Kemisk Institut

Formidling

Bidrag til forskningsformidlende bog/antologi

Keiding, SR, & Andersen, ES 2005, 'Når molekyler mødes og skilles' i: Forskning i vand, Aarhus Universitet s. 13-18.

Tidsskriftartikel

Jakobsen, HJ 2005, 'Det Danske NMR (Diskussions) Møde: 25 År' Dansk Kemi, vol. 86, s. 38-39.

Møller, B, Mosegaard, L, Thomsen, L, Hansen, E, Olesen, M, Burkarl, R, Jørgensen, J, Iversen, BB, Besenbacher, F, & Jensen, TR 2005, 'Et nyt energisystem baseret på hydrogen' Dansk Kemi, vol. 86, nr. 9, s. 1-6.

Forskningsformidlende bog/antologi

Kaufmann, I, Keiding, SR, & Andersen, ES 2005, Viden om vand Aarhus Universitetsforlag, Aarhus.

Forskning

Artikel

Linderberg, J 2005, 'Kvantekemi: En matematisk disciplin?' Matilde, vol. 25, s. 15-16.

Artikel peer reviewed

Aburel, P, Zhuang, W, Hazell, RG, & Jørgensen, KA 2005, 'Catalytic and Enantioselective Aza-Ene and Hetero-Diels-Alder Reactions of Alkenes and Dienes with Azodicarboxylates' Organic and Biomolecular Chemistry, vol. 3, s. 2344.

Aidas, K, Kongsted, J, Osted, A, Mikkelsen, K, & Christiansen, O 2005, 'Coupled cluster calculation of the n -›pi* electronic transition of acetone in aqueous solution' Journal of Physical Chemistry A, vol. 109, s. 8001-8010.

Alemparte Gallardo, C, Blay, G, & Jørgensen, KA 2005, 'A convenient Procedure for the Catalytic Asymmetric Procedure Cycloaddition of Azomethine Ylides and Alkenes' Organic Letters, vol. 7, s. 4569.

Andersen, M, Jakobsen, H, & Skibsted, J 2005, 'Effects of T ₂ -relaxation in MAS NMR spectra of the satellite transitions for quadrupolar nuclei: a ²⁷ Al MAS and single-crystal NMR study of alum KAl(SO ₄ ) ₂ ^. 12H ₂ O' J. Magn. Reson., nr. 173, s. 209-217.

Andersen, TV, Hilligsøe, KM, Nielsen, CK, Thøgersen, J, Hansen, KP, Keiding, SR, & Larsen, JJ 2005, 'Continuous-wave wavelength conversion in a photonic crystal fiber with two zero-dispersion wavelengths' Optics Express, vol. 12, nr. 17, s. 4113-4122.

Andersson, M, Birkedal, H, Franklin, N, Ostomel, T, Boettcher, S, Palmqvist, A, & Stucky, G 2005, 'Ag/AgCl-Loaded Ordered Mesoporous Anatase for Photocatalysis' Chem Mater, vol. 17, s. 1409-1415.

Andersson, M, Pedersen, JS, & Palmquist, A 2005, 'A Kinetic Study of the Formation of Silver Nanoparticles in Microemulsions Acting Both as Template and Reducing Agent' Langmuir, vol. 21, s. 11387-11396.

Andreasen, A, Sørensen, M, Burkarl, R, Møller, B, Molenbroek, A, Pedersen, A, Andreasen, J, Nielsen, M, & Jensen, TR 2005, 'Interaction of hydrogen with a Mg-Al alloy' Journal of Alloys and Compounds, vol. 404-406, s. 323-326.

Andresen, E, Paulsen, H, Birkedal, V, Thøgersen, J, & Keiding, S 2005, 'Broadband multiplex coherent anti-Stokes Raman scattering microscopy employing photonic-crystal fibers' J Opt Soc Am B, vol. 22, nr. 9, s. 1934-1938.

Andresen, E, Thøgersen, J, & Keiding, SR 2005, 'Spectral compression of femtosecond pulses in photonic crystal fibers' Optics Letters, vol. 15, nr. 30, s. 2025-2027.

Baymak, M, Celik, H, Lund, H, & Zuman, P 2005, 'Experimental evidence of formation of imines in the course of reduction of hydrazones' Journal of Electroanalytical Chemistry, vol. 581, s. 284-293.

Bella, M, Kobbelgaard, S, & Jørgensen, KA 2005, 'Organocatalytic Regio- and Asymmetric C-Selective Sa _N Ar Reactions - Stereoselective Synthesis of Optically Active Spiro-pyrrolidione-3,3´-Oxoindoles' Journal of the American Chemical Society, vol. 127, s. 3670.

Bentien, A, Nishibori, E, Paschen, S, & Iversen, B 2005, 'Crystal structures, atomic vibration, and disorder of the type-I thermoelectric clathrates Ba ₈ Ga ₁₆ Si ₃₀ , Ba ₈ Ga ₁₆ Ge ₃₀ , Ba ₈ In ₁₆ Ge ₃₀ , and Sr ₈ Ga ₁₆ Ge ₃₀ ' Phys. Rev. B, vol. 71, s. 144107-1-144107-18.

Bernardi, L, & Jørgensen, KA 2005, 'Enantioselective Chlorination and Fluorination of &beta-Keto Phosphonates' Chemical Communications, s. 1324.

Bernardi, L, Zhuang, W, & Jørgensen, KA 2005, 'An Easy Approach to Optically Active &alpha-Amino Phosphonic Acid Derivatives by Lewis-Acid Catalyzed Enantioselective Amination of Phosphonates' Journal of the American Chemical Society, vol. 127, s. 5772.

Berndt, I, Pedersen, JS, & Richtering, W 2005, 'Structure of Multiresponsive 'Intelligent' Core-Shell Microgels' Journal of the American Chemical Society, vol. 127, s. 9372-9373.

