Department of Chemistry

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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 the Department of Chemistry

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Fantner, G. E., Birkedal, H., Kindt, J. H., Hassenkam, T., Weaver, J. C., Cutroni, J. A., Bosma, B. L., Bawazer, L., Finch, M. M., Cidade, G. A. G., Morse, D. E., Stucky, G. D. & Hansma, P. K. (2004). Influence of the degradation of the organic matrix on the microscopic fracture behavior of trabecular bone. Bone, 35, 1013-1022.
Cargnoni, F., Nishibori, E., Rabiller, P., Bertini, L., Snyder, G. J., Christensen, M., Gatti, C. & Iversen, B. B. (2004). Interstitial Zn Atoms Do the Trick in Thermoelectric Zinc Antimonide, Zn4Sb3: A Combined Maximum Entropy Method X-ray Electron Density and Ab Initio Electronic Structure Study. Chemistry - A European Journal, 10, 3861-3870.
Stapelfeldt, H. (2004). Laser aligned molecules: Applications in physics and chemistry. Physica Scripta, T110, 132.
Laskowski, R., Madsen, G. K. H., Blaha, P. & Schwarz, K. (2004). Magnetic structure and electric-field gradients of uranium dioxide: An ab initio study. Physical Review B, 69, 140408-140408.
Enemærke, R. J., Larsen, J., Skrydstrup, T. & Daasbjerg, K. (2004). Mechanistic Investigation of the Electrochemical Reduction of Cp2TiCl2. Organometallics, 23, 1866-1874.
McKenna, B. J., Birkedal, H., Bartl, M. H., Denning, J. & Stucky, G. D. (2004). Micrometer-Sized Spherical Assemblies of Polypeptides and Small Molecules by Acid-Base Chemistry. Angewandte Chemie International Edition, 43, 5652-5655.
Arnbjerg, J., Johnsen, M., Schack, N. B. & Ogilby, P. R. (2004). Mikroskopi med singlet oxygen. Dansk Kemi, 85(11), 29-31.
Bachmann, S., Knudsen, K. R. & Jørgensen, K. A. (2004). Mimicking enzymatic transaminations: attempts to understand and develop a catalytic asymmetric approach to chiral alpha-amino acids. Organic and Biomolecular Chemistry, 2, 2044-2049.
Gothelf, K. V., Thomsen, A., Nielsen, M., Cló, E. & Brown, R. S. (2004). Modular DNA-programmed assembly of linear and branched conjugated nanostructures. J. Amer. Chem. Soc., 126, 1044-1046.
Gothelf, K. V., Thomsen, A., Nielsen, M., Clo, E. & Brown, R. S. (2004). Modular DNA-Programmed Assembly of Linear and Branched Conjugated Nanostructures. Journal of the American Chemical Society, 126, 1044-1046.
Pan, Y., Birkedal, H., Pattison, P., Brown, D. & Chapuis, G. (2004). Molecular Dynamics Study of Tryptophylglycine: A Dipeptide Nanotube with Confined Water. Journal of Physical Chemistry B, 108, 6458-6466.
Cannavacciuolo, L. & Pedersen, J. S. (2004). Moments and distribution function of polyelectrolyte chains. Journal of Chemical Physics, 120(18), 8862-8865.
Svaneborg, C. & Pedersen, J. S. (2004). Monte Carlo simulations and analysis of scattering from neutral and polyelectrolyte polymer and polymer-like systems. Current Opinion in Colloid & Interface Science, 8(6), 507-514. https://doi.org/10.1016/j.cocis.2004.01.001
Poulsen, M. D., Péronne, E., Stapelfeldt, H., Bisgaard, C., Viftrup, S., Hamilton, E. & Seideman, T. (2004). Nonadiabatic alignment of asymmetric top molecules: Rotational revivals. Journal of Chemical Physics, 121, 783-791.
Péronne, E., Poulsen, M. D., Stapelfeldt, H., Bisgaard, C. Z., Hamilton, H. & Seideman, T. (2004). Nonadiabatic laser-induced alignment of iodobenzene molecules. Physical Review A, 70, 63410-63411.
Larsen, R. W., Hegelund, F. & Nelander, B. (2004). Observation and assignment of the hot band nu2+nu9-nu9 in (HCN)2. Phys. Chem. Ch. Ph., 6, 3077-3080.
