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Number of items: 380.

A

A Zwijnenburg, M and Corà, F and G Bell, R (2007) Observation of the effect of chemical composition on framework-typepreference. Studies in Surface Science and Catalysis , 170 (B) 1705 - 1711.

Ackermann, W and Asova, G and Ayvazyan, V and Azima, A and Baboi, N and Bahr, J and Balandin, V and Beutner, B and Brandt, A and Bolzmann, A and Brinkmann, R and Brovko, OI and Castellano, M and Castro, P and Catani, L and Chiadroni, E and Choroba, S and Cianchi, A and Costello, JT and Cubaynes, D and Dardis, J and Decking, W and Delsim-Hashemi, H and Delserieys, A and Di Pirro, G and Dohlus, M and Dusterer, S and Eckhardt, A and Edwards, HT and Faatz, B and Feldhaus, J and Flottmann, K and Frisch, J and Frohlich, L and Garvey, T and Gensch, U and Gerth, C and Gorler, M and Golubeva, N and Grabosch, HJ and Grecki, M and Grimm, O and Hacker, K and Hahn, U and Han, JH and Honkavaara, K and Hott, T and Huning, M and Ivanisenko, Y and Jaeschke, E and Jalmuzna, W and Jezynski, T and Kammering, R and Katalev, V and Kavanagh, K and Kennedy, ET and Khodyachykh, S and Klose, K and Kocharyan, V and Korfer, M and Kollewe, M and Koprek, W and Korepanov, S and Kostin, D and Krassilnikov, M and Kube, G and Kuhlmann, M and Lewis, CLS and Lilje, L and Limberg, T and Lipka, D and Lohl, F and Luna, H and Luong, M and Martins, M and Meyer, M and Michelato, P and Miltchev, V and Moller, WD and Monaco, L and Muller, WFO and Napieralski, O and Napoly, O and Nicolosi, P and Nolle, D and Nunez, T and Oppelt, A and Pagani, C and Paparella, R and Pchalek, N and Pedregosa-Gutierrez, J and Petersen, B and Petrosyan, B and Petrosyan, G and Petrosyan, L and Pfluger, J and Plonjes, E and Poletto, L and Pozniak, K and Prat, E and Proch, D and Pucyk, P and Radcliffe, P and Redlin, H and Rehlich, K and Richter, M and Roehrs, M and Roensch, J and Romaniuk, R and Ross, M and Rossbach, J and Rybnikov, V and Sachwitz, M and Saldin, EL and Sandner, W and Schlarb, H and Schmidt, B and Schmitz, M and Schmuser, P and Schneider, JR and Schneidmiller, EA and Schnepp, S and Schreiber, S and Seidel, M and Sertore, D and Shabunov, AV and Simon, C and Simrock, S and Sombrowski, E and Sorokin, AA and Spanknebel, P and Spesyvtsev, R and Staykov, L and Steffen, B and Stephan, F and Stulle, F and Thom, H and Tiedtke, K and Tischer, M and Toleikis, S and Treusch, R and Trines, D and Tsakov, I and Vogel, E and Weiland, T and Weise, H and Wellhoffer, M and Wendt, M and Will, I and Winter, A and Wittenburg, K and Wurth, W and Yeates, P and Yurkov, MV and Zagorodnov, I and Zapfe, K (2007) Operation of a free-electron laser from the extreme ultraviolet to the water window. NAT PHOTONICS , 1 (6) 336 - 342. 10.1038/nphoton.2007.76.

Adam, FI and Hogarth, G and Richards, I (2007) Models of the iron-only hydrogenase: Reactions of [Fe-2(CO)(6)(mu-pdt)] with small bite-angle diphosphines yielding bridge and chelate diphosphine complexes [Fe-2(CO)(4)(diphosphine)(mu-pdt)]. J ORGANOMET CHEM , 692 (18) 3957 - 3968. 10.1016/j.jorganchem.2007.05.050.

Adam, FI and Hogarth, G and Richards, I and Sanchez, BE (2007) Models of the iron-only hydrogenase: Structural studies of chelating diphosphine complexes [Fe-2(CO)(4)(mu-pdt)(kappa P-2,P '-diphosphine)]. DALTON T (24) 2495 - 2498. 10.1039/b706123b.