Bertelsen, S, Nielsen, M, Bachmann, S, & Jørgensen, KA 2005, 'Rhodium-Catalyzed Synthesis of &alpha-Amido- and &alpha-Carboxylic-&beta-Ketoesters' Synthesis, s. 2234.

Bertelsen, S, Halland, N, Bachmann, S, Marigo, M, Braunton, A, & Jørgensen, KA 2005, 'Organocatalytic Asymmetric &alpha-Bromination of Aldehydes and Ketones' Chemical Communications, s. 4821.

Bertram, H, Jakobsen, HJ, & Nielsen, OB 2005, 'Origin of the high-frequency resonances in 1H NMR spectra of muscle tissue: an in vitro slow magic-angle spinning study.' J Agric Food Chem, vol. 53, s. 3229-3234.

Bertram, H, Jakobsen, HJ, & Nielsen, O 2005, 'Origin of the High-Frequency Resonances in ¹ H NMR Spectra of Muscle Tissue: An in Vitro Slow Magic-Angle Spinning Study' Journal of Agricultural and Food Chemistry, vol. 53, s. 3229-3234.

Bertram, H, Kristensen, N, Malmendal, A, Nielsen, NC, Bro, R, Andersen, H, & Harmon, D 2005, 'A metabolomic investigation of splanchnic metabolism using 1H NMR spectroscopy of bovine blood plasma' Analystica Chimica Acta, vol. 536, s. 1-6.

Birkedal, H, Broomell, C, Khan, R, Slack, N, Lichtenegger, H, Zok, F, Stucky, G, & Waite, J 2005, 'The Jaws of Nereis : Microstructure and Mechanical Properties' Mater. Res. Soc. Symp. Proc., vol. 874, s. 2-2.

Bürgi, H, Hostettler, M, Birkedal, H, & Schwarzenbach, D 2005, 'Stacking disorder: the hexagonal polymorph of tris(bicyclo[2.1.1]hexeno)benzene and related examples' Z. Kristallogr., vol. 220, s. 1066-1075.

Calderon, R, Barquin, L, Kaul, L, Sal, J, Gorria, P, Pedersen, JS, & Heenan, R 2005, 'Small-angle neutron scattering study of a magnetically inhomogeneous amorphous alloy with reentrant behavior' Physical Review B, vol. 71, s. 1-9.

Carter, S, Birkedal, V, Wang, C, Coldren, L, Maslov, A, Citrin, D, & Sherwin, M 2005, 'Quantum Coherence in an Optical Modulator' Science, vol. 310, s. 651-653.

Carter, S, Ciulin, V, Hanson, ., Huntington, A, Wang, C, Gossard, A, Coldren, L, & Sherwin, M 2005, 'Terahertz-optical mixing in undoped and doped GaAs quantum wells: From excitonic to electronic intersubband transitions' Phys. Rev. B, vol. 72.

Christiansen, O, & Luis, J 2005, 'Beyond vibrational self-consistent-field methods: Benchmark calculations for the fundamental vibrations of ethylene' International Journal of Quantum Chemistry, vol. 104, s. 667-680.

Christiansen, O 2005, 'Response theory for vibrational wave functions' Journal of Chemical Physics, vol. 122, s. 194105.

Clausen, HF, Poulsen, RD, Bond, A, & Iversen, BB 2005, 'New Metal Organic Framework Structures in the Zinc-Dimethylformamide-Terephtalic Acid System' Journal of Solid State Chemistry, vol. 178, s. 3336-3345.

Coriani, S, Marchesan, D, Gauss, J, Hättig, J, Helgaker, T, & Jørgensen, P 2005, 'The accuracy of ab initio molecular geometries for systems containing second-row atoms' Journal of Chemical Physics, vol. 123, s. 184107-1-12.

Dallas, A, & Gothelf, K 2005, 'Effect of Water on the Palladium-Catalyzed Amidation of Aryl Bromides' J. Org. Chem., vol. 70, s. 3321-3323.

Dieter, , Poulsen, K, & Strutwolf, J 2005, 'Reference values of the diffusion-limited chronoamperometric current at a microband electrode' Electrochimica Acta, vol. 51, nr. 2, s. 333-339.

Ebran, J, Hazell, R, & Skrydstrup, T 2005, 'Samarium diiodide-induced intramolecular pinacol coupling of dinitrones: Synthesis of cyclic cis-vicinal diamines' Chem. Commun., s. 5402-5404.

Enemarke, R, Larsen, J, Hjollund, G, Skrydstrup, T, & Daasbjerg, K 2005, 'Influence of the Halogen in Titanocene Halide Promoted Reductions' Organometallics, vol. 24, s. 1252-1262.

Fantner, G, Hassenkam, T, Kindt, J, Weaver, J, Birkedal, H, Pechenik, L, Cutroni, J, Cidade, G, Stucky, G, Morse, D, & Hansma, P 2005, 'Sacrifical bonds and hidden length dissipate energy as mineralized fibrils separate during bone fracture' Nature Materials, vol. 4, s. 612-616.

Fernandes, J, Ferreira, R, Pillinger, M, Carlos, L, Jepsen, J, Hazell, A, Ribeiro-Claro, P, & Goncalves, I 2005, 'Investigation of europium(III) and gadolinium(III) complexes with naphthoyltrifluoroacetone and bidentate heterocyclic amines' J. Lumin., vol. 113, s. 50-63.

Franzén, J, Marigo, M, Fielenbach, DG, Wabnitz, TC, Jensen, AKK, & Jørgensen, KA 2005, 'A General Organocatalyst for Direct &alpha-functionalization of Aldehydes: Stereoselective C-C, C-N, C-F, C-Br and C-S Bond-Forming Reactions. Scope and Mechanistic Insights' Journal of the American Chemical Society, vol. 127, s. 18296.

