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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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Glaser, J. S., Schulte-Herbrüggen, T., Sieveking, M., Schedletzky, O., Nielsen, N. C., Sørensen, O. W. & Griesinger, C. (1998). Unitary Control in Quantum Ensembles: Maximizing Signal Intensity in Coherent Spectroscopy. Science, 280, 421-424.

Untidt, T., Glaser, S. J., Griesinger, C. & Nielsen, N. C. (1999). Unitary bounds; controllability of quantum evolution in NMR spectroscopy. Mol. Phys., 96, 1739-1744.

Sanggaard, K. W., Danielsen, C. C., Wogensen, L., Vinding, M. S., Rydtoft, L. M., Mortensen, M. B., Karring, H., Nielsen, N. C., Wang, T., Thøgersen, I. B. & Enghild, J. J. (2012). Unique structural features facilitate lizard tail autotomy. P L o S One, 7(12), e51803. https://doi.org/10.1371/journal.pone.0051803

Nielsen, J. T., Bjerring, M., Jeppesen, M., Pedersen, R. O., Pedersen, J. M., Hein, K. L., Vosegaard, T., Skrydstrup, T., Otzen, D. & Nielsen, N. C. (2009). Unique identification of supramolecular structures in amyloid fibrils by solid-state NMR spectroscopy. Angewandte Chemie International Edition, 48, 2118-2121.

Zelikin, A. N. (2020). Unique enzymatic repertoire reveals the tumour. Nature Chemistry, 12, 11-12. https://doi.org/10.1038/s41557-019-0400-0

Jensen, F. (2014). Unifying general and segmented contracted basis sets. Segmented polarization consistent basis sets. Journal of Chemical Theory and Computation, 10(3), 1074-1085. https://doi.org/10.1021/ct401026a

Jensen, F. (2023). Unifying Charge-Flow Polarization Models. Journal of Chemical Theory and Computation, 19(13), 4047-4073. https://doi.org/10.1021/acs.jctc.3c00341

Rasmussen, H. Ø., Enghild, J. J., Otzen, D. E. & Pedersen, J. S. (2020). Unfolding and partial refolding of a cellulase from the SDS-denatured state: From β-sheet to α-helix and back. B B A - General Subjects, 1864(1), 129434 1-12. Article 129434. https://doi.org/10.1016/j.bbagen.2019.129434

Elm, J. (2019). Unexpected Growth Coordinate in Large Clusters Consisting of Sulfuric Acid and C ₈ H ₁₂ O ₆ Tricarboxylic Acid. The Journal of Physical Chemistry A, 123(14), 3170-3175. https://doi.org/10.1021/acs.jpca.9b00428

Huynh, T.-P., Wittig, N. K., Andersen, A., Bach-Gansmo, F. L. & Birkedal, H. (2024). Underwater Fabrication of Carbon Nanotube/Coacervate Composites. Langmuir, 40(25), 13010-13016. https://doi.org/10.1021/acs.langmuir.4c00715

Bindzus, N., Cargnoni, F., Iversen, B. B. & Gatti, C. (2015). Understanding the Reorientational Dynamics of Solid-State MBH₄ (M = Li-Cs). The Journal of Physical Chemistry Part C, 119(22), 12109-12118. https://doi.org/10.1021/acs.jpcc.5b00899

Guo, J., Li, Y., Meng, J., Pedersen, K., Gurevich, L. & Stroe, D. I. (2022). Understanding the mechanism of capacity increase during early cycling of commercial NMC/graphite lithium-ion batteries. Journal of Energy Chemistry, 74, 34-44. https://doi.org/10.1016/j.jechem.2022.07.005

Tyrsted, C., Jensen, K. M. Ø., Bøjesen, E. D., Lock, N., Christensen, M., Billinge, S. & Iversen, B. B. (2012). Understanding the Formation and Evolution of Ceria Nanoparticles Under Hydrothermal Conditions. Angewandte Chemie International Edition, 51(36), 9030-9033. https://doi.org/10.1002/anie.201204747

Chen, X., Hu, X. M., Daasbjerg, K. & Ahlquist, M. S. G. (2020). Understanding the Enhanced Catalytic CO₂ Reduction upon Adhering Cobalt Porphyrin to Carbon Nanotubes and the Inverse Loading Effect. Organometallics, 39(9), 1634-1641. https://doi.org/10.1021/acs.organomet.9b00726

