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Article

Sankar, M; Dimitratos, N; Knight, DW; Carley, AF; Tiruvalam, R; Kiely, CJ; ... Hutchings, GJ; + view all (2009) Oxidation of Glycerol to Glycolate by using Supported Gold and Palladium Nanoparticles. CHEMSUSCHEM , 2 (12) 1145 - 1151. 10.1002/cssc.200900133.

Dimitratos, N; Lopez-Sanchez, JA; Anthonykutty, JM; Brett, G; Carley, AF; Tiruvalam, RC; ... Hutchings, GJ; + view all (2009) Oxidation of glycerol using gold-palladium alloy-supported nanocrystals. PHYS CHEM CHEM PHYS , 11 (25) 4952 - 4961. 10.1039/b904317a.

Dimitratos, N; Villa, A; Prati, L; (2009) Liquid Phase Oxidation of Glycerol Using a Single Phase (Au-Pd) Alloy Supported on Activated Carbon: Effect of Reaction Conditions. CATAL LETT , 133 (3-4) 334 - 340. 10.1007/s10562-009-0192-8.

Dimitratos, N; Lopez-Sanchez, JA; Morgan, D; Carley, AF; Tiruvalam, R; Kiely, CJ; ... Hutchings, GJ; + view all (2009) Solvent-free oxidation of benzyl alcohol using Au-Pd catalysts prepared by sol immobilisation. PHYS CHEM CHEM PHYS , 11 (25) 5142 - 5153. 10.1039/b900151b.

Dimitratos, N; Lopez-Sanchez, JA; Meenakshisundaram, S; Anthonykutty, JM; Brett, G; Carley, AF; ... Hutchings, GJ; + view all (2009) Selective formation of lactate by oxidation of 1,2-propanediol using gold palladium alloy supported nanocrystals. GREEN CHEM , 11 (8) 1209 - 1216. 10.1039/b823285g.

Dimitratos, N; Lopez-Sanchez, JA; Hutchings, GJ; (2009) Green Catalysis with Alternative Feedstocks. TOP CATAL , 52 (3) 258 - 268. 10.1007/s11244-008-9162-4.

Bawaked, S; Dummer, NF; Dimitratos, N; Bethell, D; He, Q; Kiely, CJ; Hutchings, GJ; (2009) Solvent-free selective epoxidation of cyclooctene using supported gold catalysts. GREEN CHEM , 11 (7) 1037 - 1044. 10.1039/b823286p.

Lin, TW; Salzmann, CG; Shao, LD; Yu, CH; Green, MLH; Tsang, SC; (2009) Polyethylene glycol grafting and attachment of encapsulated magnetic iron oxide silica nanoparticles onto chlorosilanized single-wall carbon nanotubes. CARBON , 47 (6) 1415 - 1420. 10.1016/j.carbon.2008.11.034.

Afonja, A; Dungey, S; Binions, R; Parkin, IP; Lewis, DW; Williams, DE; (2009) Gas sensing properties of composite tungsten trioxide-zeolite thick films. ECS Transactions , 16 (24) 77 - 84. 10.1149/1.3109634.

Aliev, AE; Bhandal, S; Courtier-Murias, D; (2009) Quantum Mechanical and NMR Studies of Ring Puckering and cis/trans-Rotameric Interconversion in Prolines and Hydroxyprolines. J PHYS CHEM A , 113 (40) 10858 - 10865. 10.1021/jp906006w.

Aliev, AE; Courtier-Murias, D; Zhou, S; (2009) Scaling factors for carbon NMR chemical shifts obtained from DFF B3LYP calculations. J MOL STRUC-THEOCHEM , 893 (1-3) 1 - 5. 10.1016/j.theochem.2008.09.021.

Aliev, AE; Moise, J; Motherwell, WB; Nic, M; Courtier-Murias, D; Tocher, DA; (2009) Probing weak non-covalent interactions in solution and solid states with designed molecules. PHYS CHEM CHEM PHYS , 11 (1) 97 - 100. 10.1039/b815906h.

Aliev, AE; Sinclair, AJ; Zhou, S; Wilden, JD; Caddick, S; Kullmann, DM; Rusakov, DA; (2009) Density functional and spectroscopic studies of nitrogen inversion in substituted dizocilpines. J PHYS ORG CHEM , 22 (6) 607 - 612. 10.1002/poc.1490.

Almora-Barrios, N; Austen, KF; de Leeuw, NH; (2009) Density Functional Theory Study of the Binding of Glycine, Proline, and Hydroxyproline to the Hydroxyapatite (0001) and (01(1)over-bar0) Surfaces. LANGMUIR , 25 (9) 5018 - 5025. 10.1021/la803842g.

Anderson, JC; Blake, AJ; Moreno, RB; Raynel, G; van Slageren, J; (2009) A novel tridentate coordination mode for the carbonatonickel system exhibited in an unusual hexanuclear nickel(II) mu(3)-carbonato-bridged complex. DALTON T (42) 9153 - 9156. 10.1039/b912612k.

Anderson, JC; Smith, NM; Robertson, M; Scott, MS; (2009) An investigation into oxo analogues of molybdenum olefin metathesis complexes as epoxidation catalysts for alkenes. TETRAHEDRON LETT , 50 (38) 5344 - 5346. 10.1016/j.tetlet.2009.07.011.

Anderson, RL; Greenwell, HC; Suter, JL; Coveney, PV; Thyveetil, MA; (2009) Determining materials properties of natural composites using molecular simulation. J MATER CHEM , 19 (39) 7251 - 7262. 10.1039/b909119j.

Apostolico, L; Kociok-Kohn, G; Molloy, KC; Blackman, CS; Carmalt, CJ; Parkin, IP; (2009) The reaction of tin(IV) iodide with phosphines: formation of new halotin anions. DALTON T (47) 10486 - 10494. 10.1039/b917722a.

Ares, JR; Aguey-Zinsou, KF; Leardini, F; Ferrer, IJ; Fernandez, JF; Guo, ZX; Sanchez, C; (2009) Hydrogen Absorption/Desorption Mechanism in Potassium Alanate (KAlH4) and Enhancement by TiCl3 Doping. J PHYS CHEM C , 113 (16) 6845 - 6851. 10.1021/jp807184v.

Arnold, T; Payne, DJ; Bourlange, A; Hu, JP; Egdell, RG; Piper, LFJ; ... Watson, GW; + view all (2009) X-ray spectroscopic study of the electronic structure of CuCrO2. PHYS REV B , 79 (7) , Article 075102. 10.1103/PhysRevB.79.075102.

Assem, E-S; Peh, KH; Wan, BY; Dines, J; Middleton, JB; Marson, CM; (2009) Effects of a selection of histone deacetylase inhibitors on the antigen- and agonist(s)-induced tracheal smooth muscle contraction. Inflammation Research , 58 S22 - S23.

Axelsson, AK; Valant, M; Fenner, L; Wills, AS; Alford, NM; (2009) Chemistry of post-annealing of epitaxial CoFe2O4 thin films. THIN SOLID FILMS , 517 (13) 3742 - 3747. 10.1016/j.tsf.2009.01.142.

Banks, ST; Clary, DC; (2009) Chemical reaction surface vibrational frequencies evaluated in curvilinear internal coordinates: Application to H+CH4 -><- H-2+CH3. J CHEM PHYS , 130 (2) , Article 024106. 10.1063/1.3052076.

Banks, ST; Tautermann, CS; Remmert, SM; Clary, DC; (2009) An improved treatment of spectator mode vibrations in reduced dimensional quantum dynamics: Application to the hydrogen abstraction reactions mu+CH4, H+CH4, D+CH4, and CH3+CH4. J CHEM PHYS , 131 (4) , Article 044111. 10.1063/1.3177380.

Barrett, AGM; Brinkmann, C; Crimmin, MR; Hill, MS; Hunt, P; Procopiou, PA; (2009) Heavier Group 2 Metals and Intermolecular Hydroamination: A Computational and Synthetic Assessment. J AM CHEM SOC , 131 (36) 12906 - +. 10.1021/ja905615a.

Barrett, AGM; Casely, IJ; Crimmin, MR; Hill, MS; Lachs, JR; Mahon, MF; Procopiou, PA; (2009) beta-Diketiminato Calcium and Magnesium Amides; Model Complexes for Hydroamination Catalysis. INORG CHEM , 48 (10) 4445 - 4453. 10.1021/ic900091x.

Barrett, AGM; Crimmin, MR; Hill, MS; Hitchcock, PB; Lomas, SL; Procopiou, PA; Suntharalingam, K; (2009) Catalytic 2,3,4-hexatriene formation by terminal alkyne coupling at calcium. CHEM COMMUN (17) 2299 - 2301. 10.1039/b818848c.

Battaglia, G; Smart, TP; Mykhaylyk, OO; Ryan, AJ; (2009) Polymersomes hydrophilic brush scaling relations. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY , 237

Beale, AM; Jacques, SDM; Sacaliuc-Parvalescu, E; O'Brien, MG; Barnes, P; Weckhuysen, BM; (2009) An iron molybdate catalyst for methanol to formaldehyde conversion prepared by a hydrothermal method and its characterization. APPL CATAL A-GEN , 363 (1-2) 143 - 152. 10.1016/j.apcata.2009.05.008.

Beale, AM; Paul, M; Sankar, G; Oldman, RJ; Catlow, CRA; French, S; Fowles, M; (2009) Combined experimental and computational modelling studies of the solubility of nickel in strontium titanate. J MATER CHEM , 19 (25) 4391 - 4400. 10.1039/b902591j.

Begis, G; Cladingboel, DE; Jerome, L; Motherwell, WB; Sheppard, TD; (2009) Asymmetric Synthesis of Aminocyclopropanes and N-Cyclopropylamino Alcohols Through Direct Amidocyclopropanation of Alkenes Using Chiral Organozinc Carbenoids. EUR J ORG CHEM (10) 1532 - 1548. 10.1002/ejoc.200801033.

Benny, S; Grau-Crespo, R; de Leeuw, NH; (2009) A theoretical investigation of alpha-Fe2O3-Cr2O3 solid solutions. PHYS CHEM CHEM PHYS , 11 (5) 808 - 815. 10.1039/b815907f.

Berteotti, A; Cavalli, A; Branduardi, D; Gervasio, FL; Recanatini, M; Parrinello, M; (2009) Protein conformational transitions: the closure mechanism of a kinase explored by atomistic simulations. J Am Chem Soc , 131 (1) 244 - 250. 10.1021/ja806846q.

Binions, R; Afonja, A; Dungey, S; Lewis, D; Parkin, IP; Williams, DE; (2009) Zeolite modification: Towards discriminating metal oxide gas sensors. ECS Transactions , 19 (6) 241 - 250. 10.1149/1.3118557.

Binions, R; Afonja, A; Dungey, S; Lewis, DW; Parkin, IP; Williams, DE; (2009) Discrimination effects in zeolite modified metal oxide semiconductor gas sensors. Proceedings of IEEE Sensors 1090 - 1095. 10.1109/ICSENS.2009.5398566.

Binions, R; Davies, H; Afonja, A; Dungey, S; Lewis, D; Williams, DE; Parkin, IP; (2009) Zeolite-Modified Discriminating Gas Sensors. J ELECTROCHEM SOC , 156 (3) J46 - J51. 10.1149/1.3065436.

Bishop, CL; Pan, D; Liu, LM; Tribello, GA; Michaelides, A; Wang, EG; Slater, B; (2009) On thin ice: surface order and disorder during pre-melting. FARADAY DISCUSS , 141 277 - 292. 10.1039/b807377p.

Blackman, CS; Carmalt, CJ; Moniz, SJA; Potts, SE; Davies, HO; Pugh, DC; (2009) MOCVD Of Zirconium Oxide From The Zirconium Guanidinate Complex [ZrCp '{eta(2)-((PrN)-Pr-i)(2)CNMe2}(2)Cl]. EUROCVD 17 / CVD 17 , 25 (8) 561 - 565. 10.1149/1.3207640.

Blackman, CS; Piccirillo, C; Binions, R; Parkin, IP; (2009) Atmospheric pressure chemical vapour deposition of thermochromic tungsten doped vanadium dioxide thin films for use in architectural glazing. Thin Solid Films , 517 (16) 4565 - 4570. 10.1016/j.tsf.2008.12.050. Green open access
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Blanazs, A; Massignani, M; Battaglia, G; Armes, SP; Ryan, AJ; (2009) Tailoring Macromolecular Expression at Polymersome Surfaces. ADVANCED FUNCTIONAL MATERIALS , 19 (18) 2906 - 2914. 10.1002/adfm.200900201.

Borsenberger, V; Howorka, S; (2009) Diene-modified nucleotides for the DielsAlder-mediated functional tagging of DNA. Nucleic Acids Research , 37 (5) 1477 - 1485. 10.1093/nar/gkn1066. Green and gold open access
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Borsenberger, V; Kukwikila, M; Howorka, S; (2009) Synthesis and enzymatic incorporation of modified deoxyuridine triphosphates. ORG BIOMOL CHEM , 7 (18) 3826 - 3835. 10.1039/b906956a.

Borsenberger, V; Mitchell, N; Howorka, S; (2009) Chemically Labeled Nucleotides and Oligonucleotides Encode DNA for Sensing with Nanopores. J AM CHEM SOC , 131 (22) 7530 - +. 10.1021/ja902004s.

Bourlange, A; Payne, DJ; Palgrave, RG; Foord, JS; Egdell, RG; Jacobs, RMJ; ... Dobson, PJ; + view all (2009) Investigation of the growth of In2O3 on Y-stabilized ZrO2(100) by oxygen plasma assisted molecular beam epitaxy. THIN SOLID FILMS , 517 (15) 4286 - 4294. 10.1016/j.tsf.2008.11.134.

Bourlange, A; Payne, DJ; Palgrave, RG; Zhang, H; Foord, JS; Egdell, RG; ... McConville, CF; + view all (2009) The influence of Sn doping on the growth of In2O3 on Y-stabilized ZrO2(100) by oxygen plasma assisted molecular beam epitaxy. JOURNAL OF APPLIED PHYSICS , 106 (1) , Article ARTN 013703. 10.1063/1.3153966.

Braide-Azikiwe, DCB; Holt, KB; Williams, DE; Caruana, DJ; (2009) Soap film electrochemistry. ELECTROCHEM COMMUN , 11 (6) 1226 - 1229. 10.1016/j.elecom.2009.04.006.

Branda, MM; Castellani, NJ; Grau-Crespo, R; de Leeuw, NH; Hernandez, NC; Sanz, JF; ... Illas, F; + view all (2009) On the difficulties of present theoretical models to predict the oxidation state of atomic Au adsorbed on regular sites of CeO2(111). J CHEM PHYS , 131 (9) , Article 094702. 10.1063/1.3216102.

Bresme, F; Duffy, D; Woodley, S; (2009) Untitled. MOL SIMULAT , 35 (7) 531 - 531. 10.1080/08927020902906917.

Briquet, L; Catlow, CRA; French, SA; (2009) PHYS 426-Comparison of the adsorption of transition metals on alpha-alumina surfaces. ABSTR PAP AM CHEM S , 237 ? - ?.

Briquet, LGV; Catlow, CRA; French, SA; (2009) Platinum Group Metal Adsorption on Clean and Hydroxylated Corundum Surfaces. J PHYS CHEM C , 113 (38) 16747 - 16756. 10.1021/jp904217b.

Bronstein, HA; Luscombe, CK; (2009) Externally initiated regioregular P3HT with controlled molecular weight and narrow polydispersity. J Am Chem Soc , 131 (36) 12894 - 12895. 10.1021/ja9054977.

Brown, SL; Konkolewicz, D; Gray-Weale, A; Motherwell, WB; Perrier, S; (2009) Searching for Stars: Selective Desulfurization and Fluorescence Spectroscopy as New Tools in the Search for Cross Termination Side-products in RAFT Polymerization. AUST J CHEM , 62 (11) 1533 - 1536. 10.1071/CH09242.

Bruce, IE; Mehta, L; Porter, MJ; Stein, BK; Tyman, JHP; (2009) Anionic Surfactants Synthesised from Replenishable Phenolic Lipids. J SURFACTANTS DETERG , 12 (4) 337 - 344. 10.1007/s11743-009-1116-8.