Frederiksen, P, McIlroy, S, Nielsen, C, Nikolajsen, L, Skovsen, E, Jørgensen, M, Mikkelsen, K, & Ogilby, P 2005, 'Two-Photon Photosensitized Production of Singlet Oxygen in Water' J. Am. Chem. Soc., vol. 127, nr. 1, s. 255-269.

Frisch, K, Landa, A, Saaby, S, & Jørgensen, KA 2005, 'Organocatalytic Diastereo- and Enantioselective Annulation Reactions - Construction of Optically Active 1,2-Dihydro-Isoquinoline and Phthalazine Derivatives' Angewandte Chemie. International edition. English, vol. 44, s. 6058.

Gavrila, A, Andersen, L, & Skrydstrup, T 2005, 'A convenient and simple procedure for the preparation of nitrate esters from alcohols employing LINO ₃ /(CF ₃ CO) ₂ O' Tetrahedron Lett., vol. 46, s. 6205-6207.

Gothelf, K, & Brown, R 2005, 'A Modular Approach to DNA-Programmed Self-assembly of Macromolecular Nanostructures' Chem. Eur. J., vol. 11, nr. 4, s. 1062-1069.

Gothelf, KV, & LaBean, T 2005, 'DNA-programmed assembly of nanostructures' Organic and Biomolecular Chemistry, vol. 2, s. 4023-4037.

Gregersen, A, Pedersen, C, Jensen, H, & Bols, M 2005, 'On the electronic effects from OH groups. Synthesis and investigation of tetrahydroxylated azabicycloheptanes' Org. Biomol. Chem., vol. 3, s. 1514-1519.

Hald, P, & Iversen, BB 2005, 'Syntese af nanokrystallinske metaloxider i superkritisk væske' Tidsskrift for Dansk Keramisk Selskab, vol. 7, s. 4-7.

Halland, N, Lie, MA, Jensen, AKK, Schiøtt, B, & Jørgensen, KA 2005, 'Mechanistic Insight Into the 2,5-Diphenylpyrrolidine Catalyzed Enantioselctive &alpha-Chlorination of Aldehydes' Chemistry: A European Journal, vol. 11, s. 7083.

Hamilton, E, Seideman, T, Ejdrup, T, Poulsen, M, Bisgaard, C, Viftrup, S, & Stapelfeldt, H 2005, 'Alignment of symmetric top molecules by short laser pulses' Physical Review A, vol. 72, s. 043402-1 - 043402-12.

Hansen, A, & Skrydstrup, T 2005, 'Fast and Regioselective Heck Couplings with N-Acyl-N-vinylamine Derivatives' J. Org. Chem., vol. 70, s. 5997-6003.

Hansen, AL, & Skrydstrup, T 2005, 'Regioselective Heck Couplings of alpha,beta-Unsaturated Tosylates and Mesylates with Electron-Rich Olefins' Organic Letters, vol. 7, s. 5585-5587.

Hansen, M, Madsen, G, Jakobsen, H, & Skibsted, J 2005, 'Refinement of Borate Structures from ¹¹ B MAS NMR Spectroscopy and Density Functional Theory Calculations of ¹¹ B Electric Field Gradients' J. Phys. Chem. A., vol. 109, nr. 9, s. 1989-1997.

Hegelund, F, Wugt Larsen, R, Aitken, R, & Palmer, M 2005, 'A high-resolution infrared study of five bands of 1,2,5-thiadiazole in the range 750-1250 cm-1, together with ab initio and DFT studies' J. Mol. Spectrosc., vol. 233, s. 256-268.

Hegelund, F, Wugt Larsen, R, Nicolaisen, F, & Palmer, M 2005, 'The high-resolution infrared spectrum of isoxazole vapor between 800 and 1700 cm-1' J. Mol. Spectrosc., vol. 229, s. 244-256.

Hemmersam, AG, Foss, M, Chevallier, J, & Besenbacher, F 2005, 'Adsorption of fibrinogen on tantalum oxide, titanium oxide and gold studied by the QCM-D technique' Colloids and Surfaces B:Biointerfaces, vol. 43, s. 208.

Hibbs, D, Overgaard, J, Howard, S, & Nguyen, T 2005, 'Experimental charge density of a potential DHO synthetase inhibitor: dimethyl- trans -2-oxohexahydro-pyrimidine-4,6-dicarboxylate' Org. Biomol. Chem., vol. 3, s. Advance article.

Hjarbæk Holm, A, Møller, R, Vase, KH, Dong, M, Norrman, K, Besenbacher, F, Pedersen, SU, & Daasbjerg, K 2005, 'Nucleophilic and electrophilic displacements on covalently modified carbon: introducing 4,4-bipyridinium on grafted glassy carbon electrodes' New Journal of Chemistry, nr. 29, s. 629-666.

Holm, A, Brinck, T, & Daasbjerg, K 2005, 'Elucidation of the Thermochemical Properties of Triphenyl- or Tributyl-Substituted Si-, Ge-, and Sn-Centered Radicals by Means of Electrochemical Approches and Computations' J. Am. Chem. Soc., vol. 127, s. 2677-2685.

Hoyer, B, & Jensen, N 2005, 'Use of sodium dodecyl sulfate for suppression of electrode fouling in the voltammetric detection of biologically relevant compounds' Electroanal., vol. 17, nr. 22, s. 2037-2042.

Høst, S, Jørgensen, P, Köhn, A, Pawlowski, F, Klopper, W, & Hättig, C 2005, 'Frequency-dependent hyperpolarizabilities of the Ne, Ar, and Kr atoms using the approximate coupled cluster triples model CC3' Journal of Chemical Physics, vol. 123, s. 094303-1-10.

