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Department of Chemistry

Publications

The Department of Chemistry is one of the most productive departments at Aarhus University. A considerable number of articles are published every year.

Publications from Department of Chemistry

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Paterson, M. J., Christiansen, O., Jensen, F. & Ogilby, P. R. (2006). Overview of Theoretical and Computational Methods Applied to the Oxygen-Organic Molecule Photosystem. Photochemistry and Photobiology, 82, 1136-1160. https://doi.org/10.1562/2006-03-17-IR-851

Flors, C., Ogilby, P. R., Luis, J. G., Grillo, T. A., Izquierdo, L. R., Gentili, P. L., Bussotti, L. & Nonell, S. (2006). Phototoxic Phytoalexins. Processes that Compete with the Photosensitized Production of Singlet Oxygen by 9-Phenylphenalenones. Photochemistry and Photobiology, 82, 95-103.

Hove, A. R., Bildsøe, H. K., Skibsted, J. B., Brorson, M. & Jakobsen, H. J. (2006). Probing Crystal Structures and Transformation Reactions of Ammonium Molybdates by ¹⁴N MAS NMR Spectroscopy. Inorg. Chem., 45, 10873-10881.

Hansen, J. A., Wang, J., kawde, A.-N., Xiang, Y., Gothelf, K. V. & Collins, G. (2006). Quantum-Dot/Aptamer-Based Ultrasensitive Multi-Analyte Electrochemical Biosensor. Journal of the American Chemical Society, 128, 2228-2229.

Maetzke, A. & Jensen, S. K. (2006). Reaction paths for production of singlet oxygen from hydrogen peroxide and hypochlorite. Chemical Physics Letters, 425, 40-43.

Kumarappan, V., Bisgaard, C. Z., Viftrup, S., Holmegaard, L. & Stapelfeldt, H. (2006). Role of rotational temperature in adiabatic molecular alignment. Journal of Chemical Physics, 125, 194309.

Jakobsen, H. J., Hove, A. R., Bildsøe, H. K. & Skibsted, J. B. (2006). Satellite transitions in natural abundance solid-state ³³S MAS NMR of alums - Sign change with zero-crossing of C_Q in a variable temperature study. Journal of Magnetic Resonance, 179, 444-451.

Britz, D. (2006). Setting the record straight on reciprocal derivative chronopotentiometry. International Journal of Electrochemical Science, 1, 379-382.

Ogilby, P. R. (2006). Singlet Oxygen. Photochemistry and Photobiology, 82, 1133-1135.

Jakobsen, H. J., Hove, A. R., Hazell, R. G., Bildsøe, H. K. & Skibsted, J. B. (2006). Solid-state ¹⁴N MAS NMR of ammonium ions as a spy to structural insights for ammonium salts. Magn. Reson. Chem., 44, 348-356.

Poulsen, R. D., Bentien, A., Christensen, M. & Iversen, B. B. (2006). Solvothermal synthesis, multi-temperature crystal structures and physical properties of isostructural coordination polymers, 2C₄H₁₂N⁺[M₃(C₈H₄O₄)₄]^2-.3C₅H₁₁NO, M = Co,Zn: . Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 62, 245-254.

Bang, J., Jain, S., Li, Z., Lodge, T. P., Pedersen, J. S., Kesselman, E. & Talmon, Y. (2006). Sphere, Cylinder, and Vesicle Nanoaggregates in Poly(styrene-b-isoprene) Diblock Copolymer Solutions. Macromolecules, 39, 1199-1208.

Osted, A., Kongsted, J., Mikkelsen, K. V., Aastrand, P. O. & Christiansen, O. (2006). Statistical mechanically averaged molecularproperties of liquid water calculated using the combinedcoupled cluster/molecular dynamics method. Journal of Chemical Physics, 124, 124503-1- 124503-16.

Bols, M. & Jensen, H. H. (2006). Stereoelectronic Substituent Effects. Acc. Chem. Res., 39, 259-265.

Bentien, A., Johnsen, S. & Iversen, B. B. (2006). Strong phonon charge carrier coupling in thermoelectric clathrates. Physical Review B, 73, 94301-1 - 94301-4.

Skibsted, J. B., Andersen, M. D. & Jakobsen, H. J. (2006). Structural Investigations of Portland Cement Components, Hydration, and Effects of Admixtures by Solid-State NMR Spectroscopy. In 16th IBAUSIL - Internationale Baustofftagung, Weimar, Germany: 16th IBAUSIL - Internationale Baustofftagung, Weimar, Germany, 20. - 23. September 2006 (Vol. 1, pp. 297-312). Dorothea Rohrmann.

Andersen, C. B. F., Becker, T., Blau, M., Anand, M., Halic, M., Balar, B., Mielke, T., Boesen, T., Pedersen, J. S., Spahn, C. M. T., Kinzy, T. G., Andersen, G. R. & Beckmann, R. (2006). Structure of eEF3 and the mechanism of transfer RNA release from the E-site. Nature, 443, 663-668.