Buckeridge, J; Teweldeberhan, A; Fahy, S; (2009) Vibrational mode shifts as a measure of local strain in the dilute nitride semiconductor alloy GaNxAs1−x. Physical Review B , 79 (15) 10.1103/PhysRevB.79.153201.

Bučar, D-K; Lou, X; Zhang, GGZ; MacGillivray, LR; Henry, RF; Duerst, RW; (2009) Cocrystals of caffeine and hydroxybenzoic acids composed of multiple supramolecular heterosynthons: Screening via solution-mediated phase transformation and structural characterization. Crystal Growth and Design , 9 (4) 1932 - 1943. 10.1021/cg801178m.

Cabrera, RQ; Salamat, A; Barkalov, OI; Leynaud, O; Hutchins, P; Daisenberger, D; ... McMillan, PF; + view all (2009) Pressure-induced structural transformations of the Zintl phase sodium silicide. J SOLID STATE CHEM , 182 (9) 2535 - 2542. 10.1016/j.jssc.2009.06.037.

Carmalt, CJ; Knapp, CE; Potts, SE; (2009) Molecular design of precursors for the CVD of metal oxides and nitrides. ABSTR PAP AM CHEM S , 237 ? - ?.

Celiz, AD; Lee, T-C; Scherman, OA; (2009) Polymer-Mediated Dispersion of Gold Nanoparticles: Using Supramolecular Moieties on the Periphery. Advanced Materials , 21 (38–39) 3937 - 3940. 10.1002/adma.200901291.

Chen, BQ; Evans, JRG; (2009) Impact strength of polymer-clay nanocomposites. SOFT MATTER , 5 (19) 3572 - 3584. 10.1039/b902073j.

Chen, LF; Evans, JRG; (2009) Arched Structures Created by Colloidal Droplets as They Dry. LANGMUIR , 25 (19) 11299 - 11301. 10.1021/la902918m.

Chen, LMF; You, C; Li, SJ; Yang, R; Guo, ZX; (2009) The formation of nanocrystallite bone-like apatite on chemically treated Ti-24Nd-4Zr-7.9Sn alloy. Journal of Nanoscience and Nanotechnology , 9 (2) 1214 - 1217. 10.1166/jnn.2009.C122.

Chen, SY; Gong, XG; Walsh, A; Wei, SH; (2009) Crystal and electronic band structure of Cu2ZnSnX4 (X=S and Se) photovoltaic absorbers: First-principles insights. APPL PHYS LETT , 94 (4) , Article 041903. 10.1063/1.3074499.

Chen, SY; Gong, XG; Walsh, A; Wei, SH; (2009) Electronic structure and stability of quaternary chalcogenide semiconductors derived from cation cross-substitution of II-VI and I-III-VI2 compounds. PHYS REV B , 79 (16) , Article 165211. 10.1103/PhysRevB.79.165211.

Chen, SY; Yin, WJ; Yang, JH; Gong, XG; Walsh, A; Wei, SH; (2009) Quaternary semiconductors with positive crystal field splitting: Potential high-efficiency spin-polarized electron sources. APPL PHYS LETT , 95 (5) , Article 052102. 10.1063/1.3193662.

Clegg, W; Conway, B; Garcia-Alvarez, P; Kennedy, AR; Mulvey, RE; Russo, L; ... Tuttle, T; + view all (2009) Structural Tracking of the Potassium-Mediated Magnesiation of Anisole. CHEM-EUR J , 15 (41) 10702 - 10706. 10.1002/chem.200901897.

Coates, R; Coreno, M; DeSimone, M; Green, JC; Kaltsoyannis, N; Kerridge, A; ... Sella, A; + view all (2009) A mystery solved? Photoelectron spectroscopic and quantum chemical studies of the ion states of CeCp3+. DALTON T (30) 5943 - 5953. 10.1039/b902263e.

Colman, RH; Fennell, T; Ritter, C; Lau, G; Cava, RJ; Wills, AS; (2009) Low temperature magnetic structure of the quasi 1-dimensional magnet Ni2SiO4. HIGHLY FRUSTRATED MAGNETISM 2008 (HFM 2008) , 145 , Article 012037. 10.1088/1742-6596/145/1/012037. Gold open access

Conde, MM; Vega, C; Tribello, GA; Slater, B; (2009) The phase diagram of water at negative pressures: Virtual ices. J CHEM PHYS , 131 (3) , Article 034510. 10.1063/1.3182727.

Cook, KM; Hilton, ST; Mecinovic, J; Motherwell, WB; Figg, WD; Schofield, CJ; (2009) Epidithiodiketopiperazines Block the Interaction between Hypoxia-inducible Factor-1 alpha (HIF-1 alpha) and p300 by a Zinc Ejection Mechanism. J BIOL CHEM , 284 (39) 26831 - 26838. 10.1074/jbc.M109.009498. Gold open access

Coombes, DS; Cora, F; Mellot-Draznieks, C; Bell, RG; (2009) Sorption-Induced Breathing in the Flexible Metal Organic Framework CrMIL-53: Force-Field Simulations and Electronic Structure Analysis. J PHYS CHEM C , 113 (2) 544 - 552. 10.1021/jp809408x.

Cornet, SM; Haller, LJL; Sarsfield, MJ; Collison, D; Helliwell, M; May, I; Kaltsoyannis, N; (2009) Neptunium(VI) chain and neptunium(VI/V) mixed valence cluster complexes. CHEM COMMUN (8) 917 - 919. 10.1039/b818973k.

Corr, MJ; Roydhouse, MD; Gibson, KF; Zhou, SZ; Kennedy, AR; Murphy, JA; (2009) Amidine Dications as Superelectrophiles. J AM CHEM SOC , 131 (49) 17980 - 17985. 10.1021/ja908191k.

Coveney, PV; Atkinson, MP; (2009) Crossing boundaries: computational science, e-Science and global e-Infrastructure INTRODUCTION. PHILOS T R SOC A , 367 (1897) 2425 - 2427. 10.1098/rsta.2009.0061.

Coveney, PV; Atkinson, MP; (2009) Crossing boundaries: computational science, e-Science and global e-Infrastructure PREFACE. PHILOS T R SOC A , 367 (1898) 2621 - 2621. 10.1098/rsta.2009.0102.

Crick, CR; Parkin, IP; (2009) A single step route to superhydrophobic surfaces through aerosol assisted deposition of rough polymer surfaces: duplicating the lotus effect. J MATER CHEM , 19 (8) 1074 - 1076. 10.1039/b820102c.

Crimmin, MR; Arrowsmith, M; Barrett, AGM; Casely, IJ; Hill, MS; Procopiou, PA; (2009) Intramolecular Hydroamination of Aminoalkenes by Calcium and Magnesium Complexes: A Synthetic and Mechanistic Study. J AM CHEM SOC , 131 (28) 9670 - 9685. 10.1021/ja9003377.

Crimmin, MR; Barrett, AGM; Hill, MS; MacDougall, DJ; Mahon, MF; Procopiou, PA; (2009) beta-Diketiminate C-H activation with heavier group 2 alkyls. DALTON T (44) 9715 - 9717. 10.1039/b917466b.

Cross, WB; Anderson, JC; Wilson, CS; (2009) Nucleophilic reactivity of a d(0) molybdenum oxo moiety. DALTON T (7) 1201 - 1205. 10.1039/b817745g.

Cubillas, P; Castro, M; Jelfs, KE; Lobo, AJW; Slater, B; Lewis, DW; ... Anderson, MW; + view all (2009) Spiral Growth on Nanoporous Silicoaluminophosphate STA-7 as Observed by Atomic Force Microscopy. CRYST GROWTH DES , 9 (9) 4041 - 4050. 10.1021/cg900255u.

Cucinotta, CS; Kosa, M; Melchiorre, P; Cavalli, A; Gervasio, FL; (2009) Bifunctional catalysis by natural cinchona alkaloids: a mechanism explained. Chemistry , 15 (32) 7913 - 7921. 10.1002/chem.200900406.

Da Silva, JLF; Walsh, A; Wei, SH; (2009) Theoretical investigation of atomic and electronic structures of Ga2O3(ZnO)(6). PHYS REV B , 80 (21) , Article 214118. 10.1103/PhysRevB.80.214118.

Da Silva, JLF; Walsh, A; Wei, SH; Lee, H; (2009) Atomistic origins of the phase transition mechanism in Ge2Sb2Te5. J APPL PHYS , 106 (11) , Article 113509. 10.1063/1.3264883.

Daff, TD; Costa, D; Lisiecki, I; de Leeuw, NH; (2009) Density Functional Theory Calculations of the Interaction of Hydrazine with Low-Index Copper Surfaces. J PHYS CHEM C , 113 (35) 15714 - 15722. 10.1021/jp904054n.

Daff, TD; Saadoune, I; Lisiecki, I; de Leeuw, NH; (2009) Computer simulations of the effect of atomic structure and coordination on the stabilities and melting behaviour of copper surfaces and nano-particles. SURF SCI , 603 (3) 445 - 454. 10.1016/j.susc.2008.11.031.

Daniels, BG; Bikondoa, O; Thornton, G; (2009) A surface X-ray diffraction study of TiO2(110)(3 x 1)-S. SURF SCI , 603 (13) 2015 - 2020. 10.1016/j.susc.2009.03.021.

Danopoulos, AA; Pugh, D; Smith, H; Sassmannshausen, J; (2009) Structural and Reactivity Studies of "Pincer" Pyridine Dicarbene Complexes of Fe-0: Experimental and Computational Comparison of the Phosphine and NHC Donors. CHEM-EUR J , 15 (22) 5491 - 5502. 10.1002/chem.200900027.

Davies, ZL; Poole, A; Wills, AS; (2009) Significance of phase difference in magnetism and the magneto-electric effect. HIGHLY FRUSTRATED MAGNETISM 2008 (HFM 2008) , 145 , Article 012072. 10.1088/1742-6596/145/1/012072. Gold open access

Day, GM; Cooper, TG; Cruz-Cabeza, AJ; Hejczyk, KE; Ammon, HL; Boerrigter, SXM; ... Schweizer, B; + view all (2009) Significant progress in predicting the crystal structures of small organic molecules - a report on the fourth blind test. ACTA CRYSTALLOGR B , 65 107 - 125. 10.1107/S0108768109004066.

de Leeuw, NH; (2009) Computer simulations of the interaction of water with complex mineral surfaces and clusters. ABSTR PAP AM CHEM S , 237 ? - ?.

de Smit, E; Beale, AM; Nikitenko, S; Weckhuysen, BM; (2009) Local and long range order in promoted iron-based Fischer–Tropsch catalysts: A combined in situ X-ray absorption spectroscopy/wide angle X-ray scattering study. Journal of Catalysis , 262 (2) 244 - 256. 10.1016/j.jcat.2008.12.021.

Decraene, V; Rampaul, A; Parkin, IP; Petrie, A; Wilson, M; (2009) Enhancement by Nanogold of the Efficacy of a Light-Activated Antimicrobial Coating. CURR NANOSCI , 5 (3) 257 - 261.

Desrat, S; van de Weghe, P; (2009) Intramolecular Imino Diels-Alder Reaction: Progress toward the Synthesis of Uncialamycin. Journal of Organic Chemistry , 74 (17) 6728 - 6734. 10.1021/jo901291t. Green open access
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Devey, AJ; Grau-Crespo, R; de Leeuw, NH; (2009) Electronic and magnetic structure of Fe3S4: GGA+U investigation. PHYS REV B , 79 (19) , Article 195126. 10.1103/PhysRevB.79.195126.

Deyko, A; Lovelock, KRJ; Corfield, JA; Taylor, AW; Gooden, PN; Villar-Garcia, IJ; ... Kustov, LM; + view all (2009) Measuring and predicting Delta H-vap(298) values of ionic liquids. PHYS CHEM CHEM PHYS , 11 (38) 8544 - 8555. 10.1039/b908209c.

Di Tommaso, D; de Leeuw, NH; (2009) Theoretical study of the dimerization of calcium carbonate in aqueous solution under natural water conditions. GEOCHIM COSMOCHIM AC , 73 (18) 5394 - 5405. 10.1016/j.gca.2009.06.003.

Doubina, N; Stoddard, M; Jen, AK-Y; Bronstein, HA; Luscombe, CK; (2009) The effects of binding ligand variation on the nickel catalyzed externally initiated polymerization of 2-bromo-3-hexyl-5- iodothiophene. Macromolecular Chemistry and Physics , 210 (22) 1966 - 1972. 10.1002/macp.200900375.

Douglas, KM; Price, SD; (2009) Studies of the fragmentation of the monocation and dication of methanol. J CHEM PHYS , 131 (22) , Article 224305. 10.1063/1.3266940.

DUNNILL, C; Parkin, IP; (2009) N Titania Thin Films, Prepared by Atmospheric Pressure Chemical Vapor Deposition: Enhanced Visible Light Photocatalytic Activity and Antimicrobial Effects. ECS Meeting Abstracts , 902 (34) 2472 - ?.

Dunnill, CW; Aiken, ZA; Kafizas, A; Pratten, J; Wilson, M; Morgan, DJ; Parkin, IP; (2009) White light induced photocatalytic activity of sulfur-doped TiO2 thin films and their potential for antibacterial application. J MATER CHEM , 19 (46) 8747 - 8754. 10.1039/b913793a.

Dunnill, CW; Aiken, ZA; Pratten, J; Wilson, M; Parkin, IP; (2009) N-doped Titania Thin Films, Prepared by Atmospheric Pressure Chemical Vapour Deposition: Enhanced Visible Light Photocatalytic Activity and Anti-microbial Effects. EUROCVD 17 / CVD 17 , 25 (8) 65 - 72. 10.1149/1.3207576.

Dunnill, CW; Parkin, IP; (2009) N-Doped Titania Thin Films Prepared by Atmospheric Pressure CVD using t-Butylamine as the Nitrogen Source: Enhanced Photocatalytic Activity under Visible Light. CHEM VAPOR DEPOS , 15 (7-9) 171 - +. 10.1002/cvde.200806274.

Dunnill, CWH; Aiken, ZA; Pratten, J; Wilson, M; Morgan, DJ; Parkin, IP; (2009) Enhanced photocatalytic activity under visible light in N-doped TiO2 thin films produced by APCVD preparations using t-butylamine as a nitrogen source and their potential for antibacterial films. Journal of Photochemistry and Photobiology A: Chemistry , 207 (2-3) 244 - 253. 10.1016/j.jphotochem.2009.07.024.

Dunnill, CWH; Aiken, ZA; Pratten, J; Wilson, M; Morgan, DJ; Parkin, IP; (2009) Enhanced photocatalytic activity under visible light in N-doped TiO2 thin films produced by APCVD preparations using t-butylamine as a nitrogen source and their potential for antibacterial films. J PHOTOCH PHOTOBIO A , 207 (2-3) 244 - 253. 10.1016/j.jphotochem.2009.07.024.

Elacqua, E; Bučar, D-K; Skvortsova, Y; Baltrusaitis, J; Lei Geng, M; MacGillivray, LR; (2009) Dramatic red-shifted fluorescence of [2.2]paracyclophanes with peripheral substituents attached to the saturated bridges. Organic Letters , 11 (22) 5106 - 5109. 10.1021/ol901907j.

Ellwood, AR; Mortimer, AJP; Tocher, DA; Porter, MJ; (2009) Diastereoselective Thia-Claisen Rearrangement of Pyrrolidinone-Derived Ketene N,S-Acetals (pg 2199, 2008). SYNLETT (18) 3052 - 3052.

Ellwood, AR; Porter, MJ; (2009) Selective Conversion of Alcohols into Alkyl Iodides Using a Thioiminium Salt. J ORG CHEM , 74 (20) 7982 - 7985. 10.1021/jo901415n.

Espinosa-Alonso, L; O'Brien, MG; Jacques, SDM; Beale, AM; de Jong, KP; Barnes, P; Weckhuysen, BM; (2009) Tomographic Energy Dispersive Diffraction Imaging To Study the Genesis of Ni Nanoparticles in 3D within gamma-Al2O3 Catalyst Bodies. J AM CHEM SOC , 131 (46) 16932 - 16938. 10.1021/ja907329j.

Fenner, LA; Dee, AA; Wills, AS; (2009) Non-collinearity and spin frustration in the itinerant kagome ferromagnet Fe3Sn2. J PHYS-CONDENS MAT , 21 (45) , Article 452202. 10.1088/0953-8984/21/45/452202.