Jacobsen, M, Moses, J, Adlington, R, & Baldwin, J 2005, 'A Short Total Synthesis of Aureothin and N-Acetylaureothamin' Org. Lett., vol. 7, nr. 4, s. 641-644.

Jacobsen, M, Moses, J, Adlington, R, & Baldwin, J 2005, 'The Total Synthesis of Spectinabilin and Its Biomimetic Conversion to SNF4435C and SNF4435D' Org. Lett., vol. 7, nr. 12, s. 641-644.

Jensen, AKK, & Jørgensen, KA 2005, 'Catalytic Asymmetric Addition of &beta-Keto Phosphonates to an Activated Imine - Formation of optically Active Functionalized Phosponate &alpha-Amino Acid Derivatives' Organic and Biomolecular Chemistry, vol. 3, s. 804.

Jensen, C, Lindsay, K, Andreasen, P, & Skrydstrup, T 2005, 'Synthesis of a Hydroxyethylene Isostere of the Tripeptide Arg-Gly-Leu via a Convergent Acyl-like Radical Addition Strategy' J. Org. Chem., vol. 70, s. 7512-7519.

Jensen, C, Lindsay, K, Andreasen, P, & Skrydstrup, T 2005, 'Synthesis of a hydroxyethylene isostere of the tripeptide Arg-Gly-Leu via a convergent acyl-like radical addition strategy' J. Org. Chem., vol. 70, s. 7512-7519.

Jensen, C, Lindsay, K, Taaning, R, Karaffa, J, Hansen, A, & Skrydstrup, T 2005, 'Can Decarbonylation of Acyl Radicals Be Overcome in Radical Addition Reactions? En Route to a Solution Employing N-Acyl Oxazolidinones and SmI2/H2O' J. Am. Chem. Soc., vol. 127, s. 6544-6545.

Jensen, F, & Ogilby, P 2005, 'Christopher S. Foote (1935-2005)' Angew. Chem. Int. Edit., vol. 44, s. 62-68.

Jensen, H, Joensen, K, Jørgensen, J, Pedersen, JS, & Søgaard, E 2005, 'Characterization of partly crystalline photocatalysts' Journal of Nanoparticle Research, vol. 6, s. 519-526.

Jensen, T, Gérentes, N, Jepsen, J, Hazell, R, & Jakobsen, H 2005, 'New Amine-Templated Zinc Phosphates with a Temperature-Induced Increase of Structural Dimensionality' Inorg. Chem., vol. 44, nr. 3, s. 658.

Jensen, TR, Christensen, A, & Hanson, J 2005, 'Hydrothermal transformation of the calcium aluminium oxide hydrates CaAl ₂ O ₄ .10H ₂ O and Ca ₂ Al ₂ O ₅ .8H ₂ O to Ca ₃ Al ₂ (OH)12 investigated by in-situ synchrotron X-ray powder diffraction' Cement and Concrete Research, vol. 35, nr. 12, s. 2300-2309.

Jørgensen, J, Erlacher, K, Pedersen, JS, & Gothelf, KV 2005, 'Preparation Temperature Dependence of Size and Polydispersity of Alkylthiol Monolayer Protected Gold Clusters' Langmuir, vol. 21, s. 10320-10323.

Jørgensen, N, Laursen, J, Viksna, A, Pind, N, & Holm, P 2005, 'Multi-elemental EDXRF mapping of polluted soil from former horticultural land' Environ Int, vol. 31, nr. 1, s. 43-52.

Kamihira, M, Vosegaard, T, Mason, A, Straus, S, Nielsen, N, & Watts, A 2005, 'Structural and orientational constraints of bacteriorhodopsin in purple membranes determined by oriented-sample solid-state NMR spectroscopy' J. Struct. Biol., vol. 149, s. 7-16.

Kehlet, C, Vosegaard, T, Khaneja, N, Glaser, S, & Nielsen, NC 2005, 'Low-power homonuclear dipolar recoupling in solid-state NMR developed using optimal control theory' Chem. Phys. Lett, vol. 414, s. 204-209.

Khoo, L, & Hazell, A 2005, 'A 1:2 adduct of 3-(piperidin-1-yl)propionic acid and triphenyltin chloride' Acta Crystallogr. E, vol. 61, s. 865-867.

Kjeldsen, T, Bisgaard, C, Madsen, L, & Stapelfeldt, H 2005, 'Influence of molecular symmetry on strong-field ionization: Studies on ethylene, benzene, fluorobenzene, and chlorofluorobenzene' Phys. Rev. A, vol. 71, nr. January, s. 013418-1 - 013418-12.

Kjeldsen, TK, Bisgaard, C, Madsen, L, & Stapelfeldt, H 2005, 'Influence of molecular symmetry on strong-field ionization: Studies on ethylene, benzene, fluorobenzene, and chlorofluorobenzene' Phys. Rev. A, vol. 71, s. 013418.

Knudsen, K, & Jørgensen, KA 2005, 'A chiral Molecular Recognition Approach to Formation of Quaternary Centers in Asymmetric Synthesis' Organic and Biomolecular Chemistry, vol. 3, s. 1362.

Komorowskaa, K, Brasselet, S, Dutier, G, Ledoux, I, Zyss, J, Poulsen, L, Jazdzyk, M, Egelhaaf, H, Gierschner, J, & Hanack, M 2005, 'Nanometric scale investigation of the nonlinear efficiency of perhydrotriphenylene inclusion compounds' Chemical Physics, vol. 318, s. 12-20.

Kongsted, J, Pedersen, T, Strange, M, Osted, A, Hansen, A, Mikkelsen, K, Pawlowski, F, Jørgensen, P, & Hättig, C 2005, 'Coupled Cluster calculations of the optical rotation of S-propylene oxide in gas phase and solution' Chemical Physics Letters, vol. 401, s. 385-392.

