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Number of items at this level: 261.

A

Abraham, M.H. and Ibrahim, A. and Zhao, Y. and Acree, W.E. (2006) A data base for partition of volatile organic compounds and drugs from blood/plasma/serum to brain, and an LFER analysis of the data. Journal of Pharmaceutical Sciences, 95 (10). pp. 2091-2100. ISSN 00223549

Abraham, M.H. and Platts, J.A. (2001) Hydrogen bond structural group constants. The Journal of Organic Chemistry, 66 (10). pp. 3484-3491. ISSN 00223263

Abraham, M.H. and Zhao, Y.H. (2004) Determination of solvation descriptors for ioonic species: hydrogen bond acidity and basicity. The Journal of Organic Chemistry, 69 (14). pp. 4677-4685. ISSN 00223263

Adriaens, D.A. (2009) Theoretical investigations of surface chemistry in space. Doctoral thesis, UCL (University College London) file

Akutsu, H. and Akutsu-Sato, A. and Turner, S.S. and Day, P. and Canadell, E. and Firth, S. and Clark, R.J.H. and Yamada, J.-I. and Nakatsuji, S.-I. (2004) Superstructures of donor packing arrangements in a series of molecular charge transfer salts. Chemical Communications, 7 (1). pp. 18-19. ISSN 13597345

Akutsu-Sato, A. and Akutsu, H. and Turner, S.S. and Day, P. and Probert, M.R. and Howard, J.A.K. and Akutagawa, T. and Takeda, S. and Nakamura, T. and Mori, T. (2005) The first proton-conducting metallic ion-radical salts. Angewandte Chemie International Edition, 44 (2). pp. 292-295. ISSN 14337851

Almora-Barrios, N. and Ruiz-Salvador, A.R. and Gómez, A. and Mistry, M. and Lewis, D.W. (2001) Understanding Si/Al distributions in Al-rich zeolites: the role of water in determining the structure of Goosecreekite. Chemical Communications (6). pp. 531-532. ISSN 13597345

Anwar, M.K. and Hogarth, G. and Senturk, O.S. and Clegg, W. and Doherty, S. and Elsegood, M.R.J. (2001) α–βAlkenyl isomerisation at diiron centres. Journal of the Chemical Society Dalton Transactions (3). pp. 341-352. ISSN 14727773

Aqeel, T.M.R. (2008) Synthesis, characterisation, and sorption studies of porous in organic materials. Doctoral thesis, UCL (University College London)

Ashraf, S. and Blackman, C.S. and Palgrave, R.G. and Parkin, I.P. (2007) Aerosol-assisted chemical vapour deposition of WO3 thin films using polyoxometallate precursors and their gas sensing properties. Journal of Materials Chemistry, 17 (11). pp. 1063-1070. ISSN 09599428

Astier, Y. and Kainov, D.E. and Bayley, H. and Tuma, R. and Howorka, S. (2007) Stochastic detection of motor protein–RNA complexes by single-channel current recording. ChemPhysChem, 8 (15). pp. 2189-2194. ISSN 14394235

B

Baker, J.R. and Thominet, O. and Britton, H. and Caddick, S. (2007) An efficient synthesis of epoxydiynes and a key fragment of neocarzinostatin chromophore. Organic Letters, 9 (1). pp. 45-48. ISSN 15237060

Bangura, A.F. and Coldea, A.I. and Singleton, J. and Ardavan, A. and Akutsu-Sato, A. and Akutsu, H. and Turner, S.S. and Day, P. and Yamamoto, T. and Yakushi, K. (2005) Robust superconducting state in the low-quasiparticle-density organic metals β^{″}-(BEDT-TTF)_{4}[(H_{3}O)M(C_{2}O_{4})_{3}]∙Y: superconductivity due to proximity to a charge-ordered state. Physical Review B, 72 (1). 014543. ISSN 10980121

Basharat, S. and Betchley, W. and Carmalt, C.J. and Barnett, S. and Tocher, D.A. and Davies, H.O. (2007) Synthesis of group 13 sesquialkoxides and their application as precursors to crystalline oxide films. Organometallics, 26 (2). pp. 403-407. ISSN 02767333

Bégis, G. and Cladingboel, D. and Motherwell, W.B. (2003) The generation and trapping of organozinc carbenoids from N-diethoxymethyl amides: a new amidocyclopropanation reaction. Chemical Communications, 2003 (21). pp. 2656-2657. ISSN 13597345

Bégis, G. and Sheppard, T.D. and Cladingboel, D.E. and Motherwell, W.B. and Tocher, D.A. (2005) Synthesis of enantiopure sminocyclopropanes by diastereoselective addition of a chiral amino substituted organozinc carbenoid to alkenes. Synthesis (19). pp. 3186-3188. ISSN 00397881

Beale, A.M. and Sankar, G. (2006) Understanding the crystallization of nanosized cobalt aluminate spinel from ion-exchanged zeolites using combined in situ QEXAFS/XRD. Chemistry of Materials, 18 (2). pp. 263-272. ISSN 08974756

Beale, A.N. and Sankar, G. (2003) In situ study of the formation of crystalline bismuth molybdate materials under hydrothermal conditions. Chemistry of Materials, 15 (1). pp. 146-153. ISSN 08974756

Beyer, T. and Day, G.M. and Price, S.L. (2001) The prediction, morphology, and mechanical properties of the polymorphs of paracetamol. Journal of the American Chemical Society, 123 (21). pp. 5086-5094. ISSN 00027863

Bikondoa, O. and Pang, C.L. and Ithnin, R. and Muryn, C.A. and Onishi, H. and Thornton, G. (2006) Direct visualization of defect-mediated dissociation of water on TiO2(110). Nature Materials, 5 (3). pp. 189-192. ISSN 14761122

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) file

Blackman, C.S. and Carmalt, C.J. and O'Neill, S.A. and Parkin, I.P. and Apostolico, L. and Molloy, K.C. (2004) Atmospheric-pressure chemical vapor deposition of group IVb metal phosphide thin films from tetrakisdimethylamidometal complexes and cyclohexylphosphine. Chemistry of Materials, 16 (6). pp. 1120-1125. ISSN 08974756

Blackman, C.S. and Carmalt, C.J. and O'Neill, S.A. and Parkin, I.P. and Molloy, K.C. and Apostolico, L. (2003) Chemical vapour deposition of group Vb metal phosphide thin films. Journal of Materials Chemistry, 13 (8). pp. 1930-1935. ISSN 09599428

Blackman, C.S. and Parkin, I.P. (2005) Atmospheric pressure chemical vapor deposition of crystalline monoclinic WO3 and WO3-x thin films from reaction of WCl6 with O-containing solvents and their photochromic and electrochromic properties. Chemistry of Materials, 17 (6). pp. 1583-1590. ISSN 08974756

Boakes, G. and Mok, W.H.H. and Rowley, D.M. (2005) Kinetic studies of the ClO + ClO association reaction as a function of temperature and pressure. Physical Chemistry Chemical Physics, 7 (24). pp. 4102-4113. ISSN 14639076

Bolina, A.S. and Wolff, A.J. and Brown, W.A. (2005) Reflection absorption infrared spectroscopy and temperature-programmed desorption studies of the adsorption and desorption of amorphous and crystalline water on a graphite surface. The Journal of Physical Chemistry B, 109 (35). pp. 16836-16845. ISSN 15206106

Bolina, A.S. and Wolff, A.J. and Brown, W.A. (2005) Reflection absorption infrared spectroscopy and temperature programmed desorption investigations of the interaction of methanol with a graphite surface. The Journal of Chemical Physics, 122 (4). 044713. ISSN 00219606

Booker-Milburn, K.I. and Baker, J.R. and Bruce, I. (2004) Rapid access to azepine-fused oxetanols from alkoxy-substituted maleimides. Organic Letters, 6 (9). pp. 1481-1484. ISSN 15237060

Bramwell, S.T. and Gingras, M.J.P. (2001) Spin ice state in frustrated magnetic pyrochlore materials. Science, 294 (5546). pp. 1495-1501. ISSN 00368075 file

Bregant, S. and Tabor, A.B. (2005) Orthogonally protected lanthionines: synthesis and use for the solid-phase synthesis of an analogue of nisin ring C. The Journal of Organic Chemistry, 70 (7). pp. 2430-2438. ISSN 00223263

Brookes, I.M. and Muryn, C.A. and Thornton, G. (2001) Imaging water dissociation on TiO_{2}(110). Physical Review Letters, 87 (26). p. 266103. ISSN 00319007

Brym, M. and Jones, C. and Wilton-Ely, J. D. E. T. (2005) Auration, argentation and mercuration reactions of an iridaphosphirene complex. Inorganic Chemistry, 44 (9). pp. 3275-3282. ISSN 00201669

Burgio, L. and Clark, R.J.H. (2001) Library of FT-Raman spectra of pigments, minerals, pigment media and varnishes, and supplement to existing library of Raman spectra of pigments with visible excitation. Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy, 57 (7). pp. 1491-1521. ISSN 13861425

Burgio, L. and Clark, R.J.H. and Sheldon, L. and Smith, G.D. (2005) Pigment identification by spectroscopic means: evidence consistent with the attribution of the painting young woman seated at a virginal to vermeer. Analytical Chemistry, 77 (5). pp. 1261-1267. ISSN 00032700