Aguey-Zinsou, KF and Yao, JH and Guo, ZX (2007) Reaction paths between LiNH2 and LiH with effects of nitrides. The Journal of Physical Chemistry B , 111 (43) 12531 - 12536. 10.1021/jp075002l.

Alfredsson, M and Cora, F and Dobson, DP and Davy, J and Brodholt, JP and Parker, SC and Price, GD (2007) Dopant control over the crystal morphology of ceramic materials. SURF SCI , 601 (21) 4793 - 4800. 10.1016/j.suse.2007.07.025.

Aliev, AE and Courtier-Murias, D (2007) Conformational analysis of L-prolines in water. J PHYS CHEM B , 111 (50) 14034 - 14042. 10.1021/jp076729c.

Aliev, AE and Law, RV (2007) Solid-state NMR spectroscopy. In: Nuclear Magnetic Resonance, vol 36. (196 - 243). The Royal Society of Chemistry

Anastasi, C and Buchet, FF and Crowe, MA and Parkes, AL and Powner, MW and Smith, JM and Sutherland, JD (2007) RNA: prebiotic product, or biotic invention? Chem Biodivers , 4 (4) 721 - 739. 10.1002/cbdv.200790060.

Anderson, JC and Chapman, HA (2007) Regiochemical switching of Mitsunobu cyclisation mode of vicinal diamines with pendant hydroxyl group. ORG BIOMOL CHEM , 5 (15) 2413 - 2422. 10.1039/b705081j.

Armstrong, JP and Hurst, C and Jones, RG and Licence, P and Lovelock, KRJ and Satterley, CJ and Villar-Garcia, IJ (2007) Vapourisation of ionic liquids. PHYS CHEM CHEM PHYS , 9 (8) 982 - 990. 10.1039/b615137j.

Ashraf, S and Binions, R and Blackman, CS and Parkin, IP (2007) The APCVD of tungsten oxide thin films from reaction of WCl6 with ethanol and results on their gas-sensing properties. POLYHEDRON , 26 (7) 1493 - 1498. 10.1016/j.poly.2006.11.017.

Ashraf, S and Blackman, CS and Palgrave, RG and Naisbitt, SC and Parkin, IP (2007) Aerosol assisted chemical vapour deposition of WO3 thin films from tungsten hexacarbonyl and their gas sensing properties. J MATER CHEM , 17 (35) 3708 - 3713. 10.1039/b705166b.

Ashraf, S and Blackman, CS and Palgrave, RG and Parkin, IP (2007) Aerosol-assisted chemical vapour deposition of WO3 thin films using polyoxometallate precursors and their gas sensing properties. J MATER CHEM , 17 (11) 1063 - 1070. 10.1039/b617982g.

Astier, Y and Kainov, DE 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) 2189 - 2194. 10.1002/cphc.200700179.

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. 10.1002/cphc.200700179.

B

Baganz, F and Chen, B and Dalby, P and Hibbert, E and Lye, G and Micheletti, M and Woodley, J and Kaulmann, U and Ward, J and Hailes, H and Smith, M and Smithies, K (2007) Accelerating biocatalytic process design: Integrating new tools from biology, chemistry and engineering. JOURNAL OF BIOTECHNOLOGY , 131 (2) S78 - S78.

Baganz, F and Chen, BH and Dalby, PA and Hailes, HC and Hibbert, E and Kaulmann, U and Lye, GJ and Micheletti, M and Smith, MEB and Smithies, K and Ward, JM and and Woodley, JM (2007) Accelerating biocatalytic process design: Integrating new tools from biology, chemistry and engineering. In: (Proceedings) Biochemical Engineering XV.

Baker, JR and Thominet, O and Britton, H and Caddick, S (2007) An efficient synthesis of epoxydiynes and a key fragment of neocarzinostatin chromophore. ORG LETT , 9 (1) 45 - 48. 10.1021/ol062461g.

Baker, JR and Woolfson, DN and Muskett, FW and Stoneman, RG and Urbaniak, MD and Caddick, S (2007) Protein-small molecule interactions in neocarzinostatin, the prototypical enediyne chromoprotein antibiotic. CHEMBIOCHEM , 8 (7) 704 - 717. 10.1002/cbic.200600534.