Andersen, C. B. F., Ballut, L., Johansen, J. S., Chamieh, H., Nielsen, K. H., Oliveira, C., Pedersen, J. S., Seraphin, B., LeHir, H. & Andersen, G. R. (2006). Structure of the exon junction core complex with a trapped DEAD-box ATPase bound to RNA. Science, 313, 1968-1972.

Shanmugam, M., Engelhardt, L. P., Larsen, F. K., Luban, M., McInnes, E. J. L., Muryn, C. A., Overgaard, J., Rentschler, E., Timco, G. A. & Winpenny, R. E. P. (2006). Studies of a Molecular Hourglass: Synthesis and Magnetic Characterisation of a Cyclic Dodecanuclear {Cr₁₀Cu₂} Complex. Chemistry: A European Journal, 12, 8267-8275.

Townsend, D., Satzger, H., Ejdrup, T., Lee, A., Stapelfeldt, H. & Stolow, A. (2006). ¹B₂ (¹S_u⁺)Excited state dynamics in CS₂. Journal of Chemical Physics, 125, 234302.

Hald, P., Becker-Christensen, J., Bremholm, M., Pedersen, J. S., Chevallier, J., Brummerstedt Iversen, S. & Iversen, B. B. (2006). Supercritical Propanol-Water Synthesis and Comprehensive Size Characterisation of Highly Crystalline anatase TiO₂ Nanoparticles. Journal of Solid State Chemistry, 179, 2674-2680. https://doi.org/10.1016/j.jssc.2006.05.012

Nielsen, K. A., Cho, W.-S., Sarova, G. H., Petersen, B. M., Bond, A. D., Becher, J., Jensen, F., Guldi, D. M., Sessler, J. L. & Jeppesen, J. O. (2006). Supramolecular receptor design: Anion-triggered binding of C. Angewandte Chemie International Edition, 45(41), 6848-6853. https://doi.org/10.1002/anie.200602724

Poulsen, R. D., Bentien, A., Christensen, M. & Iversen, B. B. (2006). Synthesis, Crystal Structures and Physical Properties of Two Isomorphous Nanoporous Metal Organic Framework Materials, M₃(C₈O₄H₄)₄(C₅H₁₁ON)₃(C₄H₁₂N)₂, M = Zn,Co. Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 62, 245-254.

Blakskjær, P. & Gothelf, K. V. (2006). Synthesis of an elongated linear oligo(phenylene ethynylene)-based building block for application in DNA-programmed assembly. Organic & Biomolecular Chemistry, 4, 3442-3447.

Johnston, B., Jensen, H. H. & Pinto, B. M. (2006). Synthesis of Sulfonium Analogues of Disaccharides and their conversion to chain-extended homologues of Salacinol: New glycosidase inhibitors. J. Org. Chem., (71), 259-265.

Berndt, I., Pedersen, J. S. & Richtering, W. (2006). Temperature-Sensitive Core-Shell Microgel Particles with Dense Shell. Angewandte Chemie International Edition, 45, 1737-1741.

Jensen, F. (2006). The basis set convergence of spin: spin coupling constants calculated by density functional methods. Journal of Chemical Theory and Computation, 2(5), 1360-1369. https://doi.org/10.1021/ct600166u

Nøjgaard, J. K., Bilde, M., Stenby, C., Nielsen, O. J. & Wolkoff, P. (2006). The effect of nitrogen dioxide on particle formation during ozonolysis of two abundant monoterpenes indoors. Atmospheric Environment, (40), 1030-1042.

Osted, A., Kongsted, J., Mikkelsen, K. V. & Christiansen, O. (2006). The electronic spectrum of the micro solvated Alanine zwitter ion calculated using the combined coupled cluster/molecular mechanics method. Chem. Phys. Letters, 429, 430-435.

Coriani, S., Haaland, A., Helgaker, T. & Jørgensen, P. (2006). The Equilibrium Structure of Ferrocene. ChemPhysChem, 7, 245-249.

Johnsen, S., Bentien, A., Madsen, G. K. H., Nygren, M. & Iversen, B. B. (2006). Thermoelectric Properties of Ba₈Ni₆Ge₄₀ Clathrate. Proc. Int. Conf. Thermoelectrics.

Birkedal, H., Andersen, A. M. K., Arakcheeva, A., Chapuis, G., Norby, P. & Pattison, P. (2006). The Room-Temperature Superstructure of ZrP₂O₇ Is Orthorhombic: There are No Unusual 180^o P-O-P Bond Angles. Inorg. Chem., 45(11), 4346-4351.

Hinrichs, A. S., Karolchik, D., Baertsch, R., Barber, G. P., Bejerano, G., Clawson, H., Diekhans, M., Furey, T. S., Harte, R. A., Hsu, F., Hillman-Jackson, J., Kuhn, R. M., Pedersen, J. S., Pohl, A., Raney, B. J., Rosenbloom, K. R., Siepel, A., Smith, K. E., Sugnet, C. W. ... Pedersen, J. S. (2006). The UCSC Genome Browser Database: update 2006. Nucleic Acids Research, 34(Database issue), D590-8. https://doi.org/10.1093/nar/gkj144

Falsig, H., Gross, A., Kongsted, J., Osted, A., Mikkelsen, K. V. & Christiansen, O. (2006). The uptake of phenol on aerosol particles. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 110, 660-670.