Nguyen, Q., Christensen, M. K., Cozzi, F., Zare, A., Hansen, A. M. K., Kristensen, K., Tulinius, T. E., Madsen, H., Christensen, J. H., Brandt, J., Massling, A., Nøjgaard, J. K. & Glasius, M. (2014). Understanding the anthropogenic influence on formation of biogenic secondary organic aerosols in Denmark via analysis of organosulfates and related oxidation products. Atmospheric Chemistry and Physics, 14, 8961-8981. https://doi.org/10.5194/acp-14-8961-2014

Jørgensen, M., Shea, P. T., Tomich, A. E., Varley, J. B., Bercx, M., Lovera, S., Cerný, R., Zhou, W., Udovic, T. J., Lavallo, V., Jensen, T. R., Wood, B. C. & Stavila, V. (2020). Understanding Superionic Conductivity in Lithium and Sodium Salts of Weakly Coordinating Closo-Hexahalocarbaborate Anions. Chemistry of Materials, 32(4), 1475-1487. https://doi.org/10.1021/acs.chemmater.9b04383

Christensen, C. K. & Ravnsbaek, D. B. (2021). Understanding disorder in oxide-based electrode materials for rechargeable batteries. JPhys Energy, 3(3), Article 031002. https://doi.org/10.1088/2515-7655/abf0f1

Peng, S. X., Cheng, Y., Pries, J., Wei, S., Yu, H. B. & Wuttig, M. (2020). Uncovering β-relaxations in amorphous phase-change materials. Science Advances, 6(2), Article eaay6726. https://doi.org/10.1126/sciadv.aay6726

Frølich, S., Weaver, J. C., Dean, M. N. & Birkedal, H. (2017). Uncovering Nature's Design Strategies through Parametric Modeling, Multi-Material 3D Printing, and Mechanical Testing. Advanced Engineering Materials, 19(6), Article e201600848. https://doi.org/10.1002/adem.201600848

Soria, G. D., Granados-Miralles, C., Mandziak, A., Jenuš, P., Saura-Múzquiz, M., Christensen, M., Foerster, M., Aballe, L., Fernández, J. F., de la Figuera, J. & Quesada, A. (2021). Uncorrelated magnetic domains in decoupled SrFe₁₂O₁₉/Co hard/soft bilayers. Journal of Physics D: Applied Physics, 54(5), Article 054003. https://doi.org/10.1088/1361-6463/abc0be

Sun, P., Søndergaard, M., Sun, Y., Johnsen, S., Iversen, B. B. & Steglich, F. (2011). Unchanged thermopower enhancement at the semiconductor-metal transition in correlated FeSb2-xTex. Applied Physics Letters, 98(7), 072105-1 - 072105-3. https://doi.org/10.1063/1.3556645

Blom, J., Reyes Rodriguez, G. J., Tobiesen, H. N., Lamhauge, J. N., Iversen, M. V., Barløse, C. L., Hammer, N., Rusbjerg, M. & Jørgensen, K. A. (2019). Umpolung Strategy for α-Functionalization of Aldehydes for the Addition of Thiols and other Nucleophiles. Angewandte Chemie - International Edition, 58(49), 17856-17862. https://doi.org/10.1002/anie.201911793

Strunge, K., Burgin, T., Golbek, T. W., Roeters, S. J., Pfaendtner, J. & Weidner, T. (2023). Umbrella-like Helical Structure of α-Synuclein at the Air-Water Interface Observed with Experimental and Theoretical Sum Frequency Generation Spectroscopy. The Journal of Physical Chemistry Letters, 14(49), 11030-11035. https://doi.org/10.1021/acs.jpclett.3c02543

Vijayan, H., Knudsen, C. G., Mørch, M. I. & Christensen, M. (2021). Ultrathin nanoplatelets of six-line ferrihydrite enhances the magnetic properties of hexaferrite. Materials Chemistry Frontiers, 5(9), 3699-3709. https://doi.org/10.1039/d1qm00224d