Bala, K and Hailes, HC and Lafitte, VGH and Aliev, A and Golding, P (2007) Supramolecular Polymers Prepared Starting from Hydrogen Bonded Cytosine-Based Modules. 2007072000.

Banks, ST and Clary, DC (2007) Reduced dimensionality quantum dynamics of Cl+CH4 -> HCl+CH3 on an ab initio potential. PHYS CHEM CHEM PHYS , 9 (8) 933 - 943. 10.1039/b615460c.

Barrett, AGM and Crimmin, MR and Hill, MS and Hitchcock, PB and Procopiou, PA (2007) Reactions of beta-diketiminate-stabilized calcium amides with 9-borabicyclo[3.3.1]nonane (9-BBN). ORGANOMETALLICS , 26 (16) 4076 - 4079. 10.1021/om070083tCCC:$37.00.

Barrett, AGM and Crimmin, MR and Hill, MS and Hitchcock, PB and Procopiou, PA (2007) Trifluoromethyl coordination and C-F bond activation at calcium. ANGEW CHEM INT EDIT , 46 (33) 6339 - 6342. 10.1002/anie.200701945.

Basharat, S and Betchley, W and Carmalt, CJ and Barnett, S and Tocher, DA and Davies, HO (2007) Synthesis of group 13 sesquialkoxides and their application as precursors to crystalline oxide films. ORGANOMETALLICS , 26 (2) 403 - 407. 10.1021/om0608657.

Basharat, S and Carmalt, CJ and Barnett, SA and Tocher, DA and Davies, HO (2007) Aerosol assisted chemical vapor deposition of In2O3 films from Me3In and donor functionalized alcohols. INORG CHEM , 46 (22) 9473 - 9480. 10.1021/ic701372b.

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. 10.1021/om0608657.

Bateman, JE and Derbyshire, GE and Diakun, G and Duxbury, DM and Fairclough, JPA and Harvey, I and Helsby, WI and Mai, SM and Mykhaylyk, OO and Sankar, G and Spill, EJ and Stephenson, R (2007) First user results from the HOTWAXS detector system. In: 2007 IEEE NUCLEAR SCIENCE SYMPOSIUM CONFERENCE RECORD, VOLS 1-11. (pp. 2416 - 2420). IEEE

Battaglia, G and Tomas, S and Ryan, AJ (2007) Lamellarsomes: metastable polymeric multilamellar aggregates. SOFT MATTER , 3 (4) 470 - 475. 10.1039/b605493e.

Beale, AM and Jacques, SDM and Bergwerff, JA and Barnes, P and Weckhuysen, BM (2007) Tomographic energy dispersive diffraction imaging as a tool to profile in three dimensions the distribution and composition of metal oxide species in catalyst bodies. Angewandte Chemie - International Edition , 46 (46) 8832 - 8835.

Beale, AM and Jacques, SDM and Leynaud, O and Sankar, G (2007) Understanding the crystallisation of zinc phases from ion-exchanged zeolite precursors. MICROPOR MESOPOR MAT , 106 (1-3) 201 - 211. 10.1016/j.micromeso.2007.02.056.

Beale, AM and Reilly, LM and Sankar, G (2007) Watching the crystallisation of complex oxides by in situ X-ray techniques. In: APPLIED CATALYSIS A-GENERAL. (pp. 290 - 295). ELSEVIER SCIENCE BV

Begum, N and Das, UK and Hassan, M and Hogarth, G and Kabir, SE and Nordlander, E and Rahman, MA and Tocher, DA (2007) Chelate and bridge diphosphine isomerization: Triosmium and triruthenium clusters containing 1,1 '-bis(diphenylphosphino)ferrocene (dppf). ORGANOMETALLICS , 26 (25) 6462 - 6472. 10.1021/om700759z.

Bellerby, JM and Blackman, CS (2007) The interaction between otto fuel II and aqueous hydroxylammonium Perchlorate (HAP), part III: Depletion of components within the reacting liquids. Propellants, Explosives, Pyrotechnics , 32 (3) 222 - 226.

Binions, R (2007) Programme for spring meetings is unveiled. CHEM IND-LONDON (1) 33 - 33.