Bursten, B.E. and Chisholm, M.H. and Clark, R.J.H. and Firth, S. and Hadad, C.M. and MacIntosh, A.M. and Wilson, P.J. and Woodward, P.M. and Zaleski, J.M. (2002) Oxalate-bridged complexes of dimolybdenum and ditungsten supported by pivalate ligands: (tBuCO2)3M2(-O2CCO2)M2(O2CtBu)3. Correlation of the solid-state, molecular, and electronic structures with raman, resonance raman, and electronic spectral data. Journal of the American Chemical Society, 124 (12). pp. 3050-3063. ISSN 00027863

Bursten, B.E. and Chisholm, M.H. and Clark, R.J.H. and Firth, S. and Hadad, C.M. and Wilson, P.J. and Woodward, P.M. and Zaleski, J.M. (2002) Perfluoroterephthalate bridged complexes with M-M quadruple bonds: (tBuCO2)3M2(-O2CC6F4CO2)M2(O2CtBu)3, where M = Mo or W. studies of solid-state, molecular, and electronic structure and correlations with electronic and raman spectral data. Journal of the American Chemical Society, 124 (41). pp. 12244-12254. ISSN 00027863

C

Caddick, S. and Cloke, F.G.N. and Hitchcock, P.B. and Lewis, A.K.D.K. (2004) Unusual reactivity of a nickel N-heterocyclic carbene complex: tert-butyl group cleavage and silicone grease activation. Angewandte Chemie International Edition, 43 (43). pp. 5824-5827. ISSN 14337851

Caddick, S. and Cloke, G.N. and Hitchcock, P.B. and Leonard, J. and Lewis, A.K.D.K. and McKerrecher, D. and Titcomb, L.R. (2002) The first example of simple oxidative addition of an aryl chloride to a discrete palladium N-heterocyclic carbene amination precatalyst. Organometallics, 21 (21). pp. 4318-4319. ISSN 02767333

Caddick, S. and Hamza, D. and Wadman, S.N. and Wilden, J.D. (2002) Solid-phase intermolecular radical reactions 2: synthesis of C-glycopeptide mimetics via a novel acrylate acceptor. Organic Letters, 4 (10). pp. 1775-1777. ISSN 15237060

Caddick, S. and Muskett, F.W. and Stoneman, R.G. and Woolfson, D.N. (2006) Synthetic ligands for apo-neocarzinostatin. Journal of the American Chemical Society, 128 (13). pp. 4204-4205. ISSN 00027863

Caddick, S. and Wilden, J.D. and Judd, S. (2004) Direct synthesis of sulfonamides and activated sulfonate esters from sulfonic acids. Journal of the American Chemical Society, 126 (4). pp. 1024-1025. ISSN 00027863

Carmalt, C.J. and Manning, T.D. and Parkin, I.P. and Peters, E.S. and Hector, A.L. (2004) Formation of a new (1T) trigonal NbS2 polytype via atmospheric pressure chemical vapour deposition. Journal of Materials Chemistry, 14 (3). pp. 290-291. ISSN 09599428

Carmalt, C.J. and Mileham, J.D. and White, A.J.P. and Williams, D.J. and Steed, J.W. (2001) Synthesis and characterization of gallium silylamido complexes. Inorganic Chemistry, 40 (23). pp. 6035-6038. ISSN 00201669

Carmalt, C.J. and Newport, A. and Parkin, I.P. and Mountford, P. and Sealey, A.J. and Dubberley, S.R. (2003) Synthesis of TiN thin films from titanium imido complexes. Journal of Materials Chemistry, 13 (1). pp. 84-87. ISSN 09599428

Caruana, D.J. and McCormack, S.P. (2001) Electrochemical diffusion potential in the gas phase. Electrochemistry Communications, 3 (11). pp. 675-681. ISSN 13882481

Catlow, C.R.A. and French, S.A. and Sokol, A.A. and Thomas, J.M. (2005) Computational approaches to the determination of active site structures and reaction mechanisms in heterogeneous catalysts. Philosophical Transactions of The Royal Society A Mathematical Physical and Engineering Sciences, 363 (1829). pp. 913-936. ISSN 1364503X

Cavigliasso, G. and Kaltsoyannis, N. (2006) On the paucity of molecular actinide complexes with unsupported metal-metal bonds: a comparative investigation of the electronic structure and metal-metal bonding in U2X6 (X = Cl, F, OH, NH2, CH3) complexes and d-Block analogues. Inorganic Chemistry, 45 (17). pp. 6828-6839. ISSN 00201669

Chain, B.M. and Free, P. and Medd, P. and Swetman, C. and Tabor, A.B. and Terrazzini, N. (2005) The expression and function of cathepsin E in dendritic cells. The Journal of Immunology, 174 (4). pp. 1794-1800. ISSN 00221767

Charalambidou, E. (2008) Synthesis of oxazole ring systems for use as inhibitors of telomerase function. Masters thesis, UCL (University College London)

Chaudhry, A.A. and Haque, S. and Kellici, S. and Boldrin, P. and Rehman, I. and Khalid, F.A. and Darr, J.A. (2006) Instant nano-hydroxyapatite: a continuous and rapid hydrothermal synthesis. Chemical Communications (21). pp. 2286-2288. ISSN 13597345

Chen, B. and Evans, J.R.G. (2005) On the thermodynamic driving force for polymer intercalation in smectite clays. Philosophical Magazine, 85 (14). pp. 1519-1538. ISSN 14786435

Chen, B. and Evans, J.R.G. (2004) Preferential intercalation in polymer-clay nanocomposites. The Journal of Physical Chemistry B, 108 (39). pp. 14986-14990. ISSN 15206106

Chin, J. and Coveney, P.V. (2006) Chirality and domain growth in the gyroid mesophase. Proceedings of The Royal Society A Mathematical Physical and Engineering Sciences, 462 (2076). pp. 3575-3600. ISSN 13645021

Chisholm, M.H. and Clark, R.J.H. and Gallucci, J. and Hadad, C.M. and Patmore, N.J. (2004) Electronically-coupled tungsten-tungsten quadruple bonds: comparisons of electron delocalization in 3,6-dioxypyridazine and oxalate-bridged compounds. Journal of the American Chemical Society, 126 (26). pp. 8303-8313. ISSN 00027863

Cora, F. (2005) The performance of hybrid density functionals in solid state chemistry: the case of BaTiO3. Molecular Physics, 103 (18). pp. 2483-2496. ISSN 00268976

Corà, F. and Alfredsson, M. and Mallia, G. and Middlemiss, D.S. and Mackrodt, W.C. and Dovesi, R. and Orlando, R. (2004) The performance of hybrid density functionals in solid state chemistry. In: Kaltsoyannis, N. and McGrady, J.E., (eds.) Principles and Applications of Density Functional Theory in Inorganic Chemistry II. Structure and Bonding (113). Springer , Berlin / Heidelberg, Germany, pp. 171-232.

Corà, F. and Catlow, C.R.A. (2001) Ionicity and framework stability of crystalline aluminophosphates. The Journal of Physical Chemistry B, 105 (42). pp. 10278-10281. ISSN 15206106

Corà, F. and Saadoune, I. and Catlow, C.R.A. (2002) Lewis acidity in transition-metal-doped microporous aluminophosphates. Angewandte Chemie International Edition, 41 (24). pp. 4677-4680. ISSN 14337851

Corà, F. and Sankar, G. and Catlow, C.R.A. and Thomas, J.M. (2002) Electronic state and three-dimensional structure of Mn(iii) active sites in manganese-containing aluminophosphate molecular sieve catalysts for the oxyfunctionalisation of alkanes. Chemical Communications (7). pp. 734-735. ISSN 13597345

Coreno, M. and de Simone, M. and Green, J.C. and Kaltsoyannis, N. and Narband, N. and Sella, A. (2006) Photoelectron spectroscopy of Ce(η-C5H5)3 – Accessing two ion states on 4f ionization. Chemical Physics Letters, 432 (1-3). pp. 17-21. ISSN 00092614

Coronado, E. and Day, P. (2004) Magnetic molecular conductors. Chemical Reviews, 104 (11). pp. 5419-5448. ISSN 00092665

Creighan, S.C. and Perry, J.S.A. and Price, S.D. (2006) The rovibrational distribution of H[sub 2] and HD formed on a graphite surface at 15–50 K. The Journal of Chemical Physics, 124 (11). p. 114701. ISSN 00219606

Cyganik, P. and Buck, M. and Wilton-Ely, J. D. E. T. and Wöll, C. (2005) Stress in Self-Assembled Monolayers: ω-Biphenyl Alkane Thiols on Au(111). Journal of Physical Chemistry B, 109 (21). pp. 10902-10908. ISSN 15206106

D

Davies, Z. (2009) Application of representation theory to magnetic and structural phase transitions. Doctoral thesis, UCL (University College London) file

De Angelis, F. and Tilocca, A. and Selloni, A. (2004) Time-dependent DFT study of [Fe(CN)6]4- sensitization of TiO2 nanoparticles. Journal of the American Chemical Society, 126 (46). pp. 15024-15025. ISSN 00027863