Pedersen, B. L., Birkedal, H., Nishibori, E., Sakata, M. & Iversen, B. B. (2006). Time Induced Changes in Phase Transition Behavior and Stability of Zn₄Sb₃. In R. Ellingson (Ed.), Materials and Basic Research Needs for Solar Energy Conversion (Vol. 945E, pp. 0945-FF07-05). Mater. Res. Soc. Symp. Proc..

Svendsen, H., Overgaard, J., Chevallier, M.-A. S. & Iversen, B. B. (2006). Triaquatetrakis(dimethylacetamide-κO)-gadolinium(III) hexacyanoferrate(III) dihydrate. Acta Crystallographica Section E: Crystallographic Communications, 62, 989-991.

Andresen, E. R., Birkedal, V., Thøgersen, J. & Keiding, S. R. (2006). Tunable light source for coherent anti-Stokes Raman scattering microspectroscopy based on the soliton self-frequency shift. Optics Letters, 13(9), 1328-1330.

Paterson, M. J., Kongsted, J., Christiansen, O., Mikkelsen, K. V. & Nielsen, C. B. (2006). Two-photon absorption cross sections: An investigation of solvent effects.Theoretical studies on formaldehyde and water. Journal of Chemical Physics, 125, 184501-1- 184501-14.

Ogilby, P. R., Arnbjerg, J., Johnsen, M., Frederiksen, P. K. & Braslavsky, S. E. (2006). Two-Photon Photosensitized Production of Singlet Oxygen: Optical and Optoacoustic Characterization of Absolute Two-Photon Absorption Cross Sections for Standard Sensitizers in Different Solvents. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 110(23), 7375-7385.

Skovsen, E., Snyder, J. W. & Ogilby, P. R. (2006). Two-Photon Singlet Oxygen Microscopy: The Challenges of Working with Single Cells. Photochemistry and Photobiology, 82, 1187-1197.

Knudsen, K. R. & Jørgensen, K. A. (2005). A chiral Molecular Recognition Approach to Formation of Quaternary Centers in Asymmetric Synthesis. Organic & Biomolecular Chemistry, 3, 1362.

Gavrila, A., Andersen, L. & Skrydstrup, T. (2005). A convenient and simple procedure for the preparation of nitrate esters from alcohols employing LINO₃/(CF₃CO)₂O. Tetrahedron Letters, 46, 6205-6207.

Alemparte Gallardo, C., Blay, G. & Jørgensen, K. A. (2005). A convenient Procedure for the Catalytic Asymmetric Procedure Cycloaddition of Azomethine Ylides and Alkenes. Organic Letters, 7, 4569.

Laye, R. H., Larsen, F. K., Overgaard, J., Muryn, C. A., McInnes, E. J. L., Rentschler, E., Sanchez, V., Teat, S. J., Güdel, H. U., Waldmann, O., Timco, G. A. & Winpenny, R. E. P. (2005). A family of heterometallic wheels containing potentially fourteen hundred siblings. Chemical Communications, 9, 1125-1127.

Poulsen, R. D., Overgaard, J., Chevallier, M.-A., Clausen, H. F. & Iversen, B. B. (2005). A gadolinium-based metal-organic framework, poly[[tris(μ₄-benzene-1,4-dicarboxylato)bis(μ₂-N,N-diethylformamide)digadolinium(III)] monohydrate]. Acta Crystallographica Section E: Crystallographic Communications, 61, 1337-1339.

Andersson, M., Birkedal, H., Franklin, N. R., Ostomel, T., Boettcher, S., Palmqvist, A. E. C. & Stucky, G. D. (2005). Ag/AgCl-Loaded Ordered Mesoporous Anatase for Photocatalysis. Chemistry of Materials, 17, 1409-1415.

Franzén, J., Marigo, M., Fielenbach, D. G., Wabnitz, T. C., Jensen, A. K. K. & Jørgensen, K. A. (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, 127, 18296.

Andersson, M., Pedersen, J. S. & Palmquist, A. (2005). A Kinetic Study of the Formation of Silver Nanoparticles in Microemulsions Acting Both as Template and Reducing Agent. Langmuir, 21, 11387-11396.

Hamilton, E., Seideman, T., Ejdrup, T., Poulsen, M. D., Bisgaard, C., Viftrup, S. & Stapelfeldt, H. (2005). Alignment of symmetric top molecules by short laser pulses. Physical Review A, 72, 043402.

Bertram, H. C., Kristensen, N. B., Malmendal, A., Nielsen, N. C., Bro, R., Andersen, H. J. & Harmon, D. L. (2005). A metabolomic investigation of splanchnic metabolism using 1H NMR spectroscopy of bovine blood plasma. Analystica Chimica Acta, 536, 1-6.

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Department of Chemistry