Larsen, A, & Gothelf, K 2005, 'Electrochemical Properties of Mixed Self-Assembled Monolayers on Gold Electrodes Containing Mercaptooctylhydroquinone and Alkylthiols' Langmuir, vol. 21, s. 1015-1021.

Larsen, F, Muryn, C, Overgaard, J, Timco, G, & Winpenny, R 2005, 'Diethanolaminium cyclo -octa-μ2-fluro-hexadeca-μ2-trimethylacetato-κ32 O : O' -heptachromium(III)nickel(II) ethyl acetate 0.5-solvate' Acta Crystallogr. E, vol. 61, s. 1525-1527.

Laye, R, Larsen, F, Overgaard, J, Muryn, C, McInnes, E, Rentschler, E, Sanchez, V, Teat, S, Güdel, H, Waldmann, O, Timco, G, & Winpenny, R 2005, 'A family of heterometallic wheels containing potentially fourteen hundred siblings' Chem. Commun., vol. 9, s. 1125-1127.

Lichtenegger, H, Birkedal, H, Casa, D, Cross, J, Heald, S, Waite, J, & Stucky, G 2005, 'Distribution and Role of Trace Transition Metals in Glycera Worm Jaws Studied with Synchrotron Microbeam Techniques' Chem Mater, vol. 17, s. 2927-2931.

Linderberg, J 2005, 'Bonding in the Perchlorate Anion and Radical' Advances in Quantum Chemistry, vol. 48, s. 1-8.

Lund, H 2005, 'Some reactions of electrochemically prepared anions of DMF and DMSO' Journal of Electroanalytical Chemistry, vol. 584, s. 174-181.

Lund, H, Svith, H, Pedersen, SU, & Daasbjerg, K 2005, 'Versatile electrochemically based preparation of unusual Grignard reagents containing electrophilic substituents' Electrochimica Acta, vol. 51, nr. 4, s. 655-664.

Madsen, G, & Novák, P 2005, 'Charge order in magnetite. An LDA+ U study' Europhys. Lett., vol. 69, nr. 5, s. 777-783.

Madsen, GKH, & Santi, G 2005, 'Anharmonic lattice dynamics in type-I clathrates from first-principles calculations' Physical Review B, vol. 72, s. 220301-1 - 220301-4.

Malmendal, A, Vander Kooi, C, Nielsen, NC, & Chazin, W 2005, 'Calcium-modulated S100 protein-phospholipic interactions. An NMR study of calbindin D9k and DPC' Biochemistry, vol. 44, s. 6502-6512.

Marigo, M, Wabnitz, TC, Fielenbach, DG, & Jørgensen, KA 2005, 'Enantioselective Organocatalytic &alpha-Sulfenylation of Aldehydes' Angewandte Chemie. International edition. English, vol. 44, s. 794.

Marigo, M, Fielenbach, DG, Braunton, A, & Jørgensen, KA 2005, 'Enantioselective Formation of Stereogenic Carbon-Fluorine Centers by a Simple Catalytic Method' Angewandte Chemie. International edition. English, vol. 44, s. 3703.

Marigo, M, Franzén, J, Poulsen, TB, Zhuang, W, & Jørgensen, KA 2005, 'Asymmetric Organocatalytic Eposication of &alpha, &beta-Unsaturated Aldehydes with Hydrogen Peroxide' Journal of the American Chemical Society, vol. 127, s. 6964.

Marigo, M, Schulte, T, Franzén, J, & Jørgensen, KA 2005, 'Novel Asymmetric Multi-Component-Domino Reactions and Highly Enantioselective Conjugate Addition of Thiols to &alpha,&beta-Unsaturated Aldehydes' Journal of the American Chemical Society, vol. 127, s. 15710.

Marinescu, L, Pedersen, C, & Bols, M 2005, 'Safe Radical Azidonation using Polystyrene Supported Diazidoiodate(I)' Tetrahedron, vol. 61, s. 123-127.

Marinescu, L, Mølbach, M, Rousseau, C, & Bols, M 2005, 'Supramolecular Oxidation of Anilines Using Hydrogen Peroxide as Stoichiometric Oxidant' Journal of the American Chemical Society, vol. 127, s. 17578-17579.

McIlroy, S, Clo, E, Nikolajsen, L, Frederiksen, P, Nielsen, C, Mikkelsen, K, Gothelf, K, & Ogilby, P 2005, 'Two-Photon Photosensitized Production of Singlet Oxygen: Sensitizers with Phenylene-Ethynylene-Based Chromophores' J. Org. Chem., vol. 70, s. 1134-1146.

Nielsen, C, Forster, J, Ogilby, P, & Nielsen, S 2005, 'Delayed Dissociation of Photoexcited Porphyrin Cations in a Storage Ring: Determination of Triplet Quantum Yields' J. Phys. Chem. A., vol. 109, s. 3875-3879.

Nielsen, C, Johnsen, M, Arnbjerg, J, Pittelkow, M, McIlroy, S, Ogilby, P, & Jørgensen, M 2005, 'Synthesis and Characterization of Water-Soluble Phenylene-Vinylene-Based Singlet Oxygen Sensitizers for Two-Photon Excitation' J. Org. Chem., vol. 70, s. 7065-7079.

Nielsen, C, Andersen, T, & Keiding, SR 2005, 'Stability analysis of an all-fiber coupled cavity Fabry-Perot additive pulse mode-locked laser' IEEE Journal of Quantum Electronics, vol. 41, nr. 2, s. 198-204.

Nielsen, CK, Andersen, TV, & Keiding, SR 2005, 'Stability Analysis of an All-fiber Coupled Cavity Fabry-Perot Additive Pulse Mode-Locked laser' IEEE JOURNAL OF QUANTUM ELECTRONICS, vol. 41, nr. 2, s. 198-204.