De Fabritiis, G. and Delgado-Buscalioni, R. and Coveney, P.V. (2006) Multiscale modeling of liquids with molecular specificity. Physical Review Letters, 97 (13). p. 134501. ISSN 00319007

de Leeuw, N.H. (2004) A computer modelling study of the uptake and segregation of fluoride ions at the hydrated hydroxyapatite (0001) surface: introducing a Ca10(PO4)6(OH)2 potential model. Physical Chemistry Chemical Physics, 6 (8). pp. 1860-1866. ISSN 14639076

de Leeuw, N.H. and Du, Z. and Li, J. and Yip, S. and Zhu, T. (2003) Computer modeling study of the effect of hydration on the stability of a silica nanotube. Nano Letters, 3 (10). pp. 1347-1352. ISSN 15306984

Deifallah, M.K. (2009) A computational study of the structure and properties of aluminophosphates and carbon nitrides. Doctoral thesis, UCL (University College London)

Delgado-Buscalioni, D. and Coveney, P.V. (2003) Continuum-particle hybrid coupling for mass, momentum, and energy transfers in unsteady fluid flow. Physical Review E, 67 (4). 046704. ISSN 15393755

Di Valentin, C. and Tilocca, A. and Selloni, A. and Beck, T.J. and Klust, A. and Batzill, M. and Losovyj, Y. and Diebold, U. (2005) Adsorption of water on reconstructed rutile TiO2(011)-(2×1): Ti=O double bonds and surface reactivity. Journal of the American Chemical Society, 127 (27). pp. 9895-9903. ISSN 00027863

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

Ding, R. and Guo, Z.X. (2001) Coupled quantitative simulation of microstructural evolution and plastic flow during dynamic recrystallization. Acta Materialia, 49 (16). pp. 3163-3175. ISSN 13596454

Diorazio, L.J. and Motherwell, W.B. and Sheppard, T.D. and Waller, R.W. (2006) Observations on the reaction of N-alkyloxazolidines, isocyanides and carboxylic acids: a novel three-component reaction leading to N-acyloxyethylamino acid amides. Synlett, 2006 (14). pp. 2281-2283. ISSN 09365214

Domingos, A. and Elsegood, M.R.J. and Hillier, A.C. and Lin, G. and Liu, S.Y. and Lopes, I. and Marques, N. and Maunder, G.H. and McDonald, R. and Sella, A. and Steed, J.W. and Takats, J. (2002) Facile pyrazolylborate ligand degradation at lanthanide centers: x-ray crystal structures of pyrazolylborinate-bridged bimetallics. Inorganic Chemistry, 41 (25). pp. 6761-6768. ISSN 00201669

Domingos, A. and Lopes, I. and Waerenborgh, J.C. and Marques, N. and Lin, G.Y. and Zhang, X.W. and Takats, J. and McDonald, R. and Hillier, A.C. and Sella, A. and Elsegood, M.R.J. and Day, V.W. (2007) Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu). Inorganic Chemistry, 46 (22). pp. 9415-9424. ISSN 00201669

E

Evans, W.J. and Kozimor, S.A. and Ziller, J.W. and Kaltsoyannis, N. (2004) Structure, reactivity, and density functional theory analysis of the six-electron reductant, [(C5Me5)2U]2(-6:6-C6H6), synthesized via a new mode of (C5Me5)3M reactivity. Journal of the American Chemical Society, 126 (44). pp. 14533-14547. ISSN 00027863

Ewing, M.B. and Royal, D.D. (2002) Relative permittivities and dielectric virial coefficients of nitrogen at T=283.401K and T=303.409K determined using a cylindrical microwave cavity resonator. The Journal of Chemical Thermodynamics, 34 (12). pp. 1985-1999. ISSN 00219614

Ewing, M.B. and Royal, D.D. (2002) A highly stable cylindrical microwave cavity resonator for the measurement of the relative permittivities of gases. The Journal of Chemical Thermodynamics, 34 (7). pp. 1073-1088. ISSN 00219614

Ewing, M.B. and Sanchez Ochoa, J.C. (2006) Vapour pressures of n-hexane determined by comparative ebulliometry. The Journal of Chemical Thermodynamics, 38 (3). pp. 283-288. ISSN 00219614

Ewing, M.B. and Sanchez Ochoa, J.C. (2004) Vapor pressures of acetonitrile determined by comparative ebulliometry. Journal of Chemical and Engineering Data, 49 (3). pp. 486-491. ISSN 00219568

F

Férey, G. and Mellot-Draznieks, C. and Serre, C. and Millange, F. and Dutour, J. and Surblé, S. and Margiolaki, I. (2005) A chromium terephthalate-based solid with unusually large pore volumes and surface area. Science, 309 (5743). pp. 2040-2042. ISSN 00368075

Férey, G. and Serre, C. and Mellot-Draznieks, C. and Millange, F. and Surblé, S. and Dutour, J. and Margiolaki, I. (2004) A hybrid solid with giant pores prepared by a combination of targeted chemistry, simulation, and powder diffraction. Angewandte Chemie International Edition, 43 (46). pp. 6296-6301. ISSN 14337851

Fennell, T. and Bramwell, S.T. and McMorrow, D.F. and Manuel, P. and Wildes, A.R. (2007) Pinch points and Kasteleyn transitions in kagome ice. Nature Physics, 3 (8). pp. 566-572. ISSN 14760000

Foster, M.D. and Friedrichs, O.D. and Bell, R.G. and Almeida Paz, F.A. and Klinowski, J. (2003) Structural evaluation of systematically enumerated hypothetical uninodal zeolites. Angewandte Chemie International Edition, 42 (33). pp. 3896-3899. ISSN 14337851

Foster, M.D. and Simperler, A. and Bell, R.G. and Friedrichs, O.D. and Almeida Paz, F.A. and Klinowski, J. (2004) Chemically feasible hypothetical crystalline networks. Nature Materials, 3 (4). pp. 234-238. ISSN 14761122

French, S.A. and Di Tommaso, D. and Zanotti-Gerosa, A. and Hancock, F. and Catlow, C.R.A. (2007) New insights into the enantioselectivity in the hydrogenation of prochiral ketones. Chemical Communications (23). pp. 2381-2383. ISSN 13597345

G

Gawler, K.S. and Boakes, G. and Rowley, D.M. (2003) Kinetic studies of the gas phase INO2 self-reaction. Physical Chemistry Chemical Physics, 5 (17). pp. 3632-3637. ISSN 14639076

Geldeard, L.J. (2009) Fundamental studies on 2,4,6-trichlorophenyl sulfonate esters. Doctoral thesis, UCL (University College London) . Restricted access. file

González-Segredo , N. and Nekovee , M. and Coveney, P.V. (2003) Three-dimensional lattice-Boltzmann simulations of critical spinodal decomposition in binary immiscible fluids. Physical Review E, 67 (4). 046304. ISSN 15393755

Grau-Crespo, R. and Catlow, C.R.A. and de Leeuw, N. (2007) A computer modeling study of redox processes on the FeSbO4 (100) surface. Journal of Catalysis, 248 (1). pp. 77-88. ISSN 00219517

Greco, E. (2009) Synthesis of self-assembly systems with multiple hydrogen bonding interactions. Doctoral thesis, UCL (University College London)

H

Hadzifejzovic, E. and Sanchez Galiani, J.A. and Caruana, D.J. (2006) Plasma electrochemistry: potential measured at boron doped diamond and platinum in gaseous electrolyte. Physical Chemistry Chemical Physics, 8 (24). pp. 2797-2809. ISSN 14639076

Hadzifejzovic, E. and Stankovic, J. and Firth, S. and McMillan, P.F. and Caruana, D.J. (2007) Plasma electrochemistry: electroreduction in a flame. Physical Chemistry Chemical Physics, 9 (39). pp. 5335-5339. ISSN 14639076

Halla, J.D. and Mamak, M. and Williams, D.E. and Ozin, G.A. (2003) Meso-SiO2–C12EO10OH–CF3SO3H — a novel proton-conducting solid electrolyte. Advanced Functional Materials, 13 (2). pp. 133-138. ISSN 1616301X

Hamad, S. and Cristol, S. and Catlow, C.R.A. (2005) Simulation of the embryonic stage of ZnS formation from aqueous solution. Journal of the American Chemical Society, 127 (8). pp. 2580-2590. ISSN 00027863

Hamad, S. and Moon, C. and Catlow, C.R.A. and Hulme, A.T. and Price, S.L. (2006) Kinetic insights into the role of the solvent in the polymorphism of 5-Fluorouracil from molecular dynamics simulations. The Journal of Physical Chemistry B, 110 (7). pp. 3323-3329. ISSN 15206106

Harper, S.M. and Hu, S.W-P. and Price, S.D. (2004) Experimental studies of the dynamics of the bond-forming reactions of CF2(2+) with H2O using position-sensitive coincidence spectroscopy. The Journal of Chemical Physics, 121 (8). p. 3507. ISSN 00219606

Harper, S.M. and Hu, S.W-P. and Price, S.D. (2004) Collision complexes in dissociative single electron transfer between Ne[sup 2+] and N[sub 2]. The Journal of Chemical Physics, 120 (16). p. 7245. ISSN 00219606