Fenner, LA; Wills, AS; Bramwell, ST; Dahlberg, M; Schiffer, P; (2009) Zero-point entropy of the spinel spin glasses CuGa2O4 and CuAl2O4. HIGHLY FRUSTRATED MAGNETISM 2008 (HFM 2008) , 145 , Article 012029. 10.1088/1742-6596/145/1/012029. Gold open access

Fernyhough, C; Ryan, AJ; Battaglia, G; (2009) pH controlled assembly of a polybutadiene-poly(methacrylic acid) copolymer in water: packing considerations and kinetic limitations. SOFT MATTER , 5 (8) 1674 - 1682. 10.1039/b817218h.

Fischer, M; Hoffmann, F; Fröba, M; (2009) Preferred hydrogen adsorption sites in various MOFs--a comparative computational study. Chemphyschem , 10 (15) 2647 - 2657. 10.1002/cphc.200900459.

Fitzmaurice, RJ; Ahern, JM; Caddick, S; (2009) Synthesis of unsymmetrical ketones via simple C-H activation of aldehydes and concomitant hydroacylation of vinyl sulfonates. ORG BIOMOL CHEM , 7 (2) 235 - 237. 10.1039/b819235a.

Flores-Merino, MV; Reilly, GC; Battaglia, G; Engler, AJ; (2009) Nano-domain detection in Poly (vinyl pyrrolidinone) hydrogels. European Cells and Materials , 18 (SUPPL. 2) 33 - 33. Gold open access

Gaitzsch, J; Rogachev, VO; Metz, P; Yusubov, MS; Filimonov, VD; Kataeva, O; (2009) The first example of a domino Diels-Alder/retro-Diels-Alder reaction of 1,3-dienic delta-sultones with alkynes: a simple synthesis of m-terphenyl dicarboxy derivatives from 4,6-diphenyl-[1,2]oxathiine 2,2-dioxide. JOURNAL OF SULFUR CHEMISTRY , 30 (1) 4 - 9. 10.1080/17415990802512710.

Galea, NM; Scanlon, DO; Morgan, BJ; Watson, GW; (2009) A GGA +U study of the reduction of ceria surfaces and their partial reoxidation through NO2 adsorption. Molecular Simulation , 35 (7) 577 - 583.

Galman, JL; Hailes, HC; (2009) Application of a modified Mosher's method for the determination of enantiomeric ratio and absolute configuration at C-3 of chiral 1,3-dihydroxy ketones. TETRAHEDRON-ASYMMETR , 20 (15) 1828 - 1831. 10.1016/j.tetasy.2009.07.023.

Garrahan, JP; Stannard, A; Blunt, MO; Beton, PH; (2009) Molecular random tilings as glasses. Proc Natl Acad Sci U S A , 106 (36) 15209 - 15213. 10.1073/pnas.0902443106.

Gavaghan, D; Coveney, PV; Kohl, P; (2009) The virtual physiological human: tools and applications I. PHILOS T R SOC A , 367 (1895) 1817 - 1821. 10.1098/rsta.2009.0070.

Ghosh, S; Das, AK; Begum, N; Haworth, DT; Lindeman, SV; Gardinier, JF; ... Kabir, SE; + view all (2009) Reactivity of phenyldi(2-thienyl) phosphine towards group 7 metal carbonyls: Carbon-phosphorus bond activation. INORG CHIM ACTA , 362 (15) 5175 - 5182. 10.1016/j.ica.2009.09.021.

Ghosh, S; Hogarth, G; Kabir, SE; Miah, AL; Salassa, L; Sultana, S; Garino, C; (2009) Synthesis and Molecular Structure of [Fe-4(CO)(10)(mu(4)-O)(kappa(K)2-dppn)] (dppn=1,8-bis(diphenylphosphino)naphthalene): A Missing Piece in the [M-4(CO)(12)(mu(4)-E)](n-) (M = Fe, Ru:E = C, N, O; n=2, 1, 0) Puzzle. ORGANOMETALLICS , 28 (24) 7047 - 7052. 10.1021/om900855v.

Ghosh, S; Khatun, M; Haworth, DT; Lindeman, SV; Siddiquee, TA; Bennett, DW; ... Kabir, SE; + view all (2009) Activation of tri(2-furyl)phosphine at a dirhenium centre: Formation of phosphido-bridged dirhenium complexes. J ORGANOMET CHEM , 694 (18) 2941 - 2948. 10.1016/j.jorganchem.2009.04.032.

Ghosh, S; Rana, S; Tocher, DA; Hogarth, G; Nordlander, E; Kabir, SE; (2009) Reactivity of the triruthenium ortho-metalated cluster [Ru-3(CO)(9){mu(3)- eta(1), kappa(1),kappa(2)-PhP( C6H4) CH2PPh}] with tri(2-thienyl) phosphine and tri( 2-furyl) phosphine: Formation of 1,3-diphenyl-2,3-dihydro-1H-1,3-benzodiphosphine complexes via phosphorus-carbon bond formation. J ORGANOMET CHEM , 694 (20) 3312 - 3319. 10.1016/j.jorganchem.2009.06.005.

Gill, M; Battaglia, G; Thomas, JA; (2009) Ru(II) complexes as DNA probes in cell imaging applications. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY , 237 511 - 511.

Gill, MR; Garcia-Lara, J; Foster, SJ; Smythe, C; Battaglia, G; Thomas, JA; (2009) A ruthenium(II) polypyridyl complex for direct imaging of DNA structure in living cells. Nat Chem , 1 (8) 662 - 667. 10.1038/nchem.406.

Godinho, KG; Walsh, A; Watson, GW; (2009) Energetic and Electronic Structure Analysis of Intrinsic Defects in SnO2. J PHYS CHEM C , 113 (1) 439 - 448. 10.1021/jp807753t.

Gomez-Hortiguela, L; Hamad, S; Lopez-Arbeloa, F; Pinar, AB; Perez-Pariente, J; Cora, F; (2009) Molecular Insights into the Self-Aggregation of Aromatic Molecules in the Synthesis of Nanoporous Aluminophosphates: A Multilevel Approach. J AM CHEM SOC , 131 (45) 16509 - 16524. 10.1021/ja906105x.

Gomez-Hortiguela, L; Perez-Pariente, J; Cora, F; (2009) Insights into Structure Direction of Microporous Aluminophosphates: Competition between Organic Molecules and Water. CHEM-EUR J , 15 (6) 1478 - 1490. 10.1002/chem.200801458.

Gomez-Hortiguela, L; Pinar, AB; Perez-Pariente, J; Cora, F; (2009) Structure-Directing Effect of (S)-(-)-N-Benzylpyrrolidine-2-methanol and Benzylpyrrolidine in the Synthesis of STA-1: A New Computational Model for Structure Direction of Nanoporous Systems. CHEM MATER , 21 (14) 3447 - 3457. 10.1021/cm901149a.

Goumans, TPM; Catlow, CRA; Brown, WA; Kastner, J; Sherwood, P; (2009) An embedded cluster study of the formation of water on interstellar dust grains. PHYS CHEM CHEM PHYS , 11 (26) 5431 - 5436. 10.1039/b816905e.

Goumans, TPM; Richard, C; Catlow, A; Brown, WA; (2009) Formation of H-2 on an olivine surface: a computational study. MON NOT R ASTRON SOC , 393 (4) 1403 - 1407. 10.1111/j.1365-2966.2008.14155.x.

Grau-Crespo, R; Hernandez, NC; Sanz, JF; de Leeuw, NH; (2009) PHYS 13-DFT modeling of the interaction of noble metals with ceria and zirconia surfaces. ABSTR PAP AM CHEM S , 237 ? - ?.

Grau-Crespo, R; Hernandez, NC; Sanz, JF; de Leeuw, NH; (2009) Redox properties of gold-substituted zirconia surfaces. J MATER CHEM , 19 (6) 710 - 717. 10.1039/b812245h.

Grau-Crespo, R; Smith, KC; Fisher, TS; de Leeuw, NH; Waghmare, UV; (2009) Thermodynamics of hydrogen vacancies in MgH2 from first-principles calculations and grand-canonical statistical mechanics. PHYS REV B , 80 (17) , Article 174117. 10.1103/PhysRevB.80.174117.

Green, N; Huang, Q; Battaglia, G; MacNeil, S; Khan, L; Corfe, B; Bury, J; (2009) Development and characterisation of a tissue engineered oesophagus. European Cells and Materials , 18 (SUPPL. 2) 64 - 64. Gold open access

Green, SD; Bolina, AS; Chen, R; Collings, MP; Brown, WA; McCoustra, MRS; (2009) Applying laboratory thermal desorption data in an interstellar context: sublimation of methanol thin films(star). MON NOT R ASTRON SOC , 398 (1) 357 - 367. 10.1111/j.1365-2966.2009.15144.x.

Grounds, H; Anderson, JC; Hayter, B; Blake, AJ; (2009) A New Oxidative Addition of Ruthenium(0) into an Aryl Halide Bond and Subsequent Intermolecular C-H Insertion. ORGANOMETALLICS , 28 (17) 5289 - 5292. 10.1021/om900510k.

Gruber-Woelfler, H; Khinast, JG; Flock, M; Fischer, RC; Sassmannshausen, J; Stanoeva, T; Gescheidt, G; (2009) Titanocene-Catalyzed Hydrosilylation of Imines: Experimental and Computational Investigations of the Catalytically Active Species. ORGANOMETALLICS , 28 (8) 2546 - 2553. 10.1021/om800643q.

Habgood, M; Jefferson, JH; Briggs, GAD; (2009) Scattering-induced entanglement between spin qubits at remote two-state structures. J PHYS-CONDENS MAT , 21 (7) , Article 075503. 10.1088/0953-8984/21/7/075503.

Haghdadi, M; Amiri, R; Price, LS; (2009) DFT studies on structures and stability of some keto-fructose analogues. J MOL STRUC-THEOCHEM , 904 (1-3) 57 - 63. 10.1016/j.theochem.2009.02.029.

Hailes, HC; Dalby, PA; Lye, GJ; Ward, JM; (2009) Biocatalytic approaches to ketodiols and aminodiols. CHIM OGGI , 27 (4) 28 - 31.

Hamad, S; Woodley, SM; Catlow, CRA; (2009) Experimental and computational studies of ZnS nanostructures. MOL SIMULAT , 35 (12-13) 1015 - 1032. 10.1080/08927020903015346.

He, YB; Tilocca, A; Dulub, O; Selloni, A; Diebold, U; (2009) Local ordering and electronic signatures of submonolayer water on anatase TiO2(101). NAT MATER , 8 (7) 585 - 589. 10.1038/NMAT2466.

Hearnden, V; Lomas, H; Macneil, S; Thornhill, M; Murdoch, C; Lewis, A; ... Battaglia, G; + view all (2009) Diffusion studies of nanometer polymersomes across tissue engineered human oral mucosa. Pharm Res , 26 (7) 1718 - 1728. 10.1007/s11095-009-9882-6.

Henrich, O; Marenduzzo, D; Stratford, K; Cates, ME; (2009) Domain growth in cholesteric blue phases: hybrid lattice Boltzmann simulations. Comput. Math. Appl. , 59 2360 - 2369. 10.1016/j.camwa.2009.08.047.

Hernandez, NC; Grau-Crespo, R; de Leeuw, NH; Sanz, JF; (2009) Electronic charge transfer between ceria surfaces and gold adatoms: a GGA plus U investigation. PHYS CHEM CHEM PHYS , 11 (26) 5246 - 5252. 10.1039/b820373c.

Hirano, K; Macmillan, D; Tezuka, K; Tsuji, T; Kajihara, Y; (2009) Design and Synthesis of a Homogeneous Erythropoietin Analogue with Two Human Complex-Type Sialyloligosaccharides: Combined Use of Chemical and Bacterial Protein Expression Methods. ANGEW CHEM INT EDIT , 48 (50) 9557 - 9560. 10.1002/anie.200904376.

Ho, KK; Rosivatz, E; Gunn, RM; Smith, MEB; Stavropoulou, AV; Rosivatz, E; ... Lam, EWF; + view all (2009) The novel molecule 2-[5-(2-chloroethyl)-2-acetoxy-benzyl]-4-(2-chloroethyl)-phenyl acetate inhibits phosphoinositide 3-kinase/Akt/mammalian target of rapamycin signalling through JNK activation in cancer cells. FEBS J , 276 (15) 4037 - 4050. 10.1111/j.1742-4658.2009.07112.x.

Hofbauer, W; Ho, RJ; Hairulnizam, R; Gosvami, NN; O'Shea, SJ; (2009) Crystalline structure and squeeze-out dissipation of liquid solvation layers observed by small-amplitude dynamic AFM. PHYS REV B , 80 (13) , Article 134104. 10.1103/PhysRevB.80.134104.

Hogarth, G; Rainford-Brent, EJCRCR; Kabir, SE; Richards, I; Wilton-Ely, JDET; Zhang, Q; (2009) Functionalised dithiocarbamate complexes: Synthesis and molecular structures of 2-diethylaminoethyl and 3-dimethylaminopropyl dithiocarbamate complexes [M{S2CN(CH2CH2NEt2)(2)}(n)] and [M{S2CN(CH2CH2CH2NMe2)(2)}(n)] (n=2, M = Ni, Cu, Zn, Pd; n=3, M = Co). INORG CHIM ACTA , 362 (6) 2020 - 2026. 10.1016/j.ica.2008.09.030.

Hogarth, G; Rainford-Brent, EJCRCR; Richards, I; (2009) Functionalised dithiocarbamate complexes: Synthesis and molecular structures of bis(2-methoxyethyl)dithiocarbamate complexes [M{S2CN(CH2CH2OMe)(2)}(2)] (M = Ni, Cu, Zn) and [Cu{S2CN(CH2CH2OMe)(2)}(2)][ClO4]. INORG CHIM ACTA , 362 (4) 1361 - 1364. 10.1016/j.ica.2008.05.010.

Hollingsworth, N; Johnson, AL; Molloy, KC; (2009) First organocadmium hydrazide and hydrazine and use as a CVD precursor. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY , 238

Hollingsworth, N; Johnson, AL; Molloy, KC; (2009) Zinc alkyl peroxide: A model for formation. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY , 238

Holt, KB; Caruana, DJ; Millan-Barrios, EJ; (2009) Electrochemistry of Undoped Diamond Nanoparticles: Accessing Surface Redox States. J AM CHEM SOC , 131 (32) 11272 - +. 10.1021/ja902216n.

Holt, KB; Ziegler, C; Zang, JB; Hu, JP; Foord, JS; (2009) Scanning Electrochemical Microscopy Studies of Redox Processes at Undoped Nanodiamond Surfaces. J PHYS CHEM C , 113 (7) 2761 - 2770. 10.1021/jp8038384.

Howorka, S; Siwy, Z; (2009) Nanopore analytics: sensing of single molecules. CHEM SOC REV , 38 (8) 2360 - 2384. 10.1039/b813796j.

Howse, JR; Jones, RA; Battaglia, G; Ducker, RE; Leggett, GJ; Ryan, AJ; (2009) Templated formation of giant polymer vesicles with controlled size distributions. Nat Mater , 8 (6) 507 - 511. 10.1038/nmat2446.

Hu, JP; Holt, KB; Foord, JS; (2009) Focused Ion Beam Fabrication of Boron-Doped Diamond Ultramicroelectrodes. ANAL CHEM , 81 (14) 5663 - 5670. 10.1021/ac9003908.

Huda, MN; Yan, YF; Walsh, A; Wei, SH; Al-Jassim, MM; (2009) Group-IIIA versus IIIB delafossites: Electronic structure study. PHYS REV B , 80 (3) , Article 035205. 10.1103/PhysRevB.80.035205.

Huda, MN; Yan, YF; Walsh, A; Wei, SH; Al-Jassim, MM; (2009) Symmetry-breaking-induced enhancement of visible light absorption in delafossite alloys. APPL PHYS LETT , 94 (25) , Article 251907. 10.1063/1.3157840.

Humphrey, DS; Cabailh, G; Pang, CL; Muryn, CA; Cavill, SA; Marchetto, H; ... Thornton, G; + view all (2009) Self-Assembled Metallic Nanowires on a Dielectric Support: Pd on Rutile TiO2(110). NANO LETT , 9 (1) 155 - 159. 10.1021/nl802703e.