Nielsen, M, Dauksaite, V, Kjems, J, & Gothelf, K 2005, 'DNA-Directed Coupling of Organic Modules by Multiple Parallel Reductive Aminations and Subsequent Cleavage of Selected DNA Sequences' Bioconjugate Chem., vol. 16, nr. 4, s. 981-985.

Nielsen, M, Dauksaite, V, Kjems, J, & Gothelf, KV 2005, 'DNA-Directed Coupling of Organic Modules by Multiple Parallel Reductive Aminations and Subsequent Cleavage of Selected DNA-Sequences' Bioconjug. Chem., vol. 16, s. 981-985.

Nielsen, N, Thomsen, A, Jensen, T, Jakobsen, H, Skibsted, J, & Gothelf, K 2005, 'Formation and Structure of Conjugated Salen-Cross-Linked Polymers and Their Application in Asymmetric Heterogeneous Catalysis' Eur. J. Org. Chem., s. 342-347.

Olsen, J, Jørgensen, P, Helgaker, T, & Oddershede, J 2005, 'Quadratic Response Functions in a Second-Order Polarization Propagator Framework' Journal of Physical Chemistry A, vol. 109, s. 11618-11628.

Ortega-Caballero, F, Bjerre, J, Laustsen, L, & Bols, M 2005, 'Four orders of magnitude rate increase in artificial enzyme catalysed aryl glycoside hydrolysis' J. Org. Chem., vol. 70, s. 7217-7226.

Ortega-Caballero, F, Christensen, B, Rousseau, C, Petersen, TE, & Bols, M 2005, 'Remarkable supramolecular catalysis of glycoside hydrolysis by a cyclodextrin cyanohydrin' J. Am. Chem. Soc., vol. 127, s. 3238-9.

Ortega-Caballero, F, Rousseau, C, Christensen, B, Petersen, T, & Bols, M 2005, 'Remarkable Supramolecular Catalysis of Glycoside Hydrolysis by a Cyclodextrin Cyanohydrin' J. Am. Chem. Soc., vol. 127, s. 3238-3239.

Osted, A, Kongsted, J, & Christiansen, O 2005, 'Theoretical study of the electronic gas-phase spectrum of glycine, alanine, and related amines and carboxylic acids' Journal of Physical Chemistry A, vol. 109, s. 1430-1440.

Overgaard, J, Svendsen, H, Chevalier, M, & Iversen, B 2005, 'Tetraaquatetrakis(dimethylacetamide-κO)neodymium(III) hexacyanoferrate(III) trihydrate' Acta Crystallogr. E, vol. 61, s. 268-270.

Overgaard, J, Chevallier, M, & Iversen, B 2005, 'Bis(μ-diacetylacetonato)bis[pyridinecopper(II)]' Acta Crystallogr. E, vol. 61, s. 922-924.

Pawlowski, F, Jørgensen, P, & Hättig, C 2005, 'Cauchy Moments of Ne, Ar, and Kr Atoms Calculated Using the Approximate Coupled Cluster Triples Model CC3' Advances in Quantum Chemistry, vol. 48, s. 9-21.

Pawlowski, F, Jørgensen, P, & Hättig, C 2005, 'The second hyperpolarizability of the N ₂ molecule calculated using the approximate coupled cluster triples model CC3' Chemical Physics Letters, vol. 413, s. 272-279.

Pedersen, C, & Bols, M 2005, 'Stereochemical substituent effects: Investigation of the cyano, amide and carboxylate group' Tetrahedron, vol. 61, s. 115-122.

Pedersen, C, Marinescu, L, & Bols, M 2005, 'Radical substitution with azide: TMSN3/PhI(OAc)2 as a substitute of IN3' Org. Biomol. Chem., vol. 3, s. 816-822.

Pedersen, JS, & Sommer, C 2005, 'Temperature dependence of the virial coefficients and the chi parameter in semi-dilute solutions of PEG' Progress in Colloid and Polymer Science, vol. 130, s. 1-9.

Pind, N, Hazell, RG, Jensen, TR, Sørensen, MB, & Chevallier, J 2005, 'Cobalt substitution in a nano-porous zinc phosphate; Hydrothermal Synthesis and Crystal Structure' Microporous and Mesoporous Materials, vol. 84, s. 144-152.

Poulsen, R, Bentien, A, Chevallier, M, & Iversen, B 2005, 'Synthesis, Physical Properties, Multitemperature Crystal Structure, and 20 K Synchrotron X-ray Charge Density of a Magnetic Metal Organic Framework Structure,Mn ₃ (C ₈ O ₄ H ₄ ) ₃ (C ₅ H ₁₁ ON) ₂ ' J. Am. Ceram. Soc., vol. 127, s. 9156-9166.

Poulsen, R, Overgaard, J, Chevallier, M, Clausen, H, & Iversen, B 2005, 'A gadolinium-based metal-organic framework, poly[[tris(μ ₄ -benzene-1,4-dicarboxylato)bis(μ ₂ -N,N-diethylformamide)digadolinium(III)] monohydrate]' Acta Crystallogr. E, vol. 61, s. 1337-1339.

Poulsen, RD, Overgaard, J, Chevallier, MS, Clausen, HF, & Iversen, BB 2005, 'Poly(sesqui(4-biphenyl-4,4'-dicarboxylato-4O:O':O'':O''')(diethylformamide-O)gadolinium)' Acta Crystallographica E, vol. 61, s. 2308-2310.

Poulsen, TB, Alemparte Gallardo, C, Saaby, S, Bella, M, & Jørgensen, KA 2005, 'Direct Organocatalytic Highly Enantio- and Diastereoselective Mannich Reaction of &alpha-Substituted &alpha-Cyanoacetates' Angewandte Chemie. International edition. English, vol. 44, s. 2896.