Larsen, R. W., Hegelund, F. & Nelander, B. (2004). Observation and Rovibrational Analysis of the Intermolecular HCl Libration Band nu4 in OC-HCl. Modelling of the Intermolecular Potential Energy Surface. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 108, 1524-1530.
Bisgaard, C., Poulsen, M. D., Peronne, E., Viftrup, S. & Stapelfeldt, H. (2004). Observation of enhanced field-free molecular alignment by two laser pulses. Phys. Rev. Lett. 173004, 92, 1-4.
Svith, H., Jensen, H., Almstedt, J., Andersson, P., Lundbäck, T., Daasbjerg, K. & Jonsson, M. (2004). On the Nature of Solvent Effects on Redox Properties. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 108, 4805-4811.
Schiøtt, B. (2004). On the Possible Involvement of Collective Domain Movement in the Catalytic Reaction of Soluble Epoxide Hydrolase. Int. J. Qantum. Chem., 99.
Acocella, M. R., Mancheño García, O., Bella, M. & Jørgensen, K. A. (2004). Organocatalytic Asymmetric Hydroxylation of beta-Keto Esters: Metal-Free Synthesis of Optically Active anti-Diols. J. Org. Chem., 69, 8165-8167.
Bella, M. & Jørgensen, K. A. (2004). Organocatalytic Enantioselective Conjugate Addition to Alkynones. Journal of the American Chemical Society, 126.
Ivarsen, A., Thøgersen, J., Keiding, S. R. & Møller-Pedersen, T. (2004). Plastic particles at the LASIK interface. Ophthalmology, 111, 18-23.
Jensen, T. R. (2004). Poul la Cour og vindmøllerne. Aktuel Naturvidenskab, 2.
Larsen, J., Rasmussen, B. S., Hazell, R. G. & Skrydstrup, T. (2004). Preparation of a novel diphosphine-palladium macrocyclic complex possessing a molecular recognition site. Oxidative addition studies. Chemical Communications, 202-203.
Johannesen, S. A., Albu, S., Hazell, R. G. & Skrydstrup, T. (2004). Radical addition of nitrones to acrylates mediated by SmI2: asymmetric synthesis of α-amino acids employing carbohydrate-based chiral auxilliaries. Chemical Communications, 1962-1963.
Bieniasz, L. K. & Britz, D. (2004). Recent developments in digital simulation of electroanalytical experiments. Polish Journal of Chemistry, 78, 1195-1219.
Britz, D., Poulsen, K. & Strutwolf, J. (2004). Reference values of the diffusion-limited current at a disk electrode. Electrochimica Acta, 50, 107-113.
Dietz, R., Riget, F., Hobson, K. A., Heide-Jørgensen, M. P., Møller, P., Cleemann, M., de Boer, J. & Glasius, M. (2004). Regional and inter annual patterns of heavy metals, organochlorines and stable isotopes in narwhals (Monodon monoceros) from West Greenland. Science of the Total Environment, 331(1-3), 83-105. https://doi.org/10.1016/j.scitotenv.2004.03.041
Enemærke, R. J., Larsen, J., Skrydstrup, T. & Daasbjerg, K. (2004). Revelation of the Nature of the Reducing Species in Titanocene Halide Promoted Reductions. Journal of the American Chemical Society, 126, 7853-7864.
Castelletto, V., Hamley, I. W., Xue, W., Sommer, C., Pedersen, J. S. & Olmsted, P. D. (2004). Rheological and structural characterization of hydrophobically modified polyacrylamide solutions in the semidilute regime. Macromolecules, 37(4), 1492-1501.
Pedersen, J. S. & Schurtenberger, P. (2004). Scattering functions of semidilute solutions of polymers in a good solvent. Journal of Polymer Science. Part B, Polymer Physics, 42, 3081-3094.
Lipschutz, B. H., Frieman, B. & Birkedal, H. (2004). Scavenging and Reclaiming Phosphines Associated with Group 10 Metal-Mediated Couplings. Org. Lett., 6, 2305-2308.
Kongsted, J., Osted, A., Mikkelsen, K. V. & Christiansen, O. (2004). Second harmonic generation second hyperpolarizability of water calculated using the combined coupled cluster dielectric continuum or different molecular mechanics methods. Journal of Chemical Physics, 120, 3787-3798.
Brown, R. S., Nielsen, M. & Gothelf, K. V. (2004). Self-assembly of aluminium-salen coupled nanostructures from encoded modules with cleavable disulphide DNA-linkers. Chemical Communications, 13, 1464-1465.