Hyder, MI; Begum, N; Sikder, MDH; Hossain, GMG; Hogarth, G; Kabir, SE; Richard, CJ; (2009) Synthesis and structure of sulfur and selenium capped dihydride triruthenium clusters [Ru-3(CO)(7)(mu-H)(2)(mu-dppm)(mu(3)-E)] (E = S, Se). J ORGANOMET CHEM , 694 (2) 304 - 308. 10.1016/j.jorganchem.2008.10.030.

Hyett, G; Green, MA; Parkin, IR; (2009) Ultra-violet light activated photocatalysis in thin films of the titanium oxynitride, Ti3-delta O4N. J PHOTOCH PHOTOBIO A , 203 (2-3) 199 - 203. 10.1016/j.jphotochem.2009.01.020.

Iglesias-Juez, A; Beale, AM; O'Brien, MG; Newton, MA; Bras, W; Weckhuysen, BM; (2009) Multi-Technique In Situ Approach Towards the Study of Catalytic Solids at Work Using Synchrotron Radiation. Synchrotron Radiation News , 22 (1) 22 - 30. 10.1080/08940880802667924.

Ikeda, M; Koide, N; Han, LY; Pang, CL; Sasahara, A; Onishi, H; (2009) Lateral distribution of N3 dye molecules on TiO2 (110) surface. J PHOTOCH PHOTOBIO A , 202 (2-3) 185 - 190. 10.1016/j.jphotochem.2008.12.005.

Issa, N; Karamertzanis, PG; Welch, GWA; Price, SL; (2009) Can the Formation of Pharmaceutical Cocrystals Be Computationally Predicted? I. Comparison of Lattice Energies. CRYST GROWTH DES , 9 (1) 442 - 453. 10.1021/cg800685z.

Jerome, L; Sheppard, TD; Aliev, AE; Motherwell, WB; (2009) Intramolecular amidocyclopropanation reactions using diethoxymethyl-functionalised lactams as organozinc carbenoid precursors. Tetrahedron Letters , 50 (26) 3709 - 3712. 10.1016/j.tetlet.2009.03.224. Green open access
file

Johnson, AL; Hollingsworth, N; Kingsley, A; Kociok-Koehn, G; Molloy, KC; (2009) Organocadmium Hydrazide and Hydrazine Complexes. ORGANOMETALLICS , 28 (8) 2650 - 2653. 10.1021/om900121z.

Kabalan, L; Matar, SF; (2009) First principles studies of the electronic and magnetic structures of [Fe(pz)(2)](x) complex. CHEM PHYS , 359 (1-3) 14 - 20. 10.1016/j.chemphys.2009.02.012.

Kabir, SE; Alam, J; Ghosh, S; Kundu, K; Hogarth, G; Tocher, DA; ... Roesky, HW; + view all (2009) Synthesis, structure and reactivity of tetranuclear square-type complexes of rhenium and manganese bearing pyrimidine-2-thiolate (pymS) ligands: versatile and efficient precursors for mono- and polynuclear compounds containing M(CO)(3) (M = Re, Mn) fragments. DALTON T (23) 4458 - 4467. 10.1039/b815337j.

Kabir, SE; Hogarth, G; (2009) The chemistry of [M-3(CO)(10)(mu-dppm)](M = Ru, Os): Activating and maintaining the trinuclear core. COORDIN CHEM REV , 253 (9-10) 1285 - 1315. 10.1016/j.ccr.2008.03.013.

Kafizas, A; Adriaens, D; Mills, A; Parkin, IP; (2009) Simple method for the rapid simultaneous screening of photocatalytic activity over multiple positions of self-cleaning films. PHYS CHEM CHEM PHYS , 11 (37) 8367 - 8375. 10.1039/b905222d.

Kafizas, A; Dunnill, CW; Hyett, G; Parkin, IP; (2009) Combinatorial CVD: New Oxynitride Photocatalysts. EUROCVD 17 / CVD 17 , 25 (8) 1239 - 1250. 10.1149/1.3207729.

Kafizas, A; Hyett, G; Parkin, IP; (2009) Combinatorial atmospheric pressure chemical vapour deposition (cAPCVD) of a mixed vanadium oxide and vanadium oxynitride thin film. J MATER CHEM , 19 (10) 1399 - 1408. 10.1039/b817429f.

Kafizas, A; Kellici, S; Darr, JA; Parkin, IP; (2009) Titanium dioxide and composite metal/metal oxide titania thin films on glass: A comparative study of photocatalytic activity. J PHOTOCH PHOTOBIO A , 204 (2-3) 183 - 190. 10.1016/j.jphotochem.2009.03.017.

Kang, J; Reynolds, NL; Tyrrell, C; Dorin, JR; Macmillan, D; (2009) Peptide thioester synthesis through N -> S acyl-transfer: application to the synthesis of a beta-defensin. ORG BIOMOL CHEM , 7 (23) 4918 - 4923. 10.1039/b913886b.

Kang, J; Richardson, JP; Macmillan, D; (2009) 3-Mercaptopropionic acid-mediated synthesis of peptide and protein thioesters. CHEM COMMUN (4) 407 - 409. 10.1039/b815888f.

Karamertzanis, PG; Kazantsev, AV; Issa, N; Welch, GWA; Adjiman, CS; Pantelides, CC; Price, SL; (2009) Can the Formation of Pharmaceutical Cocrystals Be Computationally Predicted? 2. Crystal Structure Prediction. J CHEM THEORY COMPUT , 5 (5) 1432 - 1448. 10.1021/ct8004326.

Kasunič, M; Legiša, J; Meden, A; Logar, NZ; Beale, AM; Golobič, A; (2009) Crystal structure of pure-silica ZSM-12 with tetraethylammonium cations from X-ray powder diffraction data. Microporous and Mesoporous Materials , 122 (1-3) 255 - 263. 10.1016/j.micromeso.2009.03.008.

Keating, PR; Scanlon, DO; Watson, GW; (2009) Intrinsic ferromagnetism in CeO(2): dispelling the myth of vacancy site localization mediated superexchange. J Phys Condens Matter , 21 (40) 405502 - ?. 10.1088/0953-8984/21/40/405502.

Kerridge, A; Coates, R; Kaltsoyannis, N; (2009) Is Cerocene Really a Ce(III) Compound? All-Electron Spin-Orbit Coupled CASPT2 Calculations on M(eta(8)-C8H8)(2) (M = Th, Pa, Ce). J PHYS CHEM A , 113 (12) 2896 - 2905. 10.1021/jp807804w.

Kerridge, A; Kaltsoyannis, N; (2009) Are the ground states of the later actinocenes multiconfigurational? All-electron spin-orbit coupled CASPT2 calculations on An(eta-8-C8H8)2 (An = Th, U, Pu, Cm). Journal of Physical Chemistry A , 113 8737 - 8745. 10.1021/jp903912q.

Kida, T; Fenner, L; Wills, AS; Terasaki, I; Hagiwara, M; (2009) Giant anomalous Hall resistivity of the room temperature ferromagnet Fe3Sn2 - a frustrated metal with the kagome-bilayer structure. J. Phys.: Condens. Matter , 23 112205 - ?. 10.1088/0953-8984/23/11/112205.

King, FD; Aliev, AE; Caddick, S; Copley, RCB; (2009) An investigation into the electrophilic cyclisation of N-acyl-pyrrolidinium ions: a facile synthesis of pyrrolo-tetrahydroisoquinolones and pyrrolo-benzazepinones. ORG BIOMOL CHEM , 7 (17) 3561 - 3571. 10.1039/b907400g.

King, FD; Aliev, AE; Caddick, S; Tocher, DA; Courtier-Murias, D; (2009) A facile synthesis of pyrrolo-(di)-benzazocinones via an intramolecular N-acyliminium ion cyclisation. ORG BIOMOL CHEM , 7 (1) 167 - 177. 10.1039/b815195d.

King, FD; Aliev, AE; Caddick, S; Tocher, DA; Courtier-Murias, D; (2009) A facile synthesis of pyrrolo-(di)-benzazocinones via an intramolecular N-acyliminium ion cyclisation (vol 7, pg 167, 2009). ORG BIOMOL CHEM , 7 (24) 5271 - 5271.

King, FD; Aliev, AE; Caddick, S; Tocher, DA; Courtier-Murias, D; (2009) Erratum: A facile synthesis of pyrrolo-(di)-benzazocinones via an intramolecular N-acyliminium ion cyclisation (Organic & Biomolecular Chemistry (2009) 7 (167-177) DOI: 10.1039/b815195d). Organic and Biomolecular Chemistry , 7 (24) 5271 - 5271. 10.1039/b922697b.

King, G; Wills, AS; Woodward, PM; (2009) Magnetic structures of NaLMnWO6 perovskites (L=La,Nd,Tb). PHYS REV B , 79 (22) , Article 224428. 10.1103/PhysRevB.79.224428.

Knight, ER; Cowley, AR; Hogarth, G; Wilton-Ely, JDET; (2009) Bifunctional dithiocarbamates: a bridge between coordination chemistry and nanoscale materials. DALTON T (4) 607 - 609. 10.1039/b814476a.

Knight, ER; Leung, NH; Lin, YH; Cowley, AR; Watkin, DJ; Thompson, AL; ... Wilton-Ely, JDET; + view all (2009) Multimetallic arrays: Symmetrical bi-, tri- and tetrametallic complexes based on the group 10 metals and the functionalisation of gold nanoparticles with nickel-phosphine surface units. DALTON T (19) 3688 - 3697. 10.1039/b821947h.

Knight, ER; Leung, NH; Thompson, AL; Hogarth, G; Wilton-Ely, JDET; (2009) Multimetallic Arrays: Bi-, Tri-, Tetra-, and Hexametallic Complexes Based on Gold(I) and Gold(III) and the Surface Functionalization of Gold Nanoparticles with Transition Metals. INORG CHEM , 48 (8) 3866 - 3874. 10.1021/ic802442d.

Kohl, P; Coveney, PV; Gavaghan, D; (2009) The virtual physiological human: tools and applications II INTRODUCTION. PHILOS T R SOC A , 367 (1896) 2121 - 2123. 10.1098/rsta.2009.0071.

Kolbeck, C; Cremer, T; Lovelock, KRJ; Paape, N; Schulz, PS; Wasserscheid, P; ... Steinruck, HP; + view all (2009) Influence of Different Anions on the Surface Composition of Ionic Liquids Studied Using ARXPS. J PHYS CHEM B , 113 (25) 8682 - 8688. 10.1021/jp902978r.

Kongmark, C; Martis, V; Rubbens, A; Pirovano, C; Lofberg, A; Sankar, G; ... Van Beek, W; + view all (2009) Elucidating the genesis of Bi2MoO6catalyst by combination of synchrotron radiation experiments and Raman scattering. Chemical Communications (32) 4850 - 4852.

Kongmark, C; Martis, V; Rubbens, A; Pirovano, C; Lofberg, A; Sankar, G; ... Van Beek, W; + view all (2009) Elucidating the genesis of Bi2MoO6 catalyst by combination of synchrotron radiation experiments and Raman scattering. CHEM COMMUN (32) 4850 - 4852. 10.1039/b907935a.

Kumar, MK; Tan, LK; Gosvami, NN; Gao, H; (2009) Conduction-atomic force microscopy study of H-2 sensing mechanism in Pd nanoparticles decorated TiO2 nanofilm. J APPL PHYS , 106 (4) , Article 044308. 10.1063/1.3202344.

Kumar, MK; Tan, LK; Gosvami, NN; Gao, H; (2009) Titania Nanofilm with Electrical Switching Effects upon Hydrogen/Air Exposure at Room Temperature. J PHYS CHEM C , 113 (16) 6381 - 6389. 10.1021/jp809183y.

Lee, CC; Fitzmaurice, RJ; Caddick, S; (2009) 3,5-Isoxazoles from alpha-bromo-pentafluorophenyl vinylsulfonates: Synthesis of sulfonates and sulfonamides. ORG BIOMOL CHEM , 7 (21) 4349 - 4351. 10.1039/b911098d.

Lee, Y; Lu, X; Hao, Y; Yang, S; Parini, CG; Evans, JRG; (2009) Cylindrical EBG antenna for short range gigabit wireless communications at millimetre-wave bands. ELECTRON LETT , 45 (3) 136 - 138. 10.1049/el:20093192.

Lee, Y; Lu, XS; Hao, Y; Yang, SF; Evans, JRG; Parini, CG; (2009) Low-Profile Directive Millimeter-Wave Antennas Using Free-Formed Three-Dimensional (3-D) Electromagnetic Bandgap Structures. IEEE T ANTENN PROPAG , 57 (10) 2893 - 2903. 10.1109/TAP.2009.2029299.

Lee, YJ; Hao, Y; Parini, CG; Lu, X; Yang, S; Evans, JRG; (2009) Cylindrical EBG antenna for short range gigabit wireless communications at millimetre-wave bands. Electronics Letters , 45 (3) 136 - 138. 10.1049/el:20093192.

Leung, C; Kinns, H; Hoogenboom, BW; Howorka, S; Mesquida, P; (2009) Imaging Surface Charges of Individual Biomolecules. NANO LETT , 9 (7) 2769 - 2773. 10.1021/nl9012979.

Lewis, DW; Ruiz-Salvador, AR; Gomez, A; Rodriguez-Albelo, LM; Coudert, FX; Slater, B; ... Mellot-Draznieks, C; + view all (2009) Zeolitic imidazole frameworks: structural and energetics trends compared with their zeolite analogues. CRYSTENGCOMM , 11 (11) 2272 - 2276. 10.1039/b912997a.

Ley, SV; Tackett, MN; Maddess, ML; Anderson, JC; Brennan, PE; Cappi, MW; ... Willis, MC; + view all (2009) Total Synthesis of Rapamycin. CHEM-EUR J , 15 (12) 2874 - 2914. 10.1002/chem.200801656.

Li, SF; Shao, ZL; Han, SL; Xue, XL; Wang, F; Sun, Q; ... Guo, ZX; + view all (2009) Role of Ag-doping in small transition metal clusters from first-principles simulations. J CHEM PHYS , 131 (18) , Article 184301. 10.1063/1.3261728.

Li, YH; Walsh, A; Chen, SY; Yin, WJ; Yang, JH; Li, JB; ... Wei, SH; + view all (2009) Revised ab initio natural band offsets of all group IV, II-VI, and III-V semiconductors. APPL PHYS LETT , 94 (21) , Article 212109. 10.1063/1.3143626.

Lin, YH; Leung, NH; Holt, KB; Thompson, AL; Wilton-Ely, JDET; (2009) Bimetallic complexes based on carboxylate and xanthate ligands: Synthesis and electrochemical investigations. DALTON T (38) 7891 - 7901. 10.1039/b901822k.

Liu, F; de Leeuw, NH; Zhang, Z; (2009) A Computer Simulation Study of the Effects of Anions on Nickel Carbonate Crystallization Process. CHINESE J INORG CHEM , 25 (10) 1823 - 1828.

Lockyear, JF; Parkes, MA; Price, SD; (2009) Single-electron transfer between Ar2+(P-3, D-1) and He at low collision energies. J PHYS B-AT MOL OPT , 42 (14) , Article 145201. 10.1088/0953-4075/42/14/145201.

Logsdail, A; Paz-Borbón, LO; Johnston, RL; (2009) Structures and stabilities of platinum-gold nanoclusters. Journal of Computational and Theoretical Nanoscience , 6 (4) 857 - 866. 10.1166/jctn.2009.1118.

Loizidou, EZ; Kousiappa, I; Zeinalipour-Yazdi, CD; Van de Vijver, DA; Kostrikis, LG; (2009) Implications of HIV-1 M group polymorphisms on integrase inhibitor efficacy and resistance: genetic and structural in silico analyses. Biochemistry , 48 (1) 4 - 6. 10.1021/bi8019349.

Loizidou, EZ; Zeinalipour-Yazdi, CD; Christofides, T; Kostrikis, LG; (2009) Analysis of binding parameters of HIV-1 integrase inhibitors: correlates of drug inhibition and resistance. Bioorg Med Chem , 17 (13) 4806 - 4818. 10.1016/j.bmc.2009.04.058.