Hervé, G. and Hahn, D.U. and Hervé, A.-C. and Goodworth, K.J. and Hill, A.M. and Hailes, H.C. (2003) The selective functionalisation and difunctionalisation of p-substituted calix[6]arene and calix[8]arenes using hydrophilic moieties. Organic & Biomolecular Chemistry, 1 (2). pp. 427-435. ISSN 14770520

Hibbert, E.G. and Senussi, T. and Costelloe, S.J. and Lei, W. and Smith, M.E.B. and Ward, J.M. and Hailes, H.C. and Dalby, P.A. (2007) Directed evolution of transketolase activity on non-phosphorylated substrates. Journal of Biotechnology, 131 (4). pp. 425-432. ISSN 01681656

Hibbert, E.G. and Senussi, T. and Smith, M.E.B. and Costelloe, S.J. and Ward, J.M. and Hailes, H.J. and Dalby, P.A. (2008) Directed evolution of transketolase substrate specificity towards an aliphatic aldehyde. Journal of Biotechnology, 134 (3-4). pp. 240-245. ISSN 01681656

Hickford, P.J. and Baker, J.R. and Bruce, I. and Booker-Milburn, K.I. (2007) Acid-catalyzed rearrangement of fused alkylideneoxetanols. Organic Letters, 9 (23). pp. 4681-4684. ISSN 15237060

Hogarth, G. and Holman, K.T. and Pateman, A. and Sella, A. and Steed, J.W. and Richards, I. (2005) Multiple nitrene insertions into metal–sulfur bonds of dithiocarbamate complexes: synthesis of sulfido-amido and zwitterionic tetraamido complexes. Dalton Transactions (16). pp. 2688-2695. ISSN 14779226

Hogarth, G. and Richards, I. (2007) Synthesis, crystal structure and protonation of the asymmetric iron-only hydrogenase model [Fe2(CO)3(μ-pdt){μ,η2-Ph2PCH2CH2P(Ph)CH2CH2PPh2}] (pdt=SCH2CH2CH2S). Inorganic Chemistry Communications, 10 (1). pp. 66-70. ISSN 13877003

Hogarth, G. and Richards, I. (2005) Regioselective and reversible carbon–nitrogen bond formation: synthesis, structure and reactivity of ureato-bridged complexes [Mo2(NAr)2(µ-X){µ-ArNC(O)NAr}(S2CNR2)2](Ar = Ph, p-tol; X = S, NAr; R = Me, Et, Pr). Dalton Transactions (4). pp. 760-773. ISSN 14779226

Holt, K.B. (2006) Using scanning electrochemical microscopy (SECM) to measure the electron-transfer kinetics of cytochrome c immobilized on a COOH-terminated alkanethiol monolayer on a gold electrode. Langmuir, 22 (9). pp. 4298-4304. ISSN 07437463

Holt, K.B. and Bard, A.J. (2005) Interaction of silver(I) ions with the respiratory chain of escherichia coli: an electrochemical and scanning electrochemical microscopy study of the antimicrobial mechanism of micromolar Ag+. Biochemistry, 44 (39). pp. 13214-13223. ISSN 00062960

Holt, K.B. and Bard, A.J. and Show, Y. and Swain, G.M. (2004) Scanning electrochemical microscopy and conductive probe atomic force microscopy studies of hydrogen-terminated doron-doped diamond electrodes with different doping levels. The Journal of Physical Chemistry B, 108 (39). pp. 15117-15127. ISSN 15206106

Holt, K.B. and Hu, J. and Foord, J.S. (2007) Fabrication of boron-doped diamond ultramicroelectrodes for use in scanning electrochemical microscopy experiments. Analytical Chemistry, 79 (6). pp. 2556-2561. ISSN 00032700

Horvath-Bordon, E. and Riedel, R. and McMillan, P.F. and Kroll, P. and Miehe, G. and van Aken, P.A. and Zerr, A. and Hoppe, P. and Shebanova, O. and McLaren, I. and Lauterbach, S. and Kroke, E. and Boehler, R. (2007) High-pressure synthesis of crystalline carbon nitride imide, C2N2(NH). Angewandte Chemie International Edition, 46 (9). pp. 1476-1480. ISSN 14337851

Howorka, S. and Movileanu, L. and Braha, O. and Bayley, H. (2001) Kinetics of duplex formation for individual DNA strands within a single protein nanopore. Proceedings of the National Academy of Sciences, 98 (23). pp. 12996-13001. ISSN 00278424

Hulme, A.T. and Johnston, A. and Florence, A.J. and Fernandes, P. and Shankland, K. and Bedford, C.T. and Welch, G.W.A. and Sadiq, G. and Haynes, D.A. and Motherwell, W.D.S. and Tocher, D.A. and Price, S.L. (2007) Search for a Predicted Hydrogen Bonding Motif - A Multidisciplinary Investigation into the Polymorphism of 3-Azabicyclo[3.3.1]nonane-2,4-dione. Journal of the American Chemical Society, 129 (12). pp. 3649-3657. ISSN 00027863

Hulme, A.T. and Price, S.L. and Tocher, D.A. (2005) A new polymorph of 5-fluorouracil found following computational crystal structure predictions. Journal of the American Chemical Society, 127 (4). pp. 1116-1117. ISSN 00027863

Hulme, A.T. and Tocher, D.A. (2006) The discovery of new crystal forms of 5-fluorocytosine consistent with the results of computational crystal structure prediction. Crystal Growth & Design, 6 (2). pp. 481-487. ISSN 15287483

Hyett, G. and Green, M. and Parkin, I.P. (2006) X-ray diffraction area mapping of preferred orientation and phase change in TiO2 thin films deposited by chemical vapor deposition. Journal of the American Chemical Society, 128 (37). pp. 12147-12155. ISSN 00027863

I

Ilag, L.L. and Videler, H. and McKay, A.R. and Sobott, F. and Fucini, P. and Nierhaus, F.H. and Robinson, C.V. (2005) Heptameric (L12)6/L10 rather than canonical pentameric complexes are found by tandem MS of intact ribosomes from thermophilic bacteria. Proceedings of the National Academy of Sciences, 102 (23). pp. 8192-8197. ISSN 00278424

Ilioudis, C.A. and Tocher, D.A. and Steed, J.W. (2004) A highly efficient, preorganized macrobicyclic receptor for halides based on CH··· and NH···anion interactions. Journal of the American Chemical Society, 126 (39). pp. 12395-12402. ISSN 00027863

Ingram, C.U. and Bommer, M. and Smith, M.E.B. and Dalby, P.A. and Ward, J.M. and Hailes, H.C. and Lye, G.J. (2007) One-pot synthesis of amino-alcohols using a de-novo transketolase and β-alanine: pyruvate transaminase pathway in escherichia coli. Biotechnology and Bioengineering, 96 (3). pp. 559-569. ISSN 00063592

Ioannou, M. and Porter, M.J. and Saez, F. (2002) A ring expansion reaction of 1,3-oxathiolanes. Chemical Communications (4). pp. 346-347. ISSN 13597345

Iqbal, Z. and McKendry, R. and Horton, M. and Caruana, D.J. (2007) Electrochemical modulation of sickle cell haemoglobin polymerisation. The Analyst, 132 (1). pp. 27-33. ISSN 00032654

J

Jacques, S.D.M. and Leynaud, O. and Strusevich, D. and Beale, A.M. and Sankar, G. and Martin, C.M. and Barnes, P. (2006) Redox behavior of Fe-Mo-O catalysts studied by ultrarapid in situ diffraction. Angewandte Chemie International Edition, 45 (3). pp. 445-448. ISSN 14337851

Jacques, S.D.M. and Pile, K. and Barnes, P. and Lai, X. and Roberts, K.J. and Williams, R.A. (2005) An in-situ synchrotron X-ray diffraction tomography study of crystallization and preferred crystal orientation in a stirred reactor. Crystal Growth & Design, 5 (2). pp. 395-397. ISSN 15287483

Jerome, L. (2009) The generation and reactivity of functionalised organozinc carbenoids for cyclopropane synthesis. Doctoral thesis, UCL (University College London) filefile

Johnson, M. and O'Connor, D. and Barnes, P. and Catlow, C.R.A. and Owens, S.L. and Sankar, G. and Bell, R. and Teat, S.J. and Stephenson, R. (2003) Cation exchange, dehydration, and calcination in clinoptilolite: in situ X-ray diffraction and computer modeling. The Journal of Physical Chemistry B, 107 (4). pp. 942-951. ISSN 15206106

Jonasson, L. (2009) Computational investigations of the electronic structure of molecular actinide compounds. Doctoral thesis, UCL (University College London) file

Jones, N. (2009) The spectroscopy of bound and predissociating Rydberg states of NO in external electric fields. Doctoral thesis, UCL (University College London) file

Jordan, E. and Bell, R.G. and Wilmer, D. and Koller, H. (2006) Anion-promoted cation motion and conduction in zeolites. Journal of the American Chemical Society, 128 (2). pp. 558-567. ISSN 00027863

K

Kaltsoyannis, N. and Rowley, D.M. (2002) Ab initio investigations of the potential energy surfaces of the XO + HO2 reaction (X = chlorine or bromine). Physical Chemistry Chemical Physics, 4 (3). pp. 419-427. ISSN 14639076