Snyder, J. W., Zebger, I., Gao, Z., Poulsen, L., Frederiksen, P. K., Skovsen, E., McIlroy, S. P., Klinger, M., Andersen, L. K. & Ogilby, P. R. (2004). Singlet Oxygen Microscope: From Phase-Separated Polymers to Single Biological Cells. Accounts of Chemical Research, 37, 894-901.
Stieger, M., Richtering, W., Pedersen, J. S. & Lindner, P. (2004). Small-angle neutron scattering study of structural changes in temperature sensitive microgel colloids. Journal of Chemical Physics, 120(13), 6197-6206.
Castelletto, V., Hamley, I. W. & Pedersen, J. S. (2004). Small-angle neutron scattering study of the structure of superswollen micelles formed by a highly asymmetric poly(oxybutylene)-poly(oxyethylene) diblock copolymer in aqueous solution. Langmuir, 20(7), 2992-2994.
Kongsted, J., Pedersen, T. B., Osted, A., Hansen, A. E., Mikkelsen, K. V. & Christiansen, O. (2004). Solvent effects on rotatory strength tensors. 1. Theory and application of the combined coupled cluster/dielectric continuum model. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 108, 3632-3641.
Kongsted, J., Osted, A., Mikkelsen, K. V., Astrand, P. O. & Christiansen, O. (2004). Solvent effects on the n -pi(*) electronic transition in formaldehyde: A combined coupled cluster/molecular dynamics study. Journal of Chemical Physics, 8435-8445.
Godovsky, Y. K., Brezesinski, G., Ruiz-Garcia, J., Möhwald, H., Jensen, T. R., Kjaer, K. & Makarova, N. N. (2004). Stepwise Collapse of Cyclolinear Polysiloxane Langmuir Monolayers Studied by Brewster Angle Microscopy and Grazing Incidence X-ray Diffraction. Macromolecules, 37(13), 4872-4881.
Overgaard, J., Rentschler, E., Timco, G. A. & Larsen, F. K. (2004). Structural and Magnetic Investigations of the Mixed-Valence FeII,III Two-Dimensional Layer Complex, [Fe2IIFe2III(HCOO)10(C6H7N)6]n. ChemPhysChem, 5, 1755-1761.
Andersson, N., Alberius, P. C. A., Pedersen, J. S. & Bergstrom, L. (2004). Structural features and adsorption behaviour of mesoporous silica particles formed from droplets generated in a spraying chamber. Micropor. Mesopor. Mat., 72(1-3), 175-183.
Christensen, M., Iversen, B. B., Bertine, L., Gatti, C., Toprak, M., Muhammed, M. & Nishibori, E. (2004). Structural study of Fe doped and Ni substituted thermoelectric skutterudites by combined synchrotron and neutron powder diffraction and ab initio theory. Journal of Applied Physics, 96(6), 3148-3157.
Wugt Larsen, R., Hegelund, F. & Nelander, B. (2004). Studies of intermolecular vibrations in hydrogen-bonded molecular complexes for the gas phase using a synchrotron radition source. Mol. Phys., 102(16-17), 1743-1747.
Hansen, M. R., Vosegaard, T., Jakobsen, H. J. & Skibsted, J. (2004). 11B Chemical Shift Anisotropies in Borates from 11B MAS, MQMAS, and Single-Crystal NMR Spectroscopy. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 108, 586-594.
Poulsen, R. D., Bentien, A., Graber, T. & Iversen, B. B. (2004). Synchrotron charge-density studies in materials chemistry: 16 K X-ray charge density of a new magnetic metal-organic framework material,(Mn2(C8H4O4)2(C3H7NO)2. Acta Crystallographica Section A: Foundations and Advances, 60, 382-389.
Liu, H., Lillelund, V. H., Andersch, J., Liang, X. & Bols, M. (2004). Synthesis and chemistry of noeuromycin and isofagomine analogues. J. Carb. Chem, 23, 223-238.
Nielsen, M., Thomsen, A. H., Clo, E., Kirpekar, F. & Gothelf, K. V. (2004). Synthesis of Linear and Tripoidal Oligo(phenylene ethynylene)-Based Building Blocks for Application in Modular DNA-Programmed Assembly. J. Org. Chem., 69, 2240-2250.
Nielsen, N. C., Malmendal, A. & Vosegaard, T. (2004). Techniques and Applications of NMR to Membrane Proteins. Mol. Membr. Biol., 21, 129-141.

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Revised 08.05.2026
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Department of Chemistry