Poulsen, TB, Alemparte Gallardo, C, & Jørgensen, KA 2005, 'Enantioselective Organocatalytic Allylic Amination' Journal of the American Chemical Society, vol. 127, s. 116114.

Prieto, A, Halland, N, & Jørgensen, KA 2005, 'A Novel Imidazolidine-Tetrazole Organocatalyst of Asymmetric Conjugate Addition of Nitroalkanes' Organic Letters, vol. 7, s. 3897.

Rajaraman, G, Christensen, K, Larsen, F, Timco, G, & Winpenny, R 2005, 'Theoretical studies on di- and tetra-nuclear Ni pivalate complexes' Chem. Commun., s. 3053-3055.

Rousseau, C, Christensen, B, & Bols, M 2005, 'Artificial Epoxidase II. Synthesis of cyclodextrin ketoesters and epoxidation of alkenes' Eur. J. Org. Chem., s. 2734-2739.

Rousseau, C, Nordstrøm, L, Caballero, F, Christensen, B, Pedersen, T, & Bols, M 2005, 'Artificial Glycosyl phosphorylases' Chem. Eur. J., vol. 11, s. 5094-5101.

Sablinskas, V, Hegelund, F, Ceponkus, J, Bariseviciute, R, Aleksa, V, & Nelander, B 2005, 'A High-Resolution FT-IR Study of the Fundamental Bands nu7, nu8, and nu18 of Ethene Secondary Ozonide' J. Phys. Chem. A., vol. 109, s. 8791-8723.

Sancho-García, J, Brédas, J, Beljonne, D, Cornil, J, Martínez-Álvarez, R, Hanack, M, Poulsen, L, Gierschner, J, Mack, H, Egelhaaf, H, & Oelkrug, D 2005, 'Design of pi-Conjugated Organic Materials for One-Dimensional Energy Transport in Nanochannels' J. Phys. Chem. B., vol. 109, s. 48-72.

Sivertsen, A, Bjerring, M, Kehlet, C, Vosegaard, T, & Nielsen, N 2005, 'Numerical Simulations in Biological Solid-State NMR Spectroscopy' Ann. R. NMR. S., vol. 54, s. 243-293.

Skovsen, E, Snyder, J, Lambert, J, & Ogilby, P 2005, 'Lifetime and Diffusion of Singlet Oxygen in a Cell' J. Phys. Chem. B., vol. 109, s. 8570-8573.

Skovsen, E, Snyder, J, Lambert, JDC, & Ogilby, PR 2005, 'Lifetime and diffusion of singlet oxygen in a cell.' Journal of Physical Chemistry B, vol. 109, s. 8570-8573.

Snyder, J, Gao, Z, Lambert, J, & Ogilby, P 2005, 'The Imaging of Singlet Oxygen in Single Cells' Proceedings of SPIE, vol. 5689, s. 17-25.

Snyder, J, Gao, Z, & Ogilby, P 2005, 'Application of a dithered sampling technique to increase the spatial resolution of singlet oxygen images' Rev. Sci. Instrum., vol. 76, nr. 1, s. 13701-13701.

Snyder, J, Skovsen, E, Lambert, J, & Ogilby, P 2005, 'Subcellular, Time-Resolved Studies of Singlet Oxygen in Single Cells' J. Am. Chem. Soc., vol. 127, s. 14558-14559.

Snyder, J, Skovsen, E, Lambert, JDC, & Ogilby, PR 2005, 'Subcellular, time-resolved studies of singlet oxygen in single cells.' Journal of the American Chemical Society, vol. 127, s. 14558-14559.

Sommer, C, Pedersen, JS, & Garamus, V 2005, 'Structure and Interactions of Block Copolymer Micelles of Brij-700 studied by combining Small-Angle X-ray and Neutron Scattering' Langmuir, vol. 21, s. 2137-2149.

Stiewe, C, Bertini, L, Toprak, M, Christensen, M, Platzek, D, Williams, S, Gatti, C, Müller, E, Iversen, B, Muhammed, M, & Rowe, M 2005, 'Nanostructured Co _1-x Ni _x (Sb _1-y Te _y ) ₃ skutterudites: Theoretical modeling, synthesis and thermoelectric properties' J. Appl. Phys., vol. 97, s. 044317-1-044317-7.

Sørensen, M, Hazell, R, Bentien, A, Bond, A, & Jensen, T 2005, 'Two new cobaltzinc orthophosphate monohydrates: hydrothermal synthesis, crystal structures and thermal investigation' J. Chem. Soc. Dalton, nr. 3, s. 598-606.

Thogersen, J, Madsen, E, Holmegaard, L, Knak Jensen, S, Keiding, S, Matsuura, Y, & Miyagi, M 2005, 'Characterization of Ultraviolet Femtosecond Pulse Propagation in Aluminum Coated Capillary Fibers' J. Appl. Phys., vol. 98, s. 33519-1 - 33519-5.

Thøgersen, L, Olsen, J, Köhn, A, Jørgensen, P, Salek, P, & Helgaker, T 2005, 'The trust-region self-consistent field method in Kohn-Sham density-functional theory' Journal of Chemical Physics, vol. 123, s. 074103-1-17.

Timco, G, Batsanov, A, Larsen, F, Muryn, C, Overgaard, J, Teat, S, & Winpenny, R 2005, 'Influencing the nuclearity and constitution of heterometallic rings via templates' Chem. Commun., vol. 29, s. 3649-3651.

Vase, KH, Holm, AH, Pedersen, SU, & Daasbjerg, K 2005, 'Immobilization of Aryl and Alkynyl Groups onto Glassy Carbon Surfaces by Electrochemical Reduction of Iodonium Salts' Langmuir, vol. 21, s. 8085-8089.