Binions, R and Carmalt, CJ and Parkin, IP (2007) A comparison of the gas sensing properties of solid state metal oxide semiconductor gas sensors produced by atmospheric pressure chemical vapour deposition and screen printing. MEAS SCI TECHNOL , 18 (1) 190 - 200. 10.1088/0957-0233/18/1/024.

Binions, R and Hyett, G and Piccirillo, C and Parkin, IP (2007) Doped and un-doped vanadium dioxide thin films prepared by atmospheric pressure chemical vapour deposition from vanadyl acetylacetonate and tungsten hexachloride: the effects of thickness and crystallographic orientation on thermochromic properties. J MATER CHEM , 17 (44) 4652 - 4660. 10.1039/b708856f.

Binions, R and Piccirillo, C and Parkin, IP (2007) Tungsten doped vanadium dioxide thin films prepared by atmospheric pressure chemical vapour deposition from vanadyl acetylacetonate and tungsten hexachloride. In: SURFACE & COATINGS TECHNOLOGY. (pp. 9369 - 9372). ELSEVIER SCIENCE SA

Birri, A and Harvey, B and Hogarth, G and Subasi, E and Ugur, F (2007) Allyl palladium dithiocarbamates and related dithiolate complexes as precursors to palladium sulfides. J ORGANOMET CHEM , 692 (12) 2448 - 2455. 10.1016/j.jorganchem.2007.02.015.

Bisson, W and Wills, AS (2007) Intermediate phase in the oxidative hydrothermal synthesis of potassium jarosite, a model kagome antiferromagnet. Z KRISTALLOGR 511 - 516.

Blanchard, M and Wright, K and Gale, JD and Catlow, CRA (2007) Adsorption of As(OH)(3) on the (001) surface of FeS2 pyrite: A quantum-mechanical DFT study. J PHYS CHEM C , 111 (30) 11390 - 11396. 10.1021/jp072468v.

Blunt, MO and Martin, CP and Ahola-Tuomi, M and Pauliac-Vaujour, E and Sharp, P and Nativo, P and Brust, M and Moriarty, PJ (2007) Coerced mechanical coarsening of nanoparticle assemblies. Nat Nanotechnol , 2 (3) 167 - 170. 10.1038/nnano.2007.25.

Blunt, MO and Suvakov, M and Pulizzi, F and Martin, CP and Pauliac-Vaujour, E and Stannard, A and Rushforth, AW and Tadić, B and Moriarty, P (2007) Charge transport in cellular nanoparticle networks: meandering through nanoscale mazes. Nano Lett , 7 (4) 855 - 860. 10.1021/nl061656e.

Boero, M and Gervasio, FL and Parrinello, M (2007) Charge localisation and hopping in DNA. Molecular Simulation , 33 (1-2) 57 - 60.

Boldrin, P and Hebb, AK and Chaudhry, AA and Otley, L and Thiebaut, B and Bishop, P and Darr, JA (2007) Direct synthesis of nanosized NiCo2O4 spinel and related compounds via continuous hydrothermal synthesis methods. IND ENG CHEM RES , 46 (14) 4830 - 4838. 10.1021/ie061396b.

Bonomi, M and Gervasio, FL and Tiana, G and Provasi, D and Broglia, RA and Parrinello, M (2007) Insight into the folding inhibition of HIV-1 protease by a small peptide. Drugs of the Future , 32 14 - 15.

Bonomi, M and Gervasio, FL and Tiana, G and Provasi, D and Broglia, RA and Parrinello, M (2007) Insight into the folding inhibition of the HIV-1 protease by a small peptide. Biophys J , 93 (8) 2813 - 2821. 10.1529/biophysj.107.106369.

Boscher, ND and Blackman, CS and Carmalt, CJ and Parkin, IP and Prieto, AG (2007) Atmospheric pressure chemical vapour deposition of vanadium diselenide thin films. APPL SURF SCI , 253 (14) 6041 - 6046. 10.1016/j.apsusc.2007.01.002.

Boscher, ND and Carmalt, CJ and Prieto, AG and Pankhurst, QA and Palgrave, RG and Parkin, IP (2007) Synthesis and charaterisation of chromium oxyselenide (Cr2Se0.7O2.3) formed from chemical vapour synthesis: A new antiferromagnet. EUR J INORG CHEM (29) 4579 - 4582. 10.1002/ejic.200700789.