LoPresti, C; Lomas, H; Massignani, M; Smart, T; Battaglia, G; (2009) Polymersomes: nature inspired nanometer sized compartments. JOURNAL OF MATERIALS CHEMISTRY , 19 (22) 3576 - 3590. 10.1039/b818869f.

Lovelock, KRJ; Deyko, A; Corfield, JA; Gooden, PN; Licence, P; Jones, RG; (2009) Vaporisation of a Dicationic Ionic Liquid. CHEMPHYSCHEM , 10 (2) 337 - 340. 10.1002/cphc.200800690.

Lovelock, KRJ; Kolbeck, C; Cremer, T; Paape, N; Schulz, PS; Wasserscheid, P; ... Steinruck, HP; + view all (2009) Influence of Different Substituents on the Surface Composition of Ionic Liquids Studied Using ARXPS. J PHYS CHEM B , 113 (9) 2854 - 2864. 10.1021/jp810637d.

Lu, X; He, XB; Zhang, B; Qu, XH; Zhang, L; Guo, ZX; Tian, JJ; (2009) High-temperature oxidation behavior of TiAl-based alloys fabricated by spark plasma sintering. J ALLOY COMPD , 478 (1-2) 220 - 225. 10.1016/j.jallcom.2008.11.134.

Lu, X; He, XB; Zhang, B; Zhang, L; Qu, XH; Guo, ZX; (2009) Microstructure and mechanical properties of a spark plasma sintered Ti-45Al-8.5Nb-0.2W-0.2B-0.1Y alloy. INTERMETALLICS , 17 (10) 840 - 846. 10.1016/j.intermet.2009.03.013.

Lu, XS; Lee, Y; Yang, SF; Evans, JRG; Parini, CG; (2009) Fabrication and evaluation of solid freeformed electromagnetic bandgap structures. Journal of Physics D: Applied Physics , 42 (14) 145107 - ?. 10.1088/0022-3727/42/14/145107.

Lu, XS; Lee, Y; Yang, SF; Hao, Y; Evans, JRG; Parini, CG; (2009) Fabrication and evaluation of solid freeformed electromagnetic bandgap structures. J PHYS D APPL PHYS , 42 (14) , Article 145107. 10.1088/0022-3727/42/14/145107.

Lu, XS; Lee, Y; Yang, SF; Hao, Y; Evans, JRG; Parini, CG; (2009) Fine lattice structures fabricated by extrusion freeforming: Process variables. J MATER PROCESS TECH , 209 (10) 4654 - 4661. 10.1016/j.jmatprotec.2008.11.039.

Lu, XS; Lee, Y; Yang, SF; Hao, Y; Ubic, R; Evans, JRG; Parini, CG; (2009) Fabrication of Millimeter-Wave Electromagnetic Bandgap Crystals Using Microwave Dielectric Powders. J AM CERAM SOC , 92 (2) 371 - 378. 10.1111/j.1551-2916.2008.02907.x.

Lu, XS; Yang, SF; Evans, JRG; (2009) Microfeeding with different ultrasonic nozzle designs. ULTRASONICS , 49 (6-7) 514 - 521. 10.1016/j.ultras.2009.01.003.

Lupina, G; Lukosius, M; Wenger, C; Dudek, P; Kozlowski, G; Müssig, H-J; ... Kubilius, V; + view all (2009) Deposition of BaHfO dielectric layers for microelectronic applications by pulsed Liquid Injection MOCVD. Chemical Vapor Deposition , 15 (7-9) 167 - 170. 10.1002/cvde.200804272.

Luthra, V; Pratt, KFE; Parkin, IP; Williams, DE; Tandon, RP; (2009) Fabrication and characterization of Fe1.90Ti0.10O3 gas sensitive resistors for carbon monoxide. SENSOR ACTUAT B-CHEM , 135 (2) 430 - 435. 10.1016/j.snb.2008.09.023.

Macgregor, MJ; Hogarth, G; Thompson, AL; Wilton-Ely, JDET; (2009) Multimetallic Arrays: Symmetrical and Unsymmetrical Bi-, Tri-, and Tetrametallic Organometallic Complexes of Ruthenium(II) and Osmium(II). ORGANOMETALLICS , 28 (1) 197 - 208. 10.1021/om800686f.

Machon, D; Toulemonde, P; McMillan, PF; Amboage, M; Munoz, A; Rodriguez-Hernandez, P; San Miguel, A; (2009) High-pressure phase transformations, pressure-induced amorphization, and polyamorphic transition of the clathrate Rb6.15Si46. PHYSICAL REVIEW B , 79 (18) , Article ARTN 184101. 10.1103/PhysRevB.79.184101.

MacHon, D; Toulemonde, P; San Miguel, A; McMillan, PF; Amboage, M; Muñoz, A; Rodríguez-Hernández, P; (2009) High-pressure phase transformations, pressure-induced amorphization, and polyamorphic transition of the clathrate Rb6.15 Si46. Physical Review B - Condensed Matter and Materials Physics , 79 (18) 10.1103/PhysRevB.79.184101.

Macmillan, D; (2009) 2,3,4-Trimethoxy-6-[[(4-methoxyphenyl)-methyl]thio]benzaldehyde. Encyclopedia of Reagents for Organic Synthesis 10.1002/047084289X.rn00970..

Marino, KA; Carter, EA; (2009) The effect of platinum on diffusion kinetics in beta-NiAl: implications for thermal barrier coating lifetimes. Chemphyschem , 10 (1) 226 - 235. 10.1002/cphc.200800528.

MARSON, C; (2009) Mode of Action of Histone Deacetylase Inhibitors on Mast Cell Histamine Release and Colon Muscle Contraction. Inflammation Research , 58 S24 - S25.

Marson, CM; (2009) Histone Deacetylase Inhibitors: Design, Structure-Activity Relationships and Therapeutic Implications for Cancer. ANTI-CANCER AGENT ME , 9 (6) 661 - 692.

Martin, HSC; Jha, S; Howorka, S; Coveney, PV; (2009) Determination of Free Energy Profiles for the Translocation of Polynucleotides through alpha-Hemolysin Nanopores using Non-Equilibrium Molecular Dynamics Simulations. J CHEM THEORY COMPUT , 5 (8) 2135 - 2148. 10.1021/ct9000894.

Masetti, M; Cavalli, A; Recanatini, M; Gervasio, FL; (2009) Exploring complex protein-ligand recognition mechanisms with coarse metadynamics. J Phys Chem B , 113 (14) 4807 - 4816. 10.1021/jp803936q.

Massignani, M; LoPresti, C; Blanazs, A; Madsen, J; Armes, SP; Lewis, AL; Battaglia, G; (2009) Controlling cellular uptake by surface chemistry, size, and surface topology at the nanoscale. Small , 5 (21) 2424 - 2432. 10.1002/smll.200900578.

McMillan, PF; (2009) High pressure effects on liquid viscosity and glass transition behaviour, polyamorphic phase transitions and structural properties of glasses and liquids. J Non-Crystalline Solids , 355 722 - 732.

McMillan, PF; Diefenbacher, JR; Petuskey, WT; Goettler, RW; (2009) Water-soluble amorphous alumina-based ceramic precursors and alumosols: Structural and chemical characterization. Journal of Non-Crystalline Solids , 355 (28-30) 1539 - 1551. 10.1016/j.jnoncrysol.2008.11.044.

McMillan, PF; Lees, V; Quirico, E; Montagnac, G; Sella, A; Reynard, B; ... Cora, F; + view all (2009) Graphitic carbon nitride C6N9H3 center dot HCl: Characterisation by UV and near-IR FT Raman spectroscopy. J SOLID STATE CHEM , 182 (10) 2670 - 2677. 10.1016/j.jssc.2009.07.030.

Meersman, F; Cabrera, RQ; McMillan, PF; Dmitriev, V; (2009) Compressibility of insulin amyloid fibrils determined by X-ray diffraction in a diamond anvil cell. HIGH PRESSURE RESEARCH , 29 (4) , Article PII 917825715. 10.1080/08957950903350975.

Mettler, S; Wolthers, M; Charlet, L; Gunten, UV; (2009) Sorption and catalytic oxidation of Fe(II) at the surface of calcite. Geochimica et Cosmochimica Acta , 73 (7) 1826 - 1840. 10.1016/j.gca.2009.01.003. Green open access
file

Middelkoop, V; Boldrin, P; Peel, M; Buslaps, T; Barnes, P; Darr, JA; Jacques, SDM; (2009) Imaging the inside of a Continuous Nanoceramic Synthesizer under Supercritical Water Conditions Using High-Energy Synchrotron X-Radiation. CHEM MATER , 21 (12) 2430 - 2435. 10.1021/cm900118z.

Mishra, AK; Tandon, P; (2009) A Comparative Ab Initio and DFT Study of Polyaniline Leucoemeraldine Base and Its Oligomers. JOURNAL OF PHYSICAL CHEMISTRY B , 113 (44) 14629 - 14639. 10.1021/jp906799m.

Mishra, AK; Tandon, P; (2009) DFT Study and Heat Capacity of Polyaniline Pernigraniline Base. JOURNAL OF PHYSICAL CHEMISTRY B , 113 (29) 9702 - 9707. 10.1021/jp901143m.

Mitchell, N; Schlapak, R; Kastner, M; Armitage, D; Chrzanowski, W; Riener, J; ... Howorka, S; + view all (2009) A DNA Nanostructure for the Functional Assembly of Chemical Groups with Tunable Stoichiometry and Defined Nanoscale Geometry. ANGEW CHEM INT EDIT , 48 (3) 525 - 527. 10.1002/anie.200804264.

Mohamed, S; Tocher, DA; Vickers, M; Karamertzanis, PG; Price, SL; (2009) Salt or Cocrystal? A New Series of Crystal Structures Formed from Simple Pyridines and Carboxylic Acids. CRYST GROWTH DES , 9 (6) 2881 - 2889. 10.1021/cg9001994.

Moore, R; Battaglia, G; (2009) Innovative medical devices and nanotechnology: 1-Day interactive workshop. Nanomedicine , 4 (7) 709 - 712. 10.2217/nnm.09.63.

Morgan, BJ; Scanlon, DO; Watson, GW; (2009) Small polarons in Nb- and Ta-doped rutile and anatase TiO2. Journal of Materials Chemistry , 19 (29) 5175 - 5178.

Moshaverinia, A; Roohpour, N; Ansari, S; Moshaverinia, M; Schricker, S; Darr, JA; Rehman, IU; (2009) Effects of N-vinylpyrrolidone (NVP) containing polyelectrolytes on surface properties of conventional glass-ionomer cements (GIC). DENT MATER , 25 (10) 1240 - 1247. 10.1016/j.dental.2009.05.006.

Moshaverinia, A; Roohpour, N; Darr, JA; Rehman, IU; (2009) Synthesis and characterization of a novel N-vinylcaprolactam-containing acrylic acid terpolymer for applications in glass-ionomer dental cements. ACTA BIOMATER , 5 (6) 2101 - 2108. 10.1016/j.actbio.2009.02.015.

Moshaverinia, A; Roohpour, N; Darr, JA; Rehman, IU; (2009) Synthesis of a proline-modified acrylic acid copolymer in supercritical CO2 for glass-ionomer dental cement applications. ACTA BIOMATER , 5 (5) 1656 - 1662. 10.1016/j.actbio.2009.01.037.

Mustapa, MFM; Grosse, SM; Kudsiova, L; Elbs, M; Raiber, EA; Wong, JB; ... Tabor, AB; + view all (2009) Stabilized Integrin-Targeting Ternary LPD (Lipopolyplex) Vectors for Gene Delivery Designed To Disassemble Within the Target Cell. BIOCONJUGATE CHEM , 20 (3) 518 - 532. 10.1021/bc800450r.

Narband, N; Uppal, M; Dunnill, CW; Hyett, G; Wilson, M; Parkin, IP; (2009) The interaction between gold nanoparticles and cationic and anionic dyes: enhanced UV-visible absorption. PHYS CHEM CHEM PHYS , 11 (44) 10513 - 10518. 10.1039/b909714g.

Noimark, S; Dunnill, CW; Wilson, M; Parkin, IP; (2009) The role of surfaces in catheter-associated infections. CHEM SOC REV , 38 (12) 3435 - 3448. 10.1039/b908260c.

O'Brien, MG; Beale, AM; Jacques, SDM; Buslaps, T; Honkimaki, V; Weckhuysen, BM; (2009) On the Active Oxygen in Bulk MoO3 during the Anaerobic Dehydrogenation of Methanol. JOURNAL OF PHYSICAL CHEMISTRY C , 113 (12) 4890 - 4897. 10.1021/jp810428e.

O'Brien, MG; Beale, AM; Jacques, SDM; Di Michiel, M; Weckhuysen, BM; (2009) Spatiotemporal Multitechnique Imaging of a Catalytic Solid in Action: Phase Variation and Volatilization During Molybdenum Oxide Reduction. CHEMCATCHEM , 1 (1) 99 - 102. 10.1002/cctc.200900042.

O'Brien, MG; Beale, AM; Jacques, SDM; Weckhuysen, BM; (2009) A Combined Multi-Technique In Situ Approach Used to Probe the Stability of Iron Molybdate Catalysts During Redox Cycling. TOPICS IN CATALYSIS , 52 (10) 1400 - 1409. 10.1007/s11244-009-9324-z.

O'Brien, MG; Beale, AM; Kuipers, BWM; Erne, BH; Lewis, DW; Catlow, CRA; (2009) Role of Germanium on the Nucleation and Growth of Zeolite A from Clear Solutions As Studied by in Situ Small-Angle X-ray Scattering, Wide-Angle X-ray Scattering, and Dynamic Light Scattering. J PHYS CHEM C , 113 (43) 18614 - 18622. 10.1021/jp907542a.

Page, K; Parkin, IP; Wilson, M; (2009) Antimicrobial surfaces and their potential in reducing the role of the inanimate environment in the incidence of hospital-acquired infections. Journal of Materials Chemistry , 19 (23) 3818 - 3831. 10.1039/b818698g.

Page, K; Wilson, M; Parkin, IP; (2009) Antimicrobial surfaces and their potential in reducing the role of the inanimate environment in the incidence of hospital-acquired infections. J MATER CHEM , 19 (23) 3819 - 3831. 10.1039/b818698g.

Palgrave, RG; Bourlange, A; Payne, DJ; Foord, JS; Egdell, RG; (2009) Interfacial Diffusion during Growth of SnO(2)(110) on TiO(2)(110) by Oxygen Plasma Assisted Molecular Beam Epitaxy. Crystal Growth & Design , 9 1793 - 1797. 10.1021/cg8009404.

Palgrave, RG; Payne, DJ; Egdell, RG; (2009) Nitrogen diffusion in doped TiO(2) (110) single crystals: a combined XPS and SIMS study. Journal of Materials Chemistry , 19 8418 - 8425. 10.1039/b913267h.

Pang, CL; Thornton, G; (2009) Manipulation of oxide surfaces. SURF SCI , 603 (22) 3255 - 3261. 10.1016/j.susc.2009.09.027.

Papapostolou, D; Howorka, S; (2009) Engineering and exploiting protein assemblies in synthetic biology. MOL BIOSYST , 5 (7) 723 - 732. 10.1039/b902440a.

Parker, DSN; Minns, RS; Penfold, TJ; Worth, GA; Fielding, HH; (2009) Ultrafast dynamics of the S-1 excited state of benzene. CHEM PHYS LETT , 469 (1-3) 43 - 47. 10.1016/j.cplett.2008.12.069.

Parker, DSN; Nunn, ADG; Minns, RS; Fielding, HH; (2009) Frequency doubling and Fourier domain shaping the output of a femtosecond optical parametric amplifier: easy access to tuneable femtosecond pulse shapes in the deep ultraviolet. APPL PHYS B-LASERS O , 94 (2) 181 - 186. 10.1007/s00340-008-3318-6.

Parkes, MA; Lockyear, JF; Price, SD; (2009) Electron-transfer and chemical reactivity following collisions of Ar2+ with C2H2. INT J MASS SPECTROM , 280 (1-3) 85 - 92. 10.1016/j.ijms.2008.07.027.

Perkin, S; Goldberg, R; Chai, L; Kampf, N; Klein, J; (2009) Dynamic properties of confined hydration layers. FARADAY DISCUSS , 141 399 - 413. 10.1039/b805244a.