Viskolcz, B, & Knak Jensen, S 2005, 'Theoretical studies of carbon dioxide catalysis of peroxynitrite isomerizations' J. Mol. Struc. - Theochem., vol. 731, s. 57-60.

Vosegaard, T, Kehlet, C, Khaneja, N, Glaser, S, & Nielsen, NC 2005, 'Improved excitation schemes for multiple-quantum magic-angle spinning for quadrupolar nuclei designed using optimal control theory' J. Am. Chem. Soc., vol. 127, s. 13768-13769.

Wugt Larsen, R, Hegelund, F, & Nelander, B 2005, 'Observation and Rovibrational Analysis of the Intermolecular NH3 Libration Band nu9 of H3N-HCN' J. Phys. Chem. A., vol. 109, s. 4459-4463.

Wugt Larsen, R, Hegelund, F, & Nelander, B 2005, 'Observation and rovibrational analysis of the nu2 band of HCN-H35Cl' Chem. Phys., vol. 310, s. 163-167.

Wugt Larsen, R, Hegelund, F, & Nelander, B 2005, 'Observation and rovibrational analysis of the intermolecular HCl libration band nu6 of HCN-HCl, DCN-HCl and H13CN-HCl' Phys. Chem. Ch. Ph., vol. 7, s. 1953-1959.

Zebger, I, Elorza, A, Salado, J, Alcala, A, Goncalves, E, & Ogilby, P 2005, 'Degradation of Poly(1,4-Phenylene Sulfide) on Exposure to Chlorinated Water' Polym Degrad Stabil, vol. 90, s. 67-77.

Zhou, B, Giavani, T, Bildsøe, H, Skibsted, J, & Jakobsen, H 2005, 'Structure refinement of CsNO ₃ (II) by coupling of ¹⁴ N MAS NMR experiments with WIEN2k DFT calculations' Chem. Phys. Lett., vol. 402, s. 133-137.

Zhuang, W, Hazell, RG, & Jørgensen, KA 2005, 'Enantioselective Friedel-Crafts Type Addition of Indols to Nitroolefins using a Chiral Hydrogen-Bonding Catalyst - Synthesis of Optically Active Tetrahydro-&beta-Carbolines' Organic and Biomolecular Chemistry, vol. 3, s. 2566.

Zhuang, W, Marigo, M, & Jørgensen, KA 2005, 'Organocatalytic Asymmetric Epoxidation Reactions in Water-Alcohol Solutions' Organic and Biomolecular Chemistry, vol. 3, s. 3883.

Zhuang, W, Poulsen, TB, & Jørgensen, KA 2005, 'A Versatile Catalyst for Asymmetric Reactions of Carbonyl Groups Working Purely by Activation through Hydrogen bonding: Mukaiyama-Aldol, Hetero Diels-Alder and Friedel-Crafts Reactions' Organic and Biomolecular Chemistry, vol. 3, s. 3284.

Konferenceartikel

Bentien, A, Madsen, GKH, Johnsen, S, & Iversen, BB 2005, 'Thermoelectric properties of hole doped FeSb2' I ICT Proceedings, s. 186-188.

Høyer, B, & Gulamhusein, A 2005, 'Udvaskning og immobilisering af arsen i jord - laboratoriestudie' I ATV Vintermøde om jord- og grundvandsforurening, 8. marts 2005 - 9. marts 2005, ATV, Lyngby, s. 467-478.

Johnsen, S, Bentien, A, Madsen, GKH, Nygren, M, & Iversen, BB 2005, 'Copper Containing Germanium Clathrates' I ICT Proceedings, s. 2211-2214.

Pedersen, SU, & Daasbjerg, K 2005, 'Electrogeneration, Redox Properties and Applications of Organic Radicals' I Book of Abstracts, s. 51.

Bidrag til videnskabelig bog/antologi

Iversen, BB 2005, 'Structural analysis of thermoelectric materials' i: CRC Handbook of Thermoelectric Materials, s. 21.1-21.19.

Jakobsen, HJ (red.) 2005, '-' i: Magnetic Resonance in Food Science, The Multivariate Challenge. The Royal Society of Chemistry.

Kongsted, J, Osted, A, Mikkelsen, K, & Christiansen, O 2005, 'The (Hyper)Polarizabilities of Liquid Water Modelled Using Coupled Cluster/Molecular Mechanics Response Theory Methods' i: Atoms, Molecules and Clusters in electric fields. Theoretical approaches to the calculation of electric polarizability.

Marinescu, L, & Bols, M 2005, 'Iodine Azide: First Update' i: Electronic Encyclopedia of Reagents for Organic Synthesis, s. 1-9.

Nielsen, NC 2005, 'Computational Aspects of Biological Solid-State NMR Spectroscopy' i: NMR Spectroscopy of Biological Solids. Taylor and Francis.

Nielsen, NC, Vosegaard, T, & Malmendal, A 2005, 'Analytical and Numerical Tools for Experiment Design in Solid-State NMR Spectroscopy' i: Handbook of Modern Magnetic Resonance.

Snyder, J, Gao, Z, Lambert, JDC, & Ogilby, PR 2005, 'The imaging of singlet oxygen in single cells.' i: Optical Methods for Tumor Treatment and Detection: Mechanisms and Techniques in Photodynamic Therapy XIV, The International Society for Optical Engineering s. 17-25.

Ph.d.-afhandling

Nielsen, M 2005, 'Application of Metal-Salens in Self-Assembled Monolayers, Catalysis and DNA-Directed Assembly of Nanostructures' Ph.d.-afhandling, Kemisk Institut, Aarhus Universitet.

Videnskabelig bog/antologi

Britz, D 2005, Digital Simulation in Electrochemistry Springer Verlag, Berlin, Heidelberg.