Kanai, Y. and Tilocca, A. and Selloni, A. and Car, R. (2004) First-principles string molecular dynamics: An efficient approach for finding chemical reaction pathways. The Journal of Chemical Physics, 121 (8). p. 3359. ISSN 00219606

Karamertzanis, P.G. and Price, S.L. (2005) Challenges of crystal structure prediction of diastereomeric salt pairs. The Journal of Physical Chemistry B, 109 (36). pp. 17134-17150. ISSN 15206106

Kato, Y. (2009) Studies towards novel aldolase mimics. Doctoral thesis, UCL (University College London) file

Kearney, D. and Price, S.D. (2003) Bond-forming and electron transfer reactions following collisions of CF22+ with H2X (X€‰=€‰O, S). Physical Chemistry Chemical Physics, 5 (8). pp. 1575-1583. ISSN 14639076

Kerridge, A. and Harker, A.H. and Stoneham, A.M. (2004) Quantum behaviour of hydrogen and muonium in vacancy-containing complexes in diamond. Journal of Physics Condensed Matter, 16 (47). pp. 8743-8751. ISSN 09538984

Kerridge, A. and Savory, S. and Harker, A.H. and Stoneham, A.M. (2006) Time dependent quantum simulations of two-qubit gates based on donor states in silicon. Journal of Physics Condensed Matter, 18 (21). S767-S776. ISSN 09538984

King, S.-J. (2009) Studies of the dissociation and energetics of gaseous ions. Doctoral thesis, UCL (University College London) file

Koudriachova, M.V. and de Leeuw, S.W. and Harrison, N.M. (2004) Orthorhombic distortion on Li intercalation in anatase. Physical Review B, 69 (5). 054106. ISSN 10980121

Koudriachova, M.V. and de Leeuw, S.W. and Harrison, N.M. (2003) A new phase of lithiated titania predicted from first principles. Chemical Physics Letters, 371 (1-2). pp. 150-156. ISSN 00092614

Koudriachova, M.V. and Harrison, N.M. and de Leeuw, S.W. (2002) Density-functional simulations of lithium intercalation in rutile. Physical Review B, 65 (23). p. 235423. ISSN 10980121

Koudriachova, M.V. and Harrison, N.M. and de Leeuw, S.W. (2001) Effect of diffusion on lithium intercalation in titanium dioxide. Physical Review Letters, 86 (7). pp. 1275-1278. ISSN 00319007

Krokowski, D. and Tchorzewski, M. and Boguszewska, A. and Mckay, A.R. and Maslen, S.L. and Robinson, C.V. and Grankowski, N. (2007) Elevated copy number of L-A virus in yeast mutant strains defective in ribosomal stalk. Biochemical and Biophysical Research Communications, 355 (2). pp. 575-580. ISSN 0006291X

L

Ladlow, M. and Legge, C.H. and Neudeck, T. and Pipe, A.J. and Sheppard, T. and Yang, L.L. (2003) Wavelength dependent photo-controlled differential release of compounds from solid phase resin. Chemical Communications (16). pp. 2048-2049. ISSN 13597345

Lafitte, V.G.H. and Aliev, A.E. and Horton, P.N. and Hursthouse, M.B. and Bala, K. and Golding, P. and Hailes, H.C. (2006) Quadruply hydrogen bonded cytosine modules for supramolecular applications. Journal of the American Chemical Society, 128 (20). pp. 6544-6545. ISSN 00027863

Lambert, N. and Kearney, D. and Kaltsoyannis, N. and Price, S.D. (2004) The bond-forming reactions of atomic dications with neutral molecules: formation of ArNH+ and ArN+ from collisions of Ar2+ with NH3. Journal of the American Chemical Society, 126 (11). pp. 3658-3663. ISSN 00027863

Lancaster, R.W. and Karamertzanis, P.G. and Hulme, A.T. and Tocher, D.A. and Covey, D.F. and Price, S.L. (2006) Racemic progesterone: predicted in silico and produced in the solid state. Chemical Communications (47). pp. 4921-4923. ISSN 13597345

Lewis, A.K.D.K. and Caddick, S. and Cloke, F.G.N. and Billingham, N.C. and Hitchcock, P.B. and Leonard, J. (2003) Synthetic, structural, and mechanistic studies on the oxidative addition of aromatic chlorides to a palladium (N-heterocyclic carbene) complex: relevance to catalytic amination. Journal of the American Chemical Society, 125 (33). pp. 10066-10073. ISSN 00027863

Lewis, A.K.D.K.. and Mok, B.J. and Tocher, D.A. and Wilden, J.D. and Caddick, S. (2006) New synthesis of β-sultams from pentafluorophenyl sulfonates. Organic Letters, 8 (24). pp. 5513-5515. ISSN 15237060

Lewis, T.C. and Tocher, D.A. and Price, S.L. (2005) Investigating unused hydrogen bond acceptors using known and hypothetical crystal polymorphism. Crystal Growth & Design, 5 (3). pp. 983-993. ISSN 15287483

Ley, S.V. and Dixon, D.J. and Guy, R.T. and Rodríguez, G.F. and Sheppard, T.D. (2005) Michael, Michael–aldol and Michael–Michael reactions of enolate equivalents of butane-2,3-diacetal protected glycolic acid derivatives. Organic & Biomolecular Chemistry, 3 (22). pp. 4095-4107. ISSN 14770520

Limb, A.J. and Bikondoa, O. and Muryn, C.A. and Thornton, G. (2007) Visualization of Complex-Anion Site Conversion on a Metal Oxide Surface. Angewandte Chemie International Edition, 46 (4). pp. 549-552. ISSN 14337851

Love, P.J. and Nekovee, M. and Coveney, P.V. and Chin, J. and González-Segredo, N. and Martin, J.M.R. (2003) Simulations of amphiphilic fluids using mesoscale lattice-Boltzmann and lattice-gas methods. Computer Physics Communications, 153 (3). p. 340. ISSN 00104655

Lupo, F. and Cockcroft, J.K. and Barnes, P. and Stukas, P. and Vickers, M. and Norman, C. and Bradshaw, H. (2004) Hydrothermal crystallisation of doped zirconia: An in situ X-ray diffraction study. Physical Chemistry Chemical Physics, 6 (8). pp. 1837-1841. ISSN 14639076

M

Macmillan, D. and Anderson, D.W. (2004) Rapid synthesis of acyl transfer auxiliaries for cysteine-free native glycopeptide ligation. Organic Letters, 6 (25). pp. 4659-4662. ISSN 15237060

Macmillan, D. and Arham, L. (2004) Cyanogen bromide cleavage generates fragments suitable for expressed protein and glycoprotein ligation. Journal of the American Chemical Society, 126 (31). pp. 9530-9531. ISSN 00027863

Macmillan, D. and Bertozzi, C.R. (2004) Modular assembly of glycoproteins: towards the synthesis of GlyCAM-1 by using expressed protein ligation. Angewandte Chemie International Edition, 43 (11). pp. 1355-1359. ISSN 14337851

Macmillan, D. and Blanc, J. (2006) A novel neoglycopeptide linkage compatible with native chemical ligation. Organic & Biomolecular Chemistry, 4 (15). pp. 2847-2850. ISSN 14770520

Mamak, M. and Métraux, G.S. and Petrov, S. and Coombs, N. and Ozin, G.A. and Green, M.A. (2003) Lanthanum strontium manganite/yttria-stabilized zirconia nanocomposites derived from a surfactant assisted, co-assembled mesoporous phase. Journal of the American Chemical Society, 125 (17). pp. 5161-5175. ISSN 00027863

Manning, T.D. and Parkin, I.P. and Pemble, M.E. and Sheel, D. and Vernardou, D. (2004) Intelligent window coatings: atmospheric pressure chemical vapor deposition of tungsten-doped vanadium dioxide. Chemistry of Materials, 16 (4). pp. 744-749. ISSN 08974756

Markusen, J.F. and Mason, C. and Hull, D.A. and Town, M.A. and Tabor, A.B. and Clements, M. and Boshoff, C.H. and Dunnill, A.P. (2006) Behavior of adult human mesenchymal stem cells entrapped in alginate-GRGDY beads. Tissue Engineering, 12 (4). pp. 821-830. ISSN 10763279

Marson, C.M. and Edaan, E. and Morrell, J.M. and Coles, S.J. and Hursthouse, M.B. and Davies, D.T. (2007) A catalytic asymmetric protocol for the enantioselective synthesis of 3(2H)-furanones. Chemical Communications (24). pp. 2494-2496. ISSN 13597345

Marson, C.M. and Melling, R.C. (2005) Enantioselective syntheses of trans-3,4-difluoropyrrolidines and investigation of their applications in catalytic asymmetric synthesis. The Journal of Organic Chemistry, 70 (24). pp. 9771-9779. ISSN 00223263

Marson, C.M. and Pink, J.H. and Hall, D. and Hursthouse, M.B. and Malik, A. and Smith, C. (2003) An asymmetric synthesis of aza analogues of the tricyclic skeleton of daphnane and the ABC ring system of phorbol. The Journal of Organic Chemistry, 68 (3). pp. 792-798. ISSN 00223263