Boulet, P and Greenwell, HC and Chen, B and Bowden, AA and Beurroies, I and Salles, F and Coveney, PV and Evans, JRG and Whiting, A (2007) Large scale simulations of poly(propylene oxide) amine/Na+-montmorillonite using a molecular dynamics approach. Studies in Surface Science and Catalysis , 160 311 - 318.

Branduardi, D and Gervasio, FL and Parrinello, M (2007) From A to B in free energy space. J Chem Phys , 126 (5) 054103 - ?. 10.1063/1.2432340.

Brown, WA and Bolina, AS (2007) Fundamental data on the desorption of pure interstellar ices. MON NOT R ASTRON SOC , 374 (3) 1006 - 1014. 10.1111/j.1365-2966.2006.11216.x.

Burnside, PW and Price, SD (2007) Electron transfer and bond-forming reactions following collisions of Cl2+ and HCl2+ with CO. Physical Chemistry Chemical Physics , 9 (29) 3902-3913 - ?.

Bussi, G and Gervasio, FL and Laio, A and Parrinello, M (2007) COMP 463-Free-energy landscapes from combined parallel-tempering and metadynamics. Abstracts of Papers of the American Chemical Society , 234

Bussi, G and Gervasio, FL and Laio, A and Parrinello, M (2007) PHYS 410-Beta-hairpin folding with parallel-tempering and metadynamics. Abstracts of Papers of the American Chemical Society , 234

C

Cabailh, G and Torrelles, X and Lindsay, R and Bikondoa, O and Joumard, I and Zegenhagen, J and Thornton, G (2007) Geometric structure of TiO2(110)(1x1): Achieving experimental consensus. PHYS REV B , 75 (24) , Article 241403. 10.1103/PhysRevB.75.241403.

Cao, E and Firth, S and McMillan, P and Sankar, G and Gavriilidis, A (2007) Microfabricated reactors for mechanistic and kinetic studies of formaldehyde synthesis on silver. 2007 AIChE Annual Meeting

Cao, E and Firth, S and McMillan, PF and Gavriilidis, A (2007) Application of microfabricated reactors for operando Raman studies of catalytic oxidation of methanol to formaldehyde on silver. CATALYSIS TODAY , 126 (1-2) 119 - 126. 10.1016/j.cattod.2006.11.002.

Carmalt, CJ and Basharat, S (2007) Molecular precursor routes to gallium oxide. ABSTR PAP AM CHEM S , 234 ? - ?.

Carmalt, CJ and Basharat, S (2007) Precursors to Semiconducting Materials. In: O'Hare, D, (ed.) Comprehensive Organometallic Chemistry III. (1 - 34).

Carmalt, CJ and Boscher, N and Parkin, IP (2007) INOR 741-Chemical vapor deposition of WSe2 thin films: Highly hydrophobic sticky surfaces. ABSTR PAP AM CHEM S , 234 ? - ?.

Carmalt, CJ and Knapp, CE and McMillan, PF (2007) Group 13 amides and alkoxides: Synthesis, reactivity and thermal decomposition. ABSTR PAP AM CHEM S , 234 ? - ?.

Carmalt, CJ and Peters, ES and Parkin, IP and Tocher, DA (2007) Synthesis and characterisation of titanium pyridine- and pyrimidine-thiolates and their application as precursors to titanium disulfide. POLYHEDRON , 26 (1) 43 - 48. 10.1016/j.poly.2006.07.017.

Carmalt, CJ and Potts, SE and Davies, HO (2007) Transition metal amides and imides as precursors to metal nitride and carbonitride thin films via chemical vapor deposition. ABSTR PAP AM CHEM S , 234 ? - ?.

Catlow, CRA and Bell, RG and Cora, F and Slater, B (2007) Molecular modeling in zeolite science. In: Čejka, J and van Bekkum, H and Corma, A and Schüth, F, (eds.) Introduction to Zeolite Science and Practice (Studies in Surface Science and Catalysis vol. 168). Elsevier: Amsterdam.

Catlow, R and Bell, R and Cora, F and Slater, B (2007) Chapter 19 Molecular modelling in zeolite science. Studies in Surface Science and Catalysis , 168 659 - 700.