Gómez-Arconada, L., Díaz-Fernández, A. & Ferapontova, E. E. (2022). Ultrasensitive disposable apatasensor for reagentless electrocatalytic detection of thrombin: An O₂-Dependent hemin-G4-aptamer assay on gold screen-printed electrodes. Talanta, 245, Article 123456. https://doi.org/10.1016/j.talanta.2022.123456

Pérez, B., Bulsara, P., Rawlings, A. V., Wei, W., Jensen, M. M., Wang, Z., Dickens, J., Zhang, S., P. Elliot, R., Glasius, M., Dong, MD., Clarke, M. & Guo, Z. (2016). Ultralong Fatty Acyl Derivatives As Occlusive Structure Lipids for Cosmetic Applications: Synthesis and Characterization. ACS Sustainable Chemistry & Engineering, 4(12), 7137–7146. https://doi.org/10.1021/acssuschemeng.6b02021

Zhao, K., Qui, P., Song, Q., Blichfeld, A. B., Eikeland, E. Z., Ren, D., Ge, B., Iversen, B. B., Shi, X. & Chen, L. (2017). Ultrahigh thermoelectric performance in Cu_2−ySe_0.5S_0.5 liquid-like materials. Materials Today Physics, 1, 14-23. https://doi.org/10.1016/j.mtphys.2017.04.003

Wittenborn, T., Nielsen, T., Nygaard, J. V., Larsen, E. K. U., Thim, T., Rydtoft, L. M., Vorup-Jensen, T., Kjems, J., Nielsen, N. C., Horsman, M. R. & Falk, E. (2012). Ultra-High-Field DCE-MRI of Angiogenesis in a Novel Angiogenesis Mouse Model. Journal of Magnetic Resonance Imaging, 35(3), 703-710. https://doi.org/10.1002/jmri.22855

Donovan, M. A., Yimer, Y. Y., Pfaendtner, J., Backus, E. H. G., Bonn, M. & Weidner, T. (2016). Ultrafast Reorientational Dynamics of Leucine at the Air-Water Interface. Journal of the American Chemical Society, 138(16), 5226-5229. https://doi.org/10.1021/jacs.6b01878

Guo, Z., Wang, Y., Heitmüller, J., Sieck, C., Prüfer, A., Ralle, P., Steffen, A., Henke, P., Ogilby, P. R., Marder, T. B., Ma, X. & Brixner, T. (2024). Ultrafast photophysics of para-substituted 2,5-bis(arylethynyl) rhodacyclopentadienes: thermally activated intersystem crossing. Chemical Science, 15(36), 14746-14756. https://doi.org/10.1039/d4sc04306e

Uhd, J., Miotke, L., Ji, H. P., Dunaeva, M., Pruijn, G. J. M., Jørgensen, C. D., Kristoffersen, E. L., Birkedal, V., Yde, C. W., Nielsen, F. C., Hansen, J. & Astakhova, K. (2020). Ultra-fast detection and quantification of nucleic acids by amplification-free fluorescence assay. Analyst, 145(17), 5836-5844. https://doi.org/10.1039/d0an00676a

Erk, B., Rolles, D., Foucar, L., Rudek, B., Epp, S. W., Cryle, M., Bostedt, C., Schorb, S., Bozek, J., Rouzee, A., Hundertmark, A., Marchenko, T., Simon, M., Filsinger, F., Christensen, L., De, S., Trippel, S., Küpper, J., Stapelfeldt, H. ... Rudenko, A. (2013). Ultrafast Charge Rearrangement and Nuclear Dynamics upon Inner-Shell Multiple Ionization of Small Polyatomic Molecules. Physical Review Letters, 110(5), Article 053003. https://doi.org/10.1103/PhysRevLett.110.053003

Mortensen, H. G., Otzen, D. E. & Pedersen, J. S. (2021). Ubiquitin forms conventional decorated micelle structures with sodium dodecyl sulfate at saturation. Journal of Colloid and Interface Science, 596, 233-244. https://doi.org/10.1016/j.jcis.2021.03.110

Rastian, Z., Pütz, S., Wang, Y. J., Kumar, S., Fleissner, F., Weidner, T. & Parekh, S. H. (2018). Type I Collagen from Jellyfish Catostylus mosaicus for