Marson, C.M. and Savy, P. and Rioja, A.S. and Mahadevan, T. and Mikol, C. and Veerupillai, A. and Nsubuga, E. and Chahwan, A. and Joel, S.P. (2006) Aromatic sulfide inhibitors of histone deacetylase based on arylsulfinyl-2,4-hexadienoic acid hydroxyamides. Journal of Medicinal Chemistry, 49 (2). pp. 800-805. ISSN 00222623

Martin, H. and Kinns, H. and Mitchell, N. and Astier, Y. and Madathil, R. and Howorka, S. (2007) Nanoscale protein pores modified with PAMAM dendrimers. Journal of the American Chemical Society, 129 (31). pp. 9640-9649. ISSN 00027863

McKay, A.R. and Ruotolo, B.T. and Ilag, L.L. and Robinson, C.V. (2006) Mass measurements of increased accuracy resolve heterogeneous populations of intact ribosomes. Journal of the American Chemical Society, 128 (35). pp. 11433-11442. ISSN 00027863

McMillan, P.F. (2002) New materials from high-pressure experiments. Nature Materials, 1 (1). pp. 19-25. ISSN 14761122

McMillan, P.F. and Wilson, M. and Daisenberger, D. and Machon, D. (2005) A density-driven phase transition between semiconducting and metallic polyamorphs of silicon. Nature Materials, 4 (9). pp. 680-684. ISSN 14761122

McNamara, L.M.A. and Andrews, M.J.I. and Mitzel, F. and Siligardi, G. and Tabor, A.B. (2001) Peptides constrained by an aliphatic linkage between two C sites: design, synthesis, and unexpected conformational properties of an i,(i + 4)-linked peptide. The Journal of Organic Chemistry, 66 (13). pp. 4585-4594. ISSN 00223263

Mellot-Draznieks, C. and Dutour , J. and Férey, G. (2004) Hybrid organic-inorganic frameworks: routes for computational design and structure prediction. Angewandte Chemie International Edition, 43 (46). pp. 6290-6296. ISSN 14337851

Minns, R.S. and Patel, R. and Verlet, J.R.R,. and Fielding, H.H. (2003) Optical control of the rotational angular momentum of a molecular Rydberg wave packet. Physical Review Letters, 91 (24). p. 243601. ISSN 00319007

Minns, R.S. and Verley, J.R.R. and Watkins, L.J. and Fielding , H.H. (2003) Observation and control of dissociating and autoionizing Rydberg electron wave packets in NO. The Journal of Chemical Physics, 119 (12). pp. 5842-5847. ISSN 00219606 file

Mirebeau, I. and Goncharenko, I.N. and Cadavez-Peres, P. and Bramwell, S.T. and Gingras, M.J.P. and Gardner, J.S. (2002) Pressure-induced crystallization of a spin liquid. Nature, 420 (6911). pp. 54-57. ISSN 00280836

Mok, B.L. (2008) Synthesis of functionalised sulfonamides. Doctoral thesis, UCL (University College London)

Mora-Fonz, M.J. and Catlow, C.R.A. and Lewis, D.W. (2005) Oligomerization and cyclization processes in the nucleation of microporous silicas. Angewandte Chemie International Edition, 44 (20). pp. 3082-3086. ISSN 14337851

Motherwell, W.B. and Atkinson, C.E. and Aliev, A.E. and Wong, S.Y.F. and Warrington, B.H. (2004) A simple protocol for the modular assembly of“Millipede” artificial enzymes. Angewandte Chemie International Edition, 43 (10). pp. 1225-1228. ISSN 14337851

Motherwell, W.B. and Moïse, J. and Nic, M. and Coles, S.J. and Horton, P.N. and Hursthouse, M.B. and Chessari, G. and Hunter, C.A. and Vinter, J.G. and Aliev, A.E. (2007) Noncovalent functional-group–arene interactions. Angewandte Chemie, 119 (41). pp. 7969-7972. ISSN 00448249

Motherwell, W.B. and Storey, L.J. (2005) Some studies on nucleophilic trifluoromethylation using the shelf-stable trifluoromethylacetophenone- N,N-dimethyltrimethylsilylamine adduct. Journal of Fluorine Chemistry, 126 (4). pp. 489-496. ISSN 00221139

Mukerji, R.J. and Bolina, A.S. and Brown, W.A. (2003) The influence of steps on the dissociation of NO on Pt surfaces: temperature-programmed desorption studies of NO adsorption on Pt{211}. The Journal of Chemical Physics, 119 (20). pp. 10844-10852. ISSN 00219606

Mustapa, M.F.M. and Bell, P.C. and Hurley, C.A. and Nicol, A. and Guénin, E. and Writer, M.J. and Barker, S.E. and Wong, J.B. and Pilkington-Miksa, M.A. and Papahadjopoulos-Sternberg, B. and Shamlou, P.A. and Hailes, H.C. and Hart, S.L. and Zicha, D. and Tabor, A.B. and Sarkar, S. (2007) Biophysical characterization of an integrin-targeted lipopolyplex gene delivery vector. Biochemistry, 46 (45). pp. 12930-12944. ISSN 00062960

Mustapa, M.F.M. and Harris, R. and Bulic-Subanovic, N. and Elliott, S.L. and Bregant, S. and Groussier, M.F.A. and Mould, J. and Schultz, D. and Chubb, N.A.L. and Gaffney, P.R.J. and Driscoll, P.C. and Tabor, A.B. (2003) Synthesis of orthogonally protected lanthionines. The Journal of Organic Chemistry, 68 (21). pp. 8185-8192. ISSN 00223263

N

Nandra, G.S. and Pang, P.S. and Porter, M.J. and Elliott, J.M. (2005) Synthesis of vinylogous carbamates by rhodium(II)-catalyzed olefination of tertiary formamides with a silylated diazoester. Organic Letters, 7 (16). pp. 3453-3455. ISSN 15237060

Narband, N. (2009) Nanoparticles and photosensitisers; their interactions and antibacterial properties. Doctoral thesis, UCL (University College London) file

Nekovee, M. and Coveney, P.V. (2001) Lattice-Boltzmann simulations of self-assembly of a binary water-surfactant system into ordered bicontinuous cubic and lamellar phases. Journal of the American Chemical Society, 123 (49). pp. 12380-12382. ISSN 00027863

Nekovee, M. and Foulkes, W.M.C. and Needs, R.J. (2001) Quantum Monte Carlo analysis of exchange and correlation in the strongly inhomogeneous electron gas. Physical Review Letters, 87 (3). 036401. ISSN 00319007

Nguyen, K.D.H. (2008) Framework redox sites in nanoporous molecular sieve catalyst. Doctoral thesis, UCL (University College London)

Nowell, H. and Butchart, B. and Coombes, D.S. and Price, S.L. and Emmerich, W. and Catlow, C.R.A. (2004) Increasing the scope for polymorph prediction using e-Science. In: Proceedings of the 2004 UK E-Science All Hands Meeting, Nottingham, UK. UK Engineering and Physical Science Research Council, pp. 968-971. file

O

O'Brien, M.G. and Sanchez-Sanchez, M. and Beale, A.M. and Lewis, D.W. and Sankar, G. and Catlow, C.R.A. (2007) Effect of organic templates on the kinetics and crystallization of microporous metal-substituted aluminophosphates. Journal of Physical Chemistry C, 111 (45). pp. 16951-16961. ISSN 19327447

O'Grady, E. and Kaltsoyannis, N. (2004) Does metallophilicity increase or decrease down group 11? Computational investigations of [Cl–M–PH3]2 (M = Cu, Ag, Au, [111]). Physical Chemistry/ Chemical Physics, 6 (4). pp. 680-687. ISSN 14639076

P

Page, K. (2009) Photocatalytic thin films: their characterisation and antimicrobial properties. Doctoral thesis, UCL (University College London) file

Page, K. and Palgrave, R.G. and Parkin, I.P. and Wilson, M. and Savin, S.L.P. and Chadwick, A.V. (2007) Titania and silver-titania composite films on glass-potent antimicrobial coatings. Journal of Materials Chemistry, 17 (1). pp. 95-104. ISSN 09599428

Palgrave, R.G. and Parkin, I.P. (2006) Aerosol assisted chemical vapor deposition using nanoparticle precursors: a route to nanocomposite thin films. Journal of the American Chemical Society, 128 (5). pp. 1587-1597. ISSN 00027863

Pang, P.S. (2008) Studies towards the synthesis of the core of Sarains A, B, & C. Doctoral thesis, UCL (University College London) file

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) file

Partap, S. and Rehman, I. and Jones, J.R. and Darr, J.A. (2006) “Supercritical carbon dioxide in water” emulsion-templated synthesis of porous calcium alginate hydrogels. Advanced Materials, 18 (4). pp. 501-504. ISSN 09359648

Patel, R and Jones, N.J.A. and Fielding, H.H. (2007) Rotational-state-selective field ionization of molecular Rydberg states. Physical Review A, 76 (4). 043413-043413. ISSN 10502947