Cavalli, A and Berteotti, A and Branduardi, D and Gervasio, FL and Recanatini, M and Parrinello, M (2007) Protein conformational plasticity: The "off-on" switching movement in CDK5. In: UNSPECIFIED (598 - 598).

Cavigliasso, G and Kaltsoyannis, N (2007) Energy decomposition analysis of metal–metal bonding in [M2X8]2– (X = Cl, Br) complexes of 5f (U, Np, Pu), 5d (W, Re, Os) and 4d (Mo, Tc, Ru) elements. Inorganic Chemistry , 46 3557 - 3565. 10.1016/j.cattod.2006.11.002.

Chambel, L and Sol, M and Fernandes, I and Barbosa, M and Zilhao, I and Barata, B and Jordan, S and Perni, S and Shama, G and Adriao, A and Faleiro, L and Requena, T and Pelaez, C and Andrew, PW and Tenreiro, R (2007) Occurrence and persistence of Listeria spp. in the environment of ewe and cow's milk cheese dairies in Portugal unveiled by an integrated analysis of identification, typing and spatial-temporal mapping along production cycle. INT J FOOD MICROBIOL , 116 (1) 52 - 63. 10.1016/j.ijfoodmicro.2006.12.035.

Chen, B and Evans, JRG (2007) Enhancement of recycled polymer blends using nanoclays. In: (Proceedings) ICEM8 : 8th International Conference on Eco-materials, Brunel University, July, 2007..

Chen, L and Zhang, Y and Yang, S and Evans, JRG (2007) Protocols for printing thick film ceramic libraries using the London University Search Instrument. Review of Scientific Instruments , 78 (7) Article No - ?. 10.1063/1.2755469.

Coombes, DS and Bell, RG and Mellot-Draznieks, C and Ramsahye, NA and Maurin, G (2007) Derivation of new interatomic potential for flexible metal-organic frameworks: a pre-requisite for understanding swelling under adsorption conditions. Studies in Surface Science and Catalysis , 170 918 - ?. 10.1016/S0167-2991(07)80940-2.

Cornet, SM and Maya, I and Sarsfield, MJ and Kaltsoyannis, N and Haller, J and Den Auwer, C and Meyer, D (2007) Actinyl chemistry across the U, Np and Pu series. JOURNAL OF ALLOYS AND COMPOUNDS , 444 453 - 456. 10.1016/j.jallcom.2007.01.056.

Coveney, PV and Saksena, RS and Zasada, SJ and McKeown, M and Pickles, S (2007) The application hosting environment: Lightweight middleware for grid-based computational science. COMPUT PHYS COMMUN , 176 (6) 406 - 418. 10.1016/j.cpc.2006.11.011.

Coward, LS and M E B, H and E, W and J M, H and H C, AD and P, A (2007) Chemoenzymatic Synthesis of Structurally Diverse Compounds. In: (Proceedings) 8th International Symposium on Biocatalysis and Biotransformations..

Crimmin, MR and Barrett, AGM and Hill, MS and Hitchcock, PB and Procopiou, PA (2007) Bis(diphenylphosphido) derivatives of the heavier group 2 elements. INORG CHEM , 46 (24) 10410 - 10415. 10.1021/ic701608x.

Crimmin, MR and Barrett, AGM and Hill, MS and Hitchcock, PB and Procopiou, PA (2007) Calcium-catalyzed intermolecular hydrophosphination. ORGANOMETALLICS , 26 (12) 2953 - 2956. 10.1021/om070200k.

Crimmin, MR and Barrett, AGM and Hill, MS and Procopiou, PA (2007) Heavier alkaline earth amides as catalysts for the Tischenko reaction. ORG LETT , 9 (2) 331 - 333. 10.1021/ol0627247.