Perni, S; Beumer, RR; Zwietering, MH; (2009) Multi-Tools Approach for Food Safety Risk Management of Steam Meals. J FOOD PROTECT , 72 (12) 2638 - 2645.

Perni, S; Piccirillo, C; Pratten, J; Prokopovich, P; Chrzanowski, W; Parkin, IP; Wilson, M; (2009) The antimicrobial properties of light-activated polymers containing methylene blue and gold nanoparticles. BIOMATERIALS , 30 (1) 89 - 93. 10.1016/j.biomaterials.2008.09.020.

Perni, S; Prokopovich, P; Piccirillo, C; Pratten, J; Parkin, IP; Wilson, M; (2009) Toluidine blue-containing polymers exhibit potent bactericidal activity when irradiated with red laser light. J MATER CHEM , 19 (18) 2715 - 2723. 10.1039/b820561b.

Pesce, G; Volpe, G; Chiara De Luca, A; Rusciano, G; Volpe, G; (2009) Quantitative assessment of non-conservative radiation forces in an optical trap. EPL , 86 (3) , Article ARTN 38002. 10.1209/0295-5075/86/38002.

Petrenko, OA; Balakrishnan, G; Paul, DMK; Yethiraj, M; McIntyre, GJ; Wills, AS; (2009) Field induced magnetic order in the frustrated magnet Gadolinium Gallium Garnet. HIGHLY FRUSTRATED MAGNETISM 2008 (HFM 2008) , 145 , Article 012026. 10.1088/1742-6596/145/1/012026. Gold open access

Piccirillo, C; Perni, S; Gil-Thomas, J; Prokopovich, P; Wilson, M; Pratten, J; Parkin, IP; (2009) Antimicrobial activity of methylene blue and toluidine blue O covalently bound to a modified silicone polymer surface. J MATER CHEM , 19 (34) 6167 - 6171. 10.1039/b905495b.

Plet, JRH; Sandhu, AK; Sehailia, M; Porter, MJ; (2009) Thieme Chemistry Journal Awardees - Where Are They Now? Approaches to Tagetitoxin and its Decarboxy Analogue from D-Glucose. SYNLETT (20) 3258 - 3262. 10.1055/s-0029-1218525.

Pollheimer, PD; Kastner, M; Ebner, A; Blaas, D; Hinterdorfer, P; Gruber, HJ; Howorka, S; (2009) Receptor Arrays for the Selective and Efficient Capturing of Viral Particles. BIOCONJUGATE CHEM , 20 (3) 466 - 475. 10.1021/bc800357j.

Poole, A; Brown, PJ; Wills, AS; (2009) Spherical neutron polarimetry (SNP) study of magneto-electric coupling in the multiferroic MnWO4. HIGHLY FRUSTRATED MAGNETISM 2008 (HFM 2008) , 145 , Article 012074. 10.1088/1742-6596/145/1/012074. Gold open access

Poole, A; Lelievre-Berna, E; Wills, AS; (2009) General refinement strategy for magnetic structures using spherical neutron polarimetry and representation analysis. PHYSICA B-CONDENSED MATTER , 404 (17) 2535 - 2538. 10.1016/j.physb.2009.06.015.

Portegies Zwart, S; Harfst, S; Groen, D; Nualláin, BO; Angelou, V; Gaburov, E; ... Zemp, M; + view all (2009) A multiphysics and multiscale software environment for modeling astrophysical systems. New Astronomy , 14 (4) 369 - 378. 10.1016/j.newast.2008.10.006.

Potts, SE; Carmalt, CJ; Blackman, CS; Abou-Chahine, F; Pugh, D; Davies, HO; (2009) Synthesis of Zirconium Guanidinate Complexes and the Formation of Zirconium Carbonitride via Low Pressure CVD. ORGANOMETALLICS , 28 (6) 1838 - 1844. 10.1021/om801053y.

Powner, MW; Gerland, B; Sutherland, JD; (2009) Synthesis of activated pyrimidine ribonucleotides in prebiotically plausible conditions. Nature , 459 (7244) 239 - 242. 10.1038/nature08013.

Price, SL; (2009) Computed Crystal Energy Landscapes for Understanding and Predicting Organic Crystal Structures and Polymorphism. ACCOUNTS CHEM RES , 42 (1) 117 - 126. 10.1021/ar800147t.

Prokopovich, P; Perni, S; (2009) An investigation of microbial adhesion to natural and synthetic polysaccharide-based films and its relationship with the surface energy components. J MATER SCI-MATER M , 20 (1) 195 - 202. 10.1007/s10856-008-3555-6.

Qazi, SJS; Rennie, AR; Cockcroft, JK; Vickers, M; (2009) Use of wide-angle X-ray diffraction to measure shape and size of dispersed colloidal particles. J COLLOID INTERF SCI , 338 (1) 105 - 110. 10.1016/j.jcis.2009.06.006.

Qureshi, U; Dunnill, CW; Parkin, IP; (2009) Nanoparticulate cerium dioxide and cerium dioxide-titanium dioxide composite thin films on glass by aerosol assisted chemical vapour deposition. APPL SURF SCI , 256 (3) 852 - 856. 10.1016/j.apsusc.2009.08.074.

Raha, AK; Ghosh, S; Kabir, SE; Nicholson, BK; Tocher, DA; (2009) Cleavage of Ge-S and C-H bonds in the reaction of electron-deficient [Os-3(CO)(8)(mu-H)(mu(3)-Ph2PCH2P(Ph)C6H4)] with Ph3GeSPh: Generation of thiophenol derivatives [Os-3(CO)(8)(mu-H)(mu-SPh)(mu-dppm)] and [Os-3(CO)(7)(mu-H)(mu-SPh)(mu(3)-SC6H4)(mu-dppm)]. J ORGANOMET CHEM , 694 (5) 752 - 756. 10.1016/j.jorganchem.2008.12.005.

Remmert, SM; Banks, ST; Clary, DC; (2009) Reduced Dimensionality Quantum Dynamics of CH3 + CH4 -> CH4 + CH3: Symmetric Hydrogen Exchange on an Ab Initio Potential. J PHYS CHEM A , 113 (16) 4255 - 4264. 10.1021/jp810803k.

Remmert, SM; Banks, ST; Clary, DC; (2009) Reduced dimensionality quantum dynamics of the polyatomic reaction CH3 + CH4 -> CH4 + CH3 on an ab initio surface. ABSTR PAP AM CHEM S , 238 ? - ?.

Revesz, A; Sztaray, B; Schroder, D; Franzreb, K; Fiser, J; Price, SD; Roithova, J; (2009) The diatomic dication PO2+. PHYS CHEM CHEM PHYS , 11 (29) 6192 - 6198. 10.1039/b902843a.

Rodriguez-Albelo, LM; Ruiz-Salvador, AR; Sampieri, A; Lewis, DW; Gomez, A; Nohra, B; ... Dolbecq, A; + view all (2009) Zeolitic Polyoxometalate-Based Metal-Organic Frameworks (Z-POMOFs): Computational Evaluation of Hypothetical Polymorphs and the Successful Targeted Synthesis of the Redox-Active Z-POMOF1. J AM CHEM SOC , 131 (44) 16078 - 16087. 10.1021/ja905009e.

Roldan, A; Gonzalez, S; Ricart, JM; Illas, F; (2009) Critical Size for O-2 Dissociation by Au Nanoparticles. CHEMPHYSCHEM , 10 (2) 348 - 351. 10.1002/cphc.200800702.

Roldan, A; Manel Ricart, J; Illas, F; (2009) Influence of the exchange-correlation potential on the description of the molecular mechanism of oxygen dissociation by Au nanoparticles. THEORETICAL CHEMISTRY ACCOUNTS , 123 (1-2) 119 - 126. 10.1007/s00214-009-0540-1.

Roldan, A; Ricart, JM; Illas, F; (2009) Growth and properties of Au nanowires. MOLECULAR SIMULATION , 35 (12-13) , Article PII 911796232. 10.1080/08927020902902775.

Roldan, A; Torres, D; Ricart, JM; Illas, F; (2009) On the effectiveness of partial oxidation of propylene by gold: A density functional theory study. JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL , 306 (1-2) 6 - 10. 10.1016/j.molcata.2009.02.013.

Ruan, JF; Wu, P; Slater, B; Zhao, ZL; Wu, LL; Terasaki, O; (2009) Structural Characterization of Interlayer Expanded Zeolite Prepared From Ferrierite Lamellar Precursor. CHEM MATER , 21 (13) 2904 - 2911. 10.1021/cm900645c.

Saadoune, I; de Leeuw, NH; (2009) A computer simulation study of the accommodation and diffusion of He in uranium- and plutonium-doped zircon (ZrSiO4). GEOCHIM COSMOCHIM AC , 73 (13) 3880 - 3893. 10.1016/j.gca.2009.03.019.

Saadoune, I; Purton, JA; de Leeuw, NH; (2009) He incorporation and diffusion pathways in pure and defective zircon ZrSiO4: A density functional theory study. CHEM GEOL , 258 (3-4) 182 - 196. 10.1016/j.chemgeo.2008.10.015.

Saeli, M; Binions, R; Piccirillo, C; Hyett, G; Parkin, IP; (2009) Templated growth of smart nanocomposite thin films: Hybrid aerosol assisted and atmospheric pressure chemical vapour deposition of vanadyl acetylacetonate, auric acid and tetraoctyl ammonium bromide. POLYHEDRON , 28 (11) 2233 - 2239. 10.1016/j.poly.2009.03.025.

Saeli, M; Binions, R; Piccirillo, C; Parkin, IP; (2009) Templated growth of smart coatings: Hybrid chemical vapour deposition of vanadyl acetylacetonate with tetraoctyl ammonium bromide. APPL SURF SCI , 255 (16) 7291 - 7295. 10.1016/j.apsusc.2009.03.083.

Saksena, RS; Coveney, PV; (2009) Rheological response and dynamics of the amphiphilic diamond phase from kinetic lattice-Boltzmann simulations. P ROY SOC A-MATH PHY , 465 (2106) 1977 - 2002. 10.1098/rspa.2008.0479.

Saksena, RS; Coveney, PV; (2009) Shear rheology of amphiphilic cubic liquid crystals from large-scale kinetic lattice-Boltzmann simulations. SOFT MATTER , 5 (22) 4446 - 4463. 10.1039/b911884e.

Salamat, A; Woodhead, K; McMillan, PF; Cabrera, RQ; Rahman, A; Adriaens, D; ... Perrillat, JP; + view all (2009) Tetrahedrally bonded dense C2N3H with a defective wurtzite structure: X-ray diffraction and Raman scattering results at high pressure and ambient conditions. PHYS REV B , 80 (10) , Article 104106. 10.1103/PhysRevB.80.104106.

Saliu, KO; Maunder, GH; Ferguson, MJ; Sella, A; Takats, J; (2009) Synthesis and structure of heteroleptic ytterbium (II) tetrahydroborate complexes. INORG CHIM ACTA , 362 (12) 4616 - 4622. 10.1016/j.ica.2009.03.044.

Salzmann, CG; Radaelli, PG; Mayer, E; Finney, JL; (2009) Ice XV: A New Thermodynamically Stable Phase of Ice. PHYS REV LETT , 103 (10) , Article 105701. 10.1103/PhysRevLett.103.105701. Green and gold open access
file

Sassmannshausen, J; (2009) Cationic and dicationic zirconocene compounds as initiators of carbocationic isobutene polymerisation. DALTON T (41) 9026 - 9032. 10.1039/b908611k.

Sassmannshausen, J; (2009) DFT investigation of the 'quasi-living' propene polymerisation with Cp*TiMe3/B(C6F5)(3): the 'naked cation' approach. DALTON T (41) 8993 - 8999. 10.1039/b910339b.

Sassmannshausen, J; Baumgartner, J; (2009) Synthesis and Reactivity of Trimethylsilyl Substituted Mono(cyclopentadienyl)titanium Alkyl Complexes. KINET CATAL+ , 50 (5) 676 - 683. 10.1134/S0023158409050097.

Scanlon, DO; Morgan, BJ; Watson, GW; (2009) Modeling the polaronic nature of p-type defects in Cu2O: the failure of GGA and GGA + U. J Chem Phys , 131 (12) 124703 - ?. 10.1063/1.3231869.

Scanlon, DO; Morgan, BJ; Watson, GW; Walsh, A; (2009) Acceptor Levels in p-Type Cu2O: Rationalizing Theory and Experiment. PHYS REV LETT , 103 (9) , Article 096405. 10.1103/PhysRevLett.103.096405.

Scanlon, DO; Walsh, A; Morgan, BJ; Watson, GW; Payne, DJ; Egdell, RG; (2009) Effect of Cr substitution on the electronic structure of CuAl1-xCrxO2. PHYS REV B , 79 (3) , Article 035101. 10.1103/PhysRevB.79.035101.

Scanlon, DO; Walsh, A; Watson, GW; (2009) Understanding the p-Type Conduction Properties of the Transparent Conducting Oxide CuBO2: A Density Functional Theory Analysis. CHEM MATER , 21 (19) 4568 - 4576. 10.1021/cm9015113.

Scanlon, DO; Watson, GW; (2009) (Cu2S2)(Sr3Sc2O5)-A layered, direct band gap, p-type transparent conducting oxychalcogenide: A theoretical analysis. Chemistry of Materials , 21 (22) 5435 - 5442.

Schlapak, R; Armitage, D; Saucedo-Zeni, N; Chrzanowski, W; Hohage, M; Caruana, D; Howorka, S; (2009) Selective protein and DNA adsorption on PLL-PEG films modulated by ionic strength. SOFT MATTER , 5 (3) 613 - 621. 10.1039/b815065f.

Schlapak, R; Caruana, D; Armitage, D; Howorka, S; (2009) Semipermeable poly(ethylene glycol) films: the relationship between permeability and molecular structure of polymer chains. SOFT MATTER , 5 (21) 4104 - 4112. 10.1039/b913836f.

Schwingenschlogl, U; Gomez, JA; Grau-Crespo, R; (2009) Electronic structure and magnetic ordering of the unconventional antiferromagnet Yb3Pt4. EPL-EUROPHYS LETT , 88 (6) , Article 67001. 10.1209/0295-5075/88/67001.

Sella, A; (2009) 'Perkins' triangle. CHEM WORLD-UK , 6 (1) 69 - 69.

Sella, A; (2009) Abderhalden's drying pistol. CHEM WORLD-UK , 6 (2) 69 - 69.

Sella, A; (2009) Abderhalden’s Pistol. CHEM WORLD-UK , 6 (2) 69 - 69.

Sella, A; (2009) Buchner's funnel. CHEM WORLD-UK , 6 (11) 72 - 72.

Sella, A; (2009) Carius tube. CHEM WORLD-UK , 6 (4) 66 - 66.

Sella, A; (2009) Gadolin's condenser. CHEM WORLD-UK , 6 (10) 81 - 81.

Sella, A; (2009) Gaede's diffusion pump. CHEM WORLD-UK , 6 (5) 72 - 72.

Sella, A; (2009) Hirsch's funnel. CHEM WORLD-UK , 6 (3) 66 - 66.

Sella, A; (2009) Keck clip. CHEM WORLD-UK , 6 (12) 78 - 78.

Sella, A; (2009) Keck's Clip. CHEM WORLD-UK , 6 (12) 78 - 78.

Sella, A; (2009) Liebig's Kaliapparat. CHEM WORLD-UK , 6 (9) 69 - 69.

Sella, A; (2009) Mary's bath. CHEM WORLD-UK , 6 (7) 71 - 71.

Sella, A; (2009) Ostwald’s Viscometer. CHEM WORLD-UK , 6 (6) 70 - 70.

Sella, A; (2009) Perkin’s(?) Triangle. CHEM WORLD-UK , 6 (1) 69 - 69.

Sella, A; (2009) Thiele tube. CHEM WORLD-UK , 6 (8) 72 - 72.

Sella, A; (2009) Thiele’s Tube. CHEM WORLD-UK , 6 (8) 72 - 72.

Sheppard, TD; (2009) Metal-catalysed Halogen Exchange Reactions of Aryl Halides. Organic and Biomolecular Chemistry , 7 1043 - 1052. 10.1039/B818155A. Green open access
file

Shevlin, SA; Guo, ZX; (2009) Density functional theory simulations of complex hydride and carbon-based hydrogen storage materials. CHEM SOC REV , 38 (1) 211 - 225. 10.1039/b815553b.