Perkin, S. and Chai, L. and Kampf, N. and Raviv, U. and Briscoe, W. and Dunlop, I. and Titmuss, S. and Seo, M. and Kumacheva, E. and Klein, J. (2006) Forces between mica surfaces, prepared in different ways, across aqueous and nonaqueous liquids confined to molecularly thin films. Langmuir, 22 (14). pp. 6142-6152. ISSN 07437463

Perkin, S. and Kampf, N. and Klein, J. (2006) Long-range attraction between charge-mosaic surfaces across water. Physical Review Letters, 96 (3). 038301. ISSN 00319007

Perkin, S. and Kampf, N. and Klein, J. (2005) Stability of self-assembled hydrophobic surfactant layers in water. The Journal of Physical Chemistry B, 109 (9). pp. 3832-3837. ISSN 15206106

Peroos, S. and Du, Z. and de Leeuw, N.H. (2006) A computer modelling study of the uptake, structure and distribution of carbonate defects in hydroxy-apatite. Biomaterials, 27 (9). pp. 2150-2161. ISSN 01429612

Phillips, M.J. and Duncanson, P. and Wilson, K. and Darr, J.A. and Griffiths, D.V. and Rehman, I. (2005) Surface modification of bioceramics by grafting of tailored allyl phosphonic acid. Advances in Applied Ceramics, 104 (5). pp. 261-267. ISSN 17436753 file

Plet, J.R.H. and Porter, M.J. (2006) Synthesis of the bicyclic core of tagetitoxin. Chemical Communications (11). pp. 1197-1199. ISSN 13597345

Pogorzelec, P.J. and Reid, D.H. and Tocher, D.A. and Wilton-Ely, J.D.E.T. (2004) Pyrrole thioaldehyde complexes of nickel, palladium and platinum. Z. Naturforsch, 59b . pp. 1372-1378.

Poole, A. and Wills, A.S. and Lelievre-Berna, E. (2007) Magnetic ordering in the XY pyrochlore antiferromagnet Er2Ti2O7 a spherical neutron polarimetry study. Journal of Physics Condensed Matter, 19 (45). p. 452201. ISSN 09538984

Porter, M.J. and Saez, F. and Sandhu, A.K. (2006) Direct conversion of tert-butyl 2-hydroxyalkyl sulfides to 1,3-oxathiolanes. Tetrahedron, 62 (5). pp. 931-936. ISSN 00404020

Q

Quesada Cabrera, R. (2009) Molecular solids at high pressure. Doctoral thesis, UCL (University College London)

R

Raviv, U. and Perkin, S. and Laurat, P. and Klein, J. (2004) Fluidity of water confined down to subnanometer films. Langmuir, 20 (13). pp. 5322-5332. ISSN 07437463

Rennie, A.R. and Barè, S. and Cockcroft, J.K. and Jupe, A.C. (2006) Characterization of the flow of anisotropic colloidal particles using energy-dispersive X-ray diffraction. Journal of Colloid and Interface Science, 293 (2). pp. 475-482. ISSN 00219797

Russo, M.R. and Kaltsoyannis, N. and Sella, A. (2002) Are metal alkoxides linear owing to electrostatic repulsion? Chemical Communications (20). pp. 2458-2459. ISSN 13597345

S

Sabry-Grant, R. and Vickers, M. and Cockcroft, J.K. (2007) A detailed study of the variation in lattice parameter and structure with temperature and dilution in yttrium-substituted holmium hexachloro-elpasolite Cs2NaYxHo1Cl6. Zeitschrift für Kristallographie, 222 (7). pp. 356-364. ISSN 00442968

Schlapak, R. and Pammer, P. and Armitage, D. and Zhu, R. and Hinterdorfer, P. and Vaupel, M. and Frühwirth, T. and Howorka, S. (2006) Glass surfaces grafted with high-density poly(ethylene glycol) as substrates for DNA oligonucleotide microarrays. Langmuir, 22 (1). pp. 277-285. ISSN 07437463

Scott, D. (2008) The discovery of new functional oxides using combinatorial techniques and advanced data mining algorithms. Doctoral thesis, UCL (University College London) file

Scott, R.W.J. and Yang, S.M. and Chabanis, G. and Coombs, N. and Williams, D.E. and Ozin, G.A. (2001) Tin dioxide opals and inverted opals: near-ideal microstructures for gas sensors. Advanced Materials, 13 (19). pp. 1468-1472. ISSN 09359648

Scott, R.W.J. and Yang, S.M. and Coombs, N. and Ozin, G.A. and Williams, D.E. (2003) Engineered sensitivity of structured tin dioxide chemical sensors: opaline architectures with controlled necking. Advanced Functional Materials, 13 (3). pp. 225-231. ISSN 1616301X

Serre, C. and Bourrelly, S. and Vimont, A. and Ramsahye, N.A. and Maurin, G. and Llewellyn, P.L. and Daturi, M. and Filinchuk, Y. and Leynaud, O. and Barnes, P. and Férey, G. (2007) An explanation for the very large breathing effect of a metal–organic framework during CO2 adsorption. Advanced Materials, 19 (17). pp. 2246-2251. ISSN 09359648

Serre, C. and Mellot-Draznieks, C. and Surblé, S. and Audebrand, N. and Filinchuk, Y. and Férey, G. (2007) Role of solvent-host interactions that lead to very large swelling of hybrid frameworks. Science, 315 (5820). pp. 1828-1831. ISSN 00368075

Shang, C.X. and Guo, Z.X. (2004) Effect of carbon on hydrogen desorption and absorption of mechanically milled MgH2. Journal of Power Sources, 129 (1). pp. 73-80. ISSN 03787753

Shiju, N.R. and Fiddy, S. and Sonntag, O. and Stockenhuber, M. and Sankar, G. (2006) Selective oxidation of benzene to phenol over FeAlPO catalysts using nitrous oxide as oxidant. Chemical Communications (47). pp. 4955-4957. ISSN 13597345

Slater, B. and Catlow, C.R.A. and Liu, Z. and Ohsuna, T. and Terasaki, O. and Camblor, M.A. (2002) Surface structure and crystal growth of zeolite beta C. Angewandte Chemie International Edition, 41 (7). pp. 1235-1237. ISSN 14337851

Smith, M.E.B. and Hibbert, E.G. and Jones, A.B. and Dalby, P.A. and Hailes, H.C. (2008) Enhancing and reversing the stereoselectivity of Escherichia coli transketolase via single-point mutations. Advanced Synthesis and Catalysis, 350 (16). pp. 2631-2638. ISSN 16154150

Smith, M.E.B. and Smithies, K. and Senussi, T. and Dalby, P.A. and Hailes, H.C. (2006) The first mimetic of the transketolase reaction. European Journal of Organic Chemistry, 2006 (5). pp. 1121-1123. ISSN 1434193X

Soignard, E. and Machon, D. and McMillan, P.F. and Dong, J. and Xu, B. and Leinenweber, K. (2005) Spinel-structured gallium oxynitride (Ga3O3N) synthesis and characterization: an experimental and theoretical study. Chemistry of Materials, 17 (22). pp. 5465-5472. ISSN 08974756

Song, Y. and Guo, Z.X. and Yang, R. (2004) Influence of selected alloying elements on the stability of magnesium dihydride for hydrogen storage applications: a first-principles investigation. Physical Review B, 69 (9). 094205. ISSN 10980121

Song, Y. and Singh, R. and Guo, Z.X. (2006) A first-principles study of the electronic structure and stability of a lithium aluminum hydride for hydrogen storage. The Journal of Physical Chemistry B, 110 (13). pp. 6906-6910. ISSN 15206106

Stewart, J.R. and Ehlers, G. and Wills, A.S. and Bramwell, S.T. and Gardner, J.S. (2004) Phase transitions, partial disorder and multi-k structures in Gd2Ti2O7. Journal of Physics Condensed Matter, 16 (28). L321-L326. ISSN 09538984

Stone, D. and Rowley, D.M. (2005) Kinetics of the gas phase HO2 self-reaction: Effects of temperature, pressure, water and methanol vapours. Physical Chemistry Chemical Physics, 7 (10). pp. 2156-2163. ISSN 14639076

Suter, J.L. and Coveney, P.V. and Greenwell, H.C. and Thyveetil, M.-A. (2007) Large-scale molecular dynamics study of Montmorillonite clay: emergence of undulatory fluctuations and determination of material properties. Journal of Physical Chemistry C, 111 (23). pp. 8248-8259. ISSN 19327447

T

Tang, X. and Dong, J. and Hutchins, P. and Shebanova, O. and Gynko, J. and Barnes, P. and Cockcroft, J.K. and Vickers, M. and McMillan, P.F. (2006) Thermal properties of Si_{136}: theoretical and experimental study of the type-II clathrate polymorph of Si. Physical Review B, 74 (1). 014109. ISSN 10980121

Targett, J.J. (2009) The polymorphs and solvates of phenylbutazone and their phase transition behaviour. Masters thesis, UCL (University College London) file

Thominet, O. and Baker, J.R. and Britton, H. and Etheridge, Z.C. and Soscia, M.G. and Caddick, S. (2007) Synthetic strategies to epoxydiynes and a key synthon of the neocarzinostatin chromophore. Organic & Biomolecular Chemistry, 5 (22). pp. 3703-3712. ISSN 14770520

Thyveetil, M.-A. (2008) Large-scale simulations of layered double hydroxide nanocomposite materials. Doctoral thesis, UCL (University College London)