D

Dimitratos, N and Della Pina, C and Falletta, E and Bianchi, CL and Dal Santo, V and Rossi, M (2007) Effect of Au in Cs2.5H1.5PVMo11O40 and Cs2.5H1.5PVMo11O40/Au/TiO2 catalysts in the gas phase oxidation of propylene. In: CATALYSIS TODAY. (pp. 307 - 316). ELSEVIER SCIENCE BV

Della Pina, C and Dimitratos, N and Falletta, E and Rossi, M and Siani, A (2007) Catalytic performance of gold catalysts in the total oxidation of VOCs. GOLD BULL , 40 (1) 67 - 72.
An open access publication

Dimitratos, N and Lopez-Sanchez, JA and Morgan, D and Carley, A and Prati, L and Hutchings, GJ (2007) Solvent free liquid phase oxidation of benzyl alcohol using Au supported catalysts prepared using a sol immobilization technique. In: CATALYSIS TODAY. (pp. 317 - 324). ELSEVIER SCIENCE BV

Daisenberger, D and Wilson, M and McMillan, PF and Cabrera, RQ and Wilding, MC and Machon, D (2007) High-pressure x-ray scattering and computer simulation studies of density-induced polyamorphism in silicon. PHYS REV B , 75 (22) , Article 224118. 10.1103/PhysRevB.75.224118.

Dal Peraro, M and Ruggerone, P and Raugei, S and Gervasio, FL and Carloni, P (2007) Investigating biological systems using first principles Car-Parrinello molecular dynamics simulations. Curr Opin Struct Biol , 17 (2) 149 - 156. 10.1016/j.sbi.2007.03.018.

Danyliv, O and Kantorovich, L and Cora, F (2007) Treating periodic systems using embedding: Adams-Gilbert approach. PHYS REV B , 76 (4) , Article 045107. 10.1103/PhysRevB.76.045107.

De Fabritiis, G and Serrano, M and Delgado-Buscalioni, R and Coveney, PV (2007) Fluctuating hydrodynamic modeling of fluids at the nanoscale. PHYS REV E , 75 (2) , Article 026307. 10.1103/PhysRevE.75.026307.

De Fabrits, G and Vllla-Freixa, J and Coveney, PV (2007) Multiscale modelling of permeation through membrane channels using pregenerated molecular dynamics trajectories. In: INTERNATIONAL JOURNAL OF MODERN PHYSICS C. (pp. 511 - 519). WORLD SCIENTIFIC PUBL CO PTE LTD

De Leeuw, NH (2007) Computer modelling of organic/biomineral interfaces. In: GEOCHIMICA ET COSMOCHIMICA ACTA. (pp. A214 - A214). PERGAMON-ELSEVIER SCIENCE LTD

de Leeuw, NH and Bowe, JR and Rabone, JAL (2007) A computational investigation of stoichiometric and calcium-deficient oxy- and hydroxy-apatites. FARADAY DISCUSSIONS , 134 195 - 214. 10.1039/b602012g.

de Leeuw, NH and Cooper, TG (2007) Surface simulation studies of the hydration of white rust Fe(OH)(2), goethite alpha-FeO(OH) and hematite alpha-Fe2O3. GEOCHIM COSMOCHIM AC , 71 (7) 1655 - 1673. 10.1016/j.gca.2007.01.002.

de Leeuw, NH and Rabone, JAL (2007) Molecular dynamics simulations of the interaction of citric acid with the hydroxyapatite (0001) and (01(1)over-bar0) surfaces in an aqueous environment. CRYSTENGCOMM , 9 (12) 1178 - 1186. 10.1039/b710974a.

Deeming, AJ and Forth, CS and Hogarth, G (2007) Synthesis and crystal structure of [RU8(mu(5)-S)(2)(mu(4)-S)(mu(3)-S)(mu-CNMe2)(2)(mu-CO)(CO)(15)] formed via the double sulphur-carbon bond cleavage of dithiocarbamate ligands. J ORGANOMET CHEM , 692 (18) 4000 - 4004. 10.1016/j.jorganchem.2007.05.044.

Di Tommaso, D and French, SA and Catlow, CRA (2007) The H-2-hydrogenation of ketones catalysed by ruthenium(II) complexes: A density functional theory study. J MOL STRUC-THEOCHEM , 812 (1-3) 39 - 49. 10.1016/j.theochem.2007.02.029.

Ding, R and Guo, ZX and Qian, M (2007) Coupled mesoscopic constitutive modelling and finite element simulation for plastic flow and microstructure of two-phase alloys. Computational Materials Science , 40 201 - 212. 10.1016/j.commatsci.2006.12.003.

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