 123, 2016, 48-57, Source
Michele Buzzicotti, Brendan P. Murray, Luca Biferale, Miguel D. Bustamante, "Phase and precession evolution in the Burgers equation", The European Physical Journal E, 39, 2016, , Source
Mikael Fremling, "Success and failure of the plasma analogy for Laughlin states on a torus", Journal of Physics A: Mathematical and Theoretical, 50, 2016, 015201, Source
Ming Li, Richard A. Barrett, Stephen Scully, Noel M. Harrison, Sean B. Leen, Padraic E. O’Donoghue, "Cyclic plasticity of welded P91 material for simple and complex power plant connections", International Journal of Fatigue, 87, 2016, 391-404, Source
Neil T.M. Duffy, John A. Eaton, "Investigation of 3D flow and heat transfer in solid-fuel grate combustion: Measures to reduce high-temperature degradation", Combustion and Flame, 167, 2016, 422-443, Source
Niall J. English, José-A. Garate, "Near-microsecond human aquaporin 4 gating dynamics in static and alternating external electric fields: Non-equilibrium molecular dynamics", The Journal of Chemical Physics, 145, 2016, , Source
Nina Iren Kristiansen, Delia Arnold, Christian Maurer, Julius Vira, Razvan Rădulescu, Damien Martin, Andreas Stohl, Kerstin Stebel, Mikhail Sofiev, Colin O'Dowd, Gerhard Wotawa, "Improving Model Simulations of Volcanic Emission Clouds and Assessing Model Uncertainties", Natural Hazard Uncertainty Assessment, , 2016, 105-124, Source
P. Cardiff, Ž. Tuković, H. Jasak, A. Ivanković, "A block-coupled Finite Volume methodology for linear elasticity and unstructured meshes", Computers & Structures, 175, 2016, 100-122, Source
P. Cardiff, Ž. Tuković, P. De Jaeger, M. Clancy, A. Ivanković, "A Lagrangian cell‐centred finite volume method for metal forming simulation", International Journal for Numerical Methods in Engineering, 109, 2016, 1777-1803, Source
P. Dawson, S. Schulz, R. A. Oliver, M. J. Kappers, C. J. Humphreys, "The nature of carrier localisation in polar and nonpolar InGaN/GaN quantum wells", Journal of Applied Physics, 119, 2016, , Source
P. Mocilac, I. A. Osman, J. F. Gallagher, "Short C–H⋯F interactions involving the 2,5-difluorobenzene group: understanding the role of fluorine in aggregation and complex C–F/C–H disorder in a 2 × 6 isomer grid", CrystEngComm, 18, 2016, 5764-5776, Source
Paolo Marracino, Micaela Liberti, Erika Trapani, Christian Burnham, Massimiliano Avena, José-Antonio Garate, Francesca Apollonio, Niall English, "Human Aquaporin 4 Gating Dynamics under Perpendicularly-Oriented Electric-Field Impulses: A Molecular Dynamics Study", International Journal of Molecular Sciences, 17, 2016, 1133, Source
Patrick M. Kelly, Sandra A. Bright, Darren Fayne, Jade K. Pollock, Daniela M. Zisterer, D. Clive Williams, Mary J. Meegan, "Synthesis, antiproliferative and pro-apoptotic activity of 2-phenylindoles", Bioorganic & Medicinal Chemistry, 24, 2016, 4075-4099, Source
Pauric Bannigan, Jacek Zeglinski, Matteo Lusi, John O’Brien, Sarah P. Hudson, "Investigation into the Solid and Solution Properties of Known and Novel Polymorphs of the Antimicrobial Molecule Clofazimine", Crystal Growth & Design, 16, 2016, 7240-7250, Source
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Veselin G. Filev, Denjoe O’Connor, "A computer test of holographic flavour dynamics", Journal of High Energy Physics, 2016, 2016, , Source
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