Tilocca, A. and Cormack, A.N. and de Leeuw, N.H. (2007) The structure of bioactive silicate glasses: new insight from molecular dynamics simulations. Chemistry of Materials, 19 (1). pp. 95-103. ISSN 08974756

Titcomb, L.R. and Caddick, S. and Cloke, F.G.N. and Wilson, D.J. and McKerrecher, D. (2001) Unexpected reactivity of two-coordinate palladium–carbene complexes; synthetic and catalytic implications. Chemical Communications (15). pp. 1388-1389. ISSN 13597345

Tranchant, I. and Herve, A.-C. and Carlisle, S. and Lowe, K.J. and Slevin, C.J. and Forssten, C. and Dilleen, J. and Williams, D.E. and Tabor, A.B. and Hailes, H.C. (2006) Design and synthesis of ferrocene probe molecules for detection by electrochemical methods. Organic Biomolecular Chemistry, 17 (5). pp. 1256-1264. ISSN 10431802

Tribello, G.A. and Slater, B. (2006) Proton ordering energetics in ice phases. Chemical Physics Letters, 425 (4-6). pp. 246-250. ISSN 00092614

Tribello, G.A. and Slater, B. and Salzmann, C.G. (2006) A blind structure prediction of ice XIV. Journal of the American Chemical Society, 128 (39). pp. 12594-12595. ISSN 00027863

U

Urbaniak, M.D. and Bingham, J.P. and Hartley, J.A. and Woolfson, D.N. and Caddick, S. (2004) Design and synthesis of a nitrogen mustard derivative stabilized by apo-neocarzinostatin. Journal of Medicinal Chemistry, 47 (19). pp. 4710-4715. ISSN 00222623

V

Vallance, P. and Bush, H.D. and Mok, B.J. and Hurtado-Guerrero, R. and Gill, H. and Rossiter, S. and Wilden, J.D. and Caddick, S. (2005) Inhibition of dimethylarginine dimethylaminohydrolase (DDAH) and arginine deiminase (ADI) by pentafluorophenyl (PFP) sulfonates. Chemical Communications (44). pp. 5563-5565. ISSN 13597345

Verlet, J.R.R. and Stavros, V.G. and Minns, R.S. and Fielding, H.H. (2002) Controlling the angular momentum composition of a Rydberg electron wave packet. Physical Review Letters, 89 (26). p. 263004. ISSN 00319007

Videler, H. and Ilag, L.L. and McKay, A.R. and Hanson, C.L. and Robinson, C.V. (2005) Mass spectrometry of intact ribosomes. FEBS Letters, 579 (4). pp. 943-947. ISSN 00145793

W

Walker, A. and Woodley, S. and Slater, B. and 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. ISSN 00319201 file

Walker, A.M. and Slater, B. and Gale, J.D. and Wright, K. (2004) Predicting the structure of screw dislocations in nanoporous materials. Nature Materials, 3 (10). pp. 715-720. ISSN 14761122

Wander, A. and Schedin, F. and Steadman, P. and Norris, A. and McGrath, R. and Turner, T.S. and Thornton, G. and Harrison, N.M. (2001) Stability of Polar Oxide Surfaces. Physical Review Letters, 86 (17). p. 3811. ISSN 00319007

Wang, J. and Evans, J.R.G. (2006) Segregation in multicomponent ceramic colloids during drying of droplets. Physical Review E, 73 (2). 021501. ISSN 15393755

Weng, X. and Boldrin, P. and Abrahams, I. and Skinner, S.J. and Darr, J.A. (2007) Direct syntheses of mixed ion and electronic conductors La4Ni3O10 and La3Ni2O7 from nanosized coprecipitates. Chemistry of Materials, 19 (18). pp. 4382-4384. ISSN 08974756

White, C.L.I.M. and Ruiz-Salvador, A.R. and Lewis, D.W. (2004) Pressure-induced hydration effects in the zeolite laumontite. Angewandte Chemie International Edition, 43 (4). pp. 469-472. ISSN 14337851

Wieble, C.R. and Gardner, J.S. and Kim, S.-J. and Luke, G.M. and Wills, A.S. and Gaulin, D.B. and Greedan, J.E. and Swainson, I. and Qiu, Y. and Jones, C.Y. (2004) Magnetic ordering in the spin-ice candidate Ho{2}Ru{2}O{7}. Physical Review Letters, 93 (7). 076403. ISSN 00319007

Wilden, J.D. and Geldeard, L. and Lee, C.C. and Judd, D.B. and Caddick, S. (2007) Trichlorophenol (TCP) sulfonate esters: A selective alternative to pentafluorophenol (PFP) esters and sulfonyl chlorides for the preparation of sulfonamides. Chemical Communications (10). pp. 1074-1076. ISSN 13597345

Wilden, J.D. and Judd, D.B. and Caddick, S. (2005) Rate enhancement of PFP sulfonate ester aminolysis by chloride salts in organic and aqueous media. Tetrahedron Letters, 46 (44). p. 7637. ISSN 00404039

Willitsch, S. and Hollenstein, U. and Merkt, F. (2004) Ionization from a double bond: rovibronic photoionization dynamics of ethylene, large amplitude torsional motion and vibronic coupling in the ground state of C[sub 2]H[sub 4][sup +]. The Journal of Chemical Physics, 120 (4). pp. 1761-1774. ISSN 00219606

Willitsch, S. and Innocenti, F. and Dyke, J.M. and Merkt, F. (2005) High-resolution pulsed-field-ionization zero-kinetic-energy photoelectron spectroscopic study of the two lowest electronic states of the ozone cation O[sub 3][sup +]. The Journal of Chemical Physics, 122 (2). 024311. ISSN 00219606

Willitsch, S. and Jungen, Ch. and Merkt, F. (2006) Bending energy level structure and quasilinearity of the X̃[sup +] [sup 3]B[sub 1] ground electronic state of NH[sub 2][sup +]. The Journal of Chemical Physics, 124 (20). p. 204312. ISSN 00219606

Willitsch, S. and Merkt, F. (2003) Characterization of the X-tilde [sup 2]A[sub 1] (0,0 ,0) ground vibronic state of CH[sub 2][sup +] by pulsed-field-ionization zero-kinetic-energy photoelectron spectroscopy. The Journal of Chemical Physics, 118 (5). pp. 2235-2241. ISSN 00219606

Wills, A.S. (2001) Long-range ordering and representational analysis of the jarosites. Physical Review B, 63 (6). 064430. ISSN 10980121

Wills, A.S. and Zhitomirsky, M.E. and Canals, B. and Sanchez, J.P. and Bonville, P. and de Reotier, P.D. and Yaouanc, A. (2006) Magnetic ordering in Gd2Sn2O7 the archetypal Heisenberg pyrochlore antiferromagnet. Journal of Physics Condensed Matter, 18 (3). L37-L42. ISSN 09538984

Wilton-Ely, J. D. E. T. and Honarkhah, S. and Wang, M. and Tocher, D.A. and Slawin, A.M.Z. (2005) α-Organyl complexes of ruthenium and osmium supported by a mixed-donor ligand. Dalton Transactions (11). pp. 1930-1939. ISSN 14779226 file

Wilton-Ely, J. D. E. T. and Pogorzelec, P.J. and Honarkhah, S. and Reid, D.H. and Tocher, D.A. (2005) Mixed-Donor Ligands: Pyrrolecarbaldehyde and Pyrrolecarbothioaldehyde σ-Organyl Complexes of Ruthenium(II) and Osmium(II). Organometallics, 2005, 24, 2862, 24 (12). pp. 2862-2874. ISSN 02767333

Wilton-Ely, J. D. E. T. and Wang, M. and Honarkhah, S. and Tocher, D.A. (2005) Ruthenium hydride and vinyl complexes supported by nitrogen–oxygen mixed-donor ligands. Inorganica Chimica Acta, 358 (11). p. 3218. ISSN 00201693

Wolff, A.J. and Carlstedt, C. and Brown, W.A. (2007) Studies of binary layered CH3OH/H2O ices adsorbed on a graphite surface. Journal of Physical Chemistry C, 111 (16). pp. 5990-5999. ISSN 19327447

Y

Yang, S. and Evans, J.R.G. (2005) On the rate of descent of powder in a vibrating tube. Philosophical Magazine, 85 (10). pp. 1089-1109. ISSN 14786435

Z

Zhao, Y.H. and Le, J. and Abraham, M.H. and Hersey, A. and Eddershaw, P.J. and Luscombe, C.N. and Boutina, D. and Beck, G. and Sherborne, B. and Cooper, I. and Platts, J.A. (2001) Evaluation of human intestinal absorption data and subsequent derivation of a quantitative structure-activity relationship (QSAR) with the Abraham descriptors. Journal of Pharmaceutical Sciences, 90 (6). pp. 749-784. ISSN 00223549

Zwijnenburg, M.A. and Corà, F. and Bell, R.G. (2007) Dramatic differences between the energy landscapes of SiO2 and SiS2 zeotype materials. Journal of the American Chemical Society, 129 (42). pp. 12588-12589. ISSN 00027863

This list was generated on Sun Mar 21 04:30:05 2010 GMT.