Shishkovskiy, IV; Morozov, YG; Kuznetsov, MV; Parkin, IP; (2009) Electromotive force measurements in the combustion wave front during layer-by-layer surface laser sintering of exothermic powder compositions. PHYS CHEM CHEM PHYS , 11 (18) 3503 - 3508. 10.1039/b819810a.

Smart, TP; Battaglia, G; (2009) Controlling the formation of nanostructured vesicular gels for multiencapsulation and cell delivery. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY , 237

Smart, TP; Mykhaylyk, OO; Ryan, AJ; Battaglia, G; (2009) Polymersomes hydrophilic brush scaling relations. SOFT MATTER , 5 (19) 3607 - 3610. 10.1039/b908731a.

Smithies, K; Smith, MEB; Kaulmann, U; Galman, JL; Ward, JM; Hailes, HC; (2009) Stereoselectivity of an omega-transaminase-mediated amination of 1,3-dihydroxy-1-phenylpropane-2-one. TETRAHEDRON-ASYMMETR , 20 (5) 570 - 574. 10.1016/j.tetasy.2009.03.012.

Suter, JL; Anderson, RL; Greenwell, HC; Coveney, PV; (2009) Recent advances in large-scale atomistic and coarse-grained molecular dynamics simulation of clay minerals. J MATER CHEM , 19 (17) 2482 - 2493. 10.1039/b820445d.

Suter, JL; Coveney, PV; (2009) Computer simulation study of the materials properties of intercalated and exfoliated poly(ethylene)glycol clay nanocomposites. SOFT MATTER , 5 (11) 2239 - 2251. 10.1039/b822666k.

Suter, JL; Coveney, PV; (2009) Materials properties of clay nanocomposites: onset of negative Poisson ratio in large-scale molecular dynamics simulation. SOFT MATTER , 5 (20) 3896 - 3904. 10.1039/b907590a.

Sven, H; Evans, NR; Bronstein, HA; Williams, CK; (2009) Synthesis of fluoro-substituted silole-containing conjugated materials. Journal of Polymer Science, Part A: Polymer Chemistry , 47 (19) 5116 - 5125. 10.1002/pola.23563.

Tang, E; Di Tommaso, D; de Leeuw, NH; (2009) Hydrogen transfer and hydration properties of HnPO43-n (n=0-3) in water studied by first principles molecular dynamics simulations. J CHEM PHYS , 130 (23) , Article 234502. 10.1063/1.3143952.

Tao, XJ; Li, SJ; Zheng, CY; Hao, YL; Yang, R; Fu, J; ... Guo, ZX; + view all (2009) Synthesis of a porous oxide layer on a multifunctional biomedical titanium by micro-arc oxidation. Materials Science and Engineering C , 29 (6) 1923 - 1934. 10.1016/j.msec.2009.03.004.

Taylor, K; Rolfe, M; Reynolds, N; Kilanowski, F; Pathania, U; Clarke, D; ... Dorin, J; + view all (2009) Defensin-related peptide 1 (Defr1) is allelic to Defb8 and chemoattracts immature DC and CD4(+) T cells independently of CCR6. EUR J IMMUNOL , 39 (5) 1353 - 1360. 10.1002/eji.200838566.

Tedaldi, LM; Baker, JR; (2009) In situ Reduction in Photocycloadditions: A Method to Prevent Secondary Photoreactions. ORG LETT , 11 (4) 811 - 814. 10.1021/ol8026494.

Tedaldi, LM; Smith, MEB; Nathani, RI; Baker, JR; (2009) Bromomaleimides: new reagents for the selective and reversible modification of cysteine. CHEM COMMUN (43) 6583 - 6585. 10.1039/b915136b.

Thiele, U; Vancea, I; Archer, AJ; Robbins, MJ; Frastia, L; Stannard, A; ... Moriarty, PJ; + view all (2009) Modelling approaches to the dewetting of evaporating thin films of nanoparticle suspensions. JOURNAL OF PHYSICS-CONDENSED MATTER , 21 (26) , Article ARTN 264016. 10.1088/0953-8984/21/26/264016.

Thomas, JM; Hernandez-Garrido, JC; Bell, RG; (2009) A General Strategy for the Design of New Solid Catalysts for Environmentally Benign Conversions Solid Catalysts for Benign Conversions. TOP CATAL , 52 (12) 1630 - 1639. 10.1007/s11244-009-9302-5.

Thomas, JM; Hernandez-Garrido, JC; Raja, R; Bell, RG; (2009) Nanoporous oxidic solids: the confluence of heterogeneous and homogeneous catalysis. PHYS CHEM CHEM PHYS , 11 (16) 2799 - 2825. 10.1039/b819249a.

Thomas, LA; Dekker, L; Kallumadil, M; Southern, P; Wilson, M; Nair, SP; ... Parkin, IP; + view all (2009) Carboxylic acid-stabilised iron oxide nanoparticles for use in magnetic hyperthermia. J MATER CHEM , 19 (36) 6529 - 6535. 10.1039/b908187a.

Thompson, K; Goodall, J; Kellici, S; Mattinson, JA; Egerton, TA; Rehman, I; Darr, JA; (2009) Screening tests for the evaluation of nanoparticle titania photocatalysts. J CHEM TECHNOL BIOT , 84 (11) 1717 - 1725. 10.1002/jctb.2237.

Tilocca, A; (2009) Structural models of bioactive glasses from molecular dynamics simulations. P ROY SOC A-MATH PHY , 465 (2104) 1003 - 1027. 10.1098/rspa.2008.0462.

Tilocca, A; Cormack, AN; (2009) Modeling the Water-Bioglass Interface by Ab Initio Molecular Dynamics Simulations. ACS APPL MATER INTER , 1 (6) 1324 - 1333. 10.1021/am900198t.

Tilocca, A; Fois, E; (2009) The Color and Stability of Maya Blue: TDDFT Calculations. J PHYS CHEM C , 113 (20) 8683 - 8687. 10.1021/jp810945a.

Torrisi, A; Mellot-Draznieks, C; Bell, RG; (2009) Impact of ligands on CO2 adsorption in metal-organic frameworks: First principles study of the interaction of CO2 with functionalized benzenes. I. Inductive effects on the aromatic ring. J CHEM PHYS , 130 (19) , Article 194703. 10.1063/1.3120909.

Torrisi, A; Mellot-Draznieks, C; Bell, RG; (2009) Impact of ligands on CO2 adsorption in metal-organic frameworks: First principles study of the interaction of CO2 with functionalized benzenes. I. Inductive effects on the aromatic ring. J CHEM PHYS , 130 (19) , Article 194703. 10.1063/1.3120909.

Tribello, GA; Slater, B; (2009) A theoretical examination of known and hypothetical clathrate hydrate materials. J CHEM PHYS , 131 (2) , Article 024703. 10.1063/1.3142503.

Uddin, MN; Mottalib, MA; Begum, N; Ghosh, S; Raha, AK; Haworth, DT; ... Kabir, SE; + view all (2009) Carbon-Phosphorus Bond Activation of Tri(2-thienyl)phosphine at Dirhenium and Dimanganese Centers. ORGANOMETALLICS , 28 (5) 1514 - 1523. 10.1021/om801075p.

Volpe, G; Cherukulappurath, S; Juanola Parramon, R; Molina-Terriza, G; Quidant, R; (2009) Controlling the optical near field of nanoantennas with spatial phase-shaped beams. Nano Lett , 9 (10) 3608 - 3611. 10.1021/nl901821s.

Wagner, GK; Pesnot, T; Field, RA; (2009) A survey of chemical methods for sugar-nucleotide synthesis. NAT PROD REP , 26 (9) 1172 - 1194. 10.1039/b909621n.

Wakihara, T; Suzuki, Y; Fan, W; Saito, S; Kohara, S; Sankar, G; ... Okubo, T; + view all (2009) Changes in the medium-range order during crystallization of aluminosilicate zeolites characterized by high-energy X-ray diffraction technique. J CERAM SOC JPN , 117 (1363) 277 - 282.

Walker, A.; Woodley, S.; Slater, B.; Wright, K.; (2009) A computational study of magnesium point defects and diffusion in forsterite. Physics of the Earth and Planetary Interiors , 172 (1-2) pp. 20-27. 10.1016/j.pepi.2008.04.001. Green open access
file

Walker, AM; Woodley, SM; Slater, B; Wright, K; (2009) A computational study of magnesium point defects and diffusion in forsterite. PHYS EARTH PLANET IN , 172 (1-2) 20 - 27. 10.1016/j.pepi.2008.04.001.

Walsh, A; Ahn, KS; Shet, S; Huda, MN; Deutsch, TG; Wang, HL; ... Al-Jassim, MM; + view all (2009) Ternary cobalt spinel oxides for solar driven hydrogen production: Theory and experiment. ENERG ENVIRON SCI , 2 (7) 774 - 782. 10.1039/b822903a.

Walsh, A; Catlow, CRA; Sokol, AA; Woodley, SM; (2009) Physical Properties, Intrinsic Defects, and Phase Stability of Indium Sesquioxide. CHEM MATER , 21 (20) 4962 - 4969. 10.1021/cm902280z.

Walsh, A; Da Silva, JLF; Wei, SH; (2009) Comment on "Theoretical Description of Carrier Mediated Magnetism in Cobalt Doped ZnO'' Reply. PHYS REV LETT , 102 (15) , Article 159702. 10.1103/PhysRevLett.102.159702.

Walsh, A; Da Silva, JLF; Wei, SH; (2009) Interplay between Order and Disorder in the High Performance of Amorphous Transparent Conducting Oxides. CHEM MATER , 21 (21) 5119 - 5124. 10.1021/cm9020113.

Walsh, A; Da Silva, JLF; Yan, YF; Al-Jassim, MM; Wei, SH; (2009) Origin of electronic and optical trends in ternary In2O3(ZnO)(n) transparent conducting oxides (n=1,3,5): Hybrid density functional theory calculations. PHYS REV B , 79 (7) , Article 073105. 10.1103/PhysRevB.79.073105.

Walsh, A; Yan, Y; Huda, MN; Al-Jassim, MM; Wei, SH; (2009) Band Edge Electronic Structure of BiVO4: Elucidating the Role of the Bi s and V d Orbitals. CHEM MATER , 21 (3) 547 - 551. 10.1021/cm802894z.

Walters, G; Parkin, IP; (2009) Aerosol assisted chemical vapour deposition of ZnO films on glass with noble metal and p-type dopants; use of dopants to influence preferred orientation. APPL SURF SCI , 255 (13-14) 6555 - 6560. 10.1016/j.apsusc.2009.02.039.

Walters, G; Parkin, IP; (2009) The incorporation of noble metal nanoparticles into host matrix thin films: synthesis, characterisation and applications. J MATER CHEM , 19 (5) 574 - 590. 10.1039/b809646e.

Wan, SZ; Coveney, PV; (2009) A Comparative Study of the COX-1 and COX-2 Isozymes Bound to Lipid Membranes. J COMPUT CHEM , 30 (7) 1038 - 1050. 10.1002/jcc.21130.

Wang, XZ; Perston, B; Yang, Y; Lin, T; Darr, JA; (2009) Robust QSAR model development in high-throughput catalyst discovery based on genetic parameter optimisation. CHEM ENG RES DES , 87 (10A) 1420 - 1429. 10.1016/j.cherd.2009.01.013.

Watkins, MB; Shevlin, SA; Sokol, AA; Slater, B; Catlow, CRA; Woodley, SM; (2009) Bubbles and microporous frameworks of silicon carbide. PHYS CHEM CHEM PHYS , 11 (17) 3186 - 3200. 10.1039/b902603g.

Weng, XL; Cockcroft, JK; Hyett, G; Vickers, M; Boldrin, P; Tang, CC; ... Darr, JA; + view all (2009) High-Throughput Continuous Hydrothermal Synthesis of an Entire Nanoceramic Phase Diagram. J COMB CHEM , 11 (5) 829 - 834. 10.1021/cc900041a.

Weng, XL; Perston, B; Wang, XZ; Abrahams, I; Lin, T; Yang, SF; ... Darr, JA; + view all (2009) Synthesis and characterization of doped nano-sized ceria-zirconia solid solutions. APPL CATAL B-ENVIRON , 90 (3-4) 405 - 415. 10.1016/j.apcatb.2009.03.031.

Wenzel, SE; Fischer, M; Hoffmann, F; Fröba, M; (2009) Highly porous metal-organic framework containing a novel organosilicon linker--a promising material for hydrogen storage. Inorg Chem , 48 (14) 6559 - 6565. 10.1021/ic900478z.

Wilden, JD; Mavri-Damelin, D; Mani, A-R; Selden, C; Hodgson, HJF; Damelin, LH; (2009) The Use of 3-Aminophthalimide as a Pro-Chemiluminescent Label in Chemiluminescence and Fluorescence-Based Cellular Assays. Bioconjugate Chemistry , 20 (2) , Article 10.1021/bc800361r. 10.1021/bc800361r.

Wills, AS; (2009) Indexing magnetic structures and crystallographic distortions from powder diffraction: Brillouin zone indexing. Z KRISTALLOGR 39 - 44. 10.1524/zksu.2009.0006.

Wills, AS; Perring, TG; Raymond, S; Fak, B; Henry, J-Y; Telling, M; (2009) Inelastic neutron scattering studies of the quantum frustrated magnet clinoatacamite, γ-Cu<sub>2</sub>(OD)<sub>3</sub>Cl, a proposed valence bond solid (VBS) journal series. Journal of Physics: Conference Series , 145 012056 - ?. Gold open access

Wong, SC; Ramkissoon, YD; Lopez, M; Page, K; Parkin, IP; Sullivan, PM; (2009) Use of hydroxypropylmethylcellulose 2% for removing adherent silicone oil from silicone intraocular lenses. BRIT J OPHTHALMOL , 93 (8) 1085 - 1088. 10.1136/bjo.2008.153007.

Woodley, SM; (2009) Structure Prediction of Ternary Oxide Sub-Nanoparticles. MATER MANUF PROCESS , 24 (3) 255 - 264. 10.1080/10426910802675848.

Woodley, SM; Catlow, CRA; (2009) Structure prediction of titania phases: Implementation of Darwinian versus Lamarckian concepts in an Evolutionary Algorithm. Computational Materials Science , 45 (1) 84 - 95. 10.1016/j.commatsci.2008.02.033.

Woodley, SM; Watkins, MB; Sokol, AA; Shevlin, SA; Catlow, CRA; (2009) Construction of nano- and microporous frameworks from octahedral bubble clusters. PHYS CHEM CHEM PHYS , 11 (17) 3176 - 3185. 10.1039/b902600b.

Yang, JH; Chen, SY; Yin, WJ; Gong, XG; Walsh, A; Wei, SH; (2009) Electronic structure and phase stability of MgTe, ZnTe, CdTe, and their alloys in the B3, B4, and B8 structures. PHYS REV B , 79 (24) , Article 245202. 10.1103/PhysRevB.79.245202.

Yang, M; Rodgers, JA; Middler, LC; Oró-Solé, J; Jorge, ABN; Fuertes, A; Attfield, JP; (2009) Direct Solid-State Synthesis at High Pressures of New Mixed-Metal Oxynitrides: RZrO N (R = Pr, Nd, and Sm). Inorganic Chemistry , 48 (24) 11498 - 11500. 10.1021/ic902020r.

Yu, WB; Liang, L; Lin, ZJ; Ling, SL; Haranczyk, M; Gutowski, M; (2009) Comparison of Some Representative Density Functional Theory and Wave Function Theory Methods for the Studies of Amino Acids. J COMPUT CHEM , 30 (4) 589 - 600. 10.1002/jcc.21091.

Zasada, SJ; Coveney, PV; (2009) Virtualizing access to scientific applications with the Application Hosting Environment. COMPUT PHYS COMMUN , 180 (12) 2513 - 2525. 10.1016/j.cpc.2009.06.008.

Zeinalipour-Yazdi, CD; Christofides, C; (2009) Linear correlation between binding energy and Young's modulus in graphene nanoribbons. Journal of Applied Physics , 106 (5) 10.1063/1.3211944.

Zeinalipour-Yazdi, CD; Pullman, DP; (2009) Erratum: Additions and corrections: Quantitative structure-property relationships for longitudinal, transverse, and molecular static polarizabilities in polyynes (Journal of Physical Chemistry (1989) 93 (7120)). Journal of Physical Chemistry B , 113 (28) 9628 - 9628. 10.1021/jp904002v.

Zeinalipour-Yazdi, CD; van Santen, RA; (2009) Kinetic rates and linear free energy relationships for water dissociation on transition and noble metal dimers. J Phys Chem A , 113 (25) 6971 - 6978. 10.1021/jp902139m.

Zhang, KHL; Payne, DJ; Palgrave, RG; Lazarov, VK; Chen, W; Wee, ATS; ... Egdell, RG; + view all (2009) Surface Structure and Electronic Properties of In2O3(111) Single-Crystal Thin Films Grown on Y-Stabilized ZrO2(111). CHEMISTRY OF MATERIALS , 21 (19) 4353 - 4355. 10.1021/cm901127r.

Zhang, Z; Goodall, JBM; Morgan, DJ; Brown, S; Clark, RJH; Knowles, JC; ... Darr, JA; + view all (2009) Photocatalytic activities of N-doped nano-titanias and titanium nitride. J EUR CERAM SOC , 29 (11) 2343 - 2353. 10.1016/j.jeurceramsoc.2009.02.008.

Zhang, ZC; Brown, S; Goodall, JBM; Weng, XL; Thompson, K; Gong, KN; ... Darr, JA; + view all (2009) Direct continuous hydrothermal synthesis of high surface area nanosized titania. J ALLOY COMPD , 476 (1-2) 451 - 456. 10.1016/j.jallcom.2008.09.036.

Zhu, R; Ebner, A; Kastner, M; Preiner, J; Howorka, S; Hinterdorfer, P; (2009) Topography and Recognition Imaging of Protein-Patterned Surfaces Generated by AFM Nanolithography. CHEMPHYSCHEM , 10 (9-10) 1478 - 1481. 10.1002/cphc.200900245.

Zwijnenburg, MA; Sokol, AA; Sousa, C; Bromley, ST; (2009) The effect of local environment on photoluminescence: A time-dependent density functional theory study of silanone groups on the surface of silica nanostructures. J CHEM PHYS , 131 (3) , Article 034705. 10.1063/1.3155083.

Book chapter

Aliev, AE; Law, RV; (2009) Solid-state NMR spectroscopy. In: Webb, GA, (ed.) Nuclear Magnetic Resonance, vol. 38. (271 - 321). The Royal Society of Chemistry: Cambridge.

Baker, JR; Woolfson, DN; Muskett, F. W.,; Stoneman, MD; Urbaniak, MD; Caddick, S; (2009) Wiley encyclopedia of chemical biology (Protein-Small Molecule Interactions in Neocarzinostatin). In: Begley, TP and Sons, JW, (eds.) Wiley encyclopedia of chemical biology.

Brennan, JG; Sella, A; (2009) Scandium, yttrium and the lanthanides. In: Specialist Periodical Reports: Organometallic Chemistry. (183 - 223). Royal Society of Chemistry

Howorka, S; Siwy, Z; (2009) Nanopores: Generation, engineering and single-molecule applications. In: Handbook of Single-Molecule Biophysics. (293 - 340). Springer: New York.

Kaltsoyannis, N; (2009) The effects of spin orbit coupling in heavy element chemistry. In: Solomon, EI and Scott, RA and King, RB, (eds.) Computational Inorganic and Bioinorganic Chemistry. (517 - 526). Wiley

PORTER, M; Skidmore, J; (2009) Asymmetric epoxidation of electron-deficient alkenes. In: Denmark, SE, (ed.) Organic reactions. (425 - 672). Wiley: Hoboken, New Jersey, US.

Proceedings paper

Pollington, SD; Enache, DI; Landon, P; Meenakshisundaram, S; Dimitratos, N; Wagland, A; ... Stitt, EH; + view all (2009) Enhanced selective glycerol oxidation in multiphase structured reactors. In: CATALYSIS TODAY. (pp. 169 - 175). ELSEVIER SCIENCE BV

Almora-Barrios, N; de Leeuw, NH; (2009) Computer simulations of the interaction of bio-molecules with hydroxyapatite surfaces in aqueous environment. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A31 - A31). PERGAMON-ELSEVIER SCIENCE LTD

Bar, P; Kravtsov, V; Schuster, A; Coti, C; Herault, T; Groen, D; Swain, M; (2009) Running parallel applications with topology-aware grid middleware. In: e-Science 2009 - 5th IEEE International Conference on e-Science. (pp. 292 - 299).

Binions, R; Afonja, A; Dungey, S; Lewis, D; Parkin, IP; Williams, DE; (2009) Zeotite Modification: Towards Discriminating Metal Oxide Gas Sensors. In: Li, J and Vanysek, P and Brown, R and BrucknerLea, C and Hatchet, D and Josowicz, M, (eds.) 35 YEARS OF CHEMICAL SENSORS - AN HONORARY SYMPOSIUM FOR PROFESSOR JIRI JANATA'S 70TH BIRTHDAY CELEBRATION. (pp. 241 - 250). ELECTROCHEMICAL SOCIETY INC

Binions, R; Afonja, A; Dungey, S; Lewis, DW; Parkin, IP; Williams, DE; (2009) Discrimination Effects in Zeolite Modified Metal Oxide Semiconductor Gas Sensors. In: 2009 IEEE SENSORS, VOLS 1-3. (pp. 1044 - 1049). IEEE

Chaitanya Kumar, S; Mathew, M; Volpe, G; Takayama, O; Valencia, A; (2009) El día de la luz - II (the day of light -II) - optics demonstration for high school students. In: Optics InfoBase Conference Papers.

Chen, MF; You, C; Li, SJ; Yang, R; Guo, ZX; (2009) The Formation of Nanocrystallite Bone-Like Apatite on Chemically Treated Ti-24Nd-4Zr-7.9Sn Alloy. In: JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY. (pp. 1214 - 1217). AMER SCIENTIFIC PUBLISHERS

de Leeuw, NH; Du, ZM; (2009) Modelling the hydration, dissolution and crystallisation of alpha-quartz. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A276 - A276). PERGAMON-ELSEVIER SCIENCE LTD

Devey, AJ; Grau-Crespo, R; de Leeuw, NH; (2009) DFT plus U study of the iron sulphide mineral greigite (Fe3S4). In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A287 - A287). PERGAMON-ELSEVIER SCIENCE LTD

Di Tommaso, D; de Leeuw, NH; (2009) MeHCO3+ and MeCO3 (Me = Ca and Mg) species in aqueous solution: Insights from quantum mechanical calculations. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A294 - A294). PERGAMON-ELSEVIER SCIENCE LTD

Du, ZM; Robertson, M; De Leeuw, NH; (2009) A computational study of the immobilisation of arsenic in groundwater. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A307 - A307). PERGAMON-ELSEVIER SCIENCE LTD

Egglestone, SR; Axelrod, L; Nind, T; Turk, R; Wilkinson, A; Burridge, J; ... Rodden, T; + view all (2009) A design framework for a home-based stroke rehabilitation system: Identifying the key components. In: (Proceedings) 3rd International ICST Conference on Pervasive Computing Technologies for Healthcare. European Alliance for Innovation Green open access
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Evans, JRG; (2009) Microextrusion freeforming is the solution; what was the problem? In: (Proceedings) 6th Millimetre-wave Users Group Meeting, National Physical Laboratory, Teddington, UK.

Greenwell, HC; Coveney, PV; (2009) Investigating organic-clay interactions. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A463 - A463). PERGAMON-ELSEVIER SCIENCE LTD

Groen, D; Harfst, S; Portegies Zwart, S; (2009) On the origin of grid species: The living application. In: Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics). (pp. 205 - 212).

Haidar, AN; Abdallah, AE; (2009) Abstractions of Web Services. In: 2009 14TH IEEE INTERNATIONAL CONFERENCE ON ENGINEERING OF COMPLEX COMPUTER SYSTEMS (ICECCS). (pp. 182 - 191). IEEE

Haidar, AN; Abdallah, AE; (2009) Composition and Customization of Web Services Using Wrappers: A Formal Approach based on CSP. In: Breitman, K and Sterritt, R and Bohner, S, (eds.) 32ND ANNUAL IEEE SOFTWARE ENGINEERING WORKSHOP, PROCEEDINGS. (pp. 187 - 194). IEEE COMPUTER SOC

Hearnden, V; Battaglia, G; MacNeil, S; Murdoch, C; Thornhill, M; (2009) Penetration of polymersome drug and gene delivery nanoparticles into in vitro models of head and neck cancer and tissue engineered oral mucosa. In: ORAL ONCOLOGY. (pp. 66 - 66).

Hewer, T; Nekovee, M; Coveney, PV; (2009) Parameter Exploration in Parallel for Dynamic Vehicular Network Efficiency. In: 2009 INTERNATIONAL CONFERENCE ON ADVANCES IN COMPUTATIONAL TOOLS FOR ENGINEERING APPLICATIONS. (pp. 16 - 20). IEEE

Hewer, T; Nekovee, M; Coveney, PV; (2009) Parameter exploration in parallel for dynamic vehicular network efficiency. In: International Conference on Advances in Computational Tools for Engineering Applications, 2009: ACTEA '09. (pp. 16 - 20). IEEE Computer Society: Los Alamitos, US.

Hewer, TD; Nekovee, M; (2009) Congestion Reduction Using Ad-Hoc Message Dissemination in Vehicular Networks. In: COMMUNICATIONS INFRASTRUCTURE: SYSTEMS AND APPLICATIONS IN EUROPE. (pp. 128 - 139).

Hyett, G; Darr, JA; Mills, A; Parkin, IP; (2009) The Synthesis of Tantalum (V) Oxide Using Atmospheric Pressure Chemical Vapour Deposition for the Purposes of Photo-activated Water Splitting. In: EUROCVD 17 / CVD 17. (pp. 935 - 942).

Jacques, SDM; Leynaud, O; Strusevich, D; Stukas, P; Barnes, P; Sankar, G; ... Beale, AM; + view all (2009) Recent progress in the use of in situ X-ray methods for the study of heterogeneous catalysts in packed-bed capillary reactors. In: CATALYSIS TODAY. (pp. 204 - 212). ELSEVIER SCIENCE BV

King, HE; Stimpfl, M; De Leeuw, NH; Putnis, A; (2009) Dissociated water adsorption to stepped forsterite surfaces: Implications for planetary accretion. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A659 - A659). PERGAMON-ELSEVIER SCIENCE LTD

Muralidharan, K; Stimpfl, M; de Leeuw, NH; Deymier, PA; Runge, K; Drake, MJ; (2009) WATER IN THE INNER SOLAR SYSTEM: INSIGHTS FROM ATOMISTIC AND ELECTRONIC-STRUCTURE CALCULATIONS. In: METEORITICS & PLANETARY SCIENCE. (pp. A136 - A136). METEORITICAL SOC

Raiber, EA; Tulone, C; Steed, E; Chain, BM; Tabor, AB; (2009) Optical imaging of the role of Cathepsin E in antigen processing. In: ABSTR PAP AM CHEM S. (pp. ? - ?). AMER CHEMICAL SOC

Saksena, RS; Boghosian, B; Fazendeiro, L; Kenway, OA; Manos, S; Mazzeo, MD; ... Coveney, PV; + view all (2009) Real science at the petascale. In: PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES. (pp. 2557 - 2571). ROYAL SOC

Sankar, G; Bras, W; (2009) Insights into the formation of microporous materials by in situ X-ray scattering techniques. In: CATALYSIS TODAY. (pp. 195 - 203). ELSEVIER SCIENCE BV

Sloot, PMA; Coveney, PV; Ertaylan, G; Muller, V; Boucher, CA; Bubak, M; (2009) HIV decision support: from molecule to man. In: PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES. (pp. 2691 - 2703). ROYAL SOC

Walsh, A; Wei, SH; Chen, SY; Gong, XG; (2009) DESIGN OF QUATERNARY CHALCOGENIDE PHOTOVOLTAIC ABSORBERS THROUGH CATION MUTATION. In: 2009 34TH IEEE PHOTOVOLTAIC SPECIALISTS CONFERENCE, VOLS 1-3. (pp. 1803 - 1806). IEEE

Wang, Q; De Leeuw, NH; (2009) A computer simulation study of the thermodynamics of mixing in the (Ca, Mn)CO3 solid solution. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A1412 - A1412). PERGAMON-ELSEVIER SCIENCE LTD

Wills, AS; Perring, TG; Raymond, S; Fak, B; Henry, JY; Telling, M; (2009) Inelastic neutron scattering studies of the quantum frustrated magnet clinoatacamite, gamma-Cu-2(OD)(3)Cl, a proposed valence bond solid (VBS). In: Eremin, I and Brenig, W and Kremer, R and Litterst, J, (eds.) HIGHLY FRUSTRATED MAGNETISM 2008 (HFM 2008). (pp. ? - ?). IOP PUBLISHING LTD Gold open access

Yan, YF; Walsh, A; Da Silva, JLF; Wei, SH; Al-Jassim, M; (2009) STRUCTURAL, ELECTRONIC, AND OPTICAL PROPERTIES OF THE IN2O3(ZNO)(N) SYSTEM. In: 2009 34TH IEEE PHOTOVOLTAIC SPECIALISTS CONFERENCE, VOLS 1-3. (pp. 2234 - 2236). IEEE

Yang, S; Lu, X; Lee, Y; Hao, Y; Evans, JRG; Parini, CG; (2009) Metamaterials fabrication by solid freeform fabrication (Invited lecture). In: (Proceedings) International Conference on Advances in Functional Materials, 8-12 June, Jiuzhaiguo, P.R.China..

Thesis

Adriaens, D.A.; (2009) Theoretical investigations of surface chemistry in space. Doctoral thesis, UCL (University College London). Green open access
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Bishop, C.L.; (2009) The construction, development and application of potential simulation models to the filling of carbon nanotubes by molten salts. Doctoral thesis, UCL (University College London). Green open access
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Davies, Z.; (2009) Application of representation theory to magnetic and structural phase transitions. Doctoral thesis, UCL (University College London). Green open access
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Deifallah, M.K.; (2009) A computational study of the structure and properties of aluminophosphates and carbon nitrides. Doctoral thesis, UCL (University College London).

Dines, J.; (2009) Synthesis of inhibitors of histone deacetylase. Doctoral thesis, UCL (University College London).

Geldeard, L.J.; (2009) Fundamental studies on 2,4,6-trichlorophenyl sulfonate esters. Doctoral thesis, UCL (University College London). Green open access
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Greco, E.; (2009) Synthesis of self-assembly systems with multiple hydrogen bonding interactions. Doctoral thesis, UCL (University College London).

Jerome, L.; (2009) The generation and reactivity of functionalised organozinc carbenoids for cyclopropane synthesis. Doctoral thesis, UCL (University College London). Green open access
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Jonasson, L.; (2009) Computational investigations of the electronic structure of molecular actinide compounds. Doctoral thesis, UCL (University College London). Green open access
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Jones, N.; (2009) The spectroscopy of bound and predissociating Rydberg states of NO in external electric fields. Doctoral thesis, UCL (University College London). Green open access
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Kato, Y.; (2009) Studies towards novel aldolase mimics. Doctoral thesis, UCL (University College London). Green open access
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King, S.-J.; (2009) Studies of the dissociation and energetics of gaseous ions. Doctoral thesis, UCL (University College London). Green open access
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Narband, N.; (2009) Nanoparticles and photosensitisers; their interactions and antibacterial properties. Doctoral thesis, UCL (University College London). Green open access
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Page, K.; (2009) Photocatalytic thin films: their characterisation and antimicrobial properties. Doctoral thesis, UCL (University College London). Green open access
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Parker, D.S.N.; (2009) Experimental investigation of the dynamics of S1 benzene and the development of a new UV femtosecond pulse shaper. Doctoral thesis, UCL (University College London). Green open access
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Quesada Cabrera, R.; (2009) Molecular solids at high pressure. Doctoral thesis, UCL (University College London).

Targett, J.J.; (2009) The polymorphs and solvates of phenylbutazone and their phase transition behaviour. Masters thesis, UCL (University College London). Green open access
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This list was generated on Mon Dec 22 04:40:46 2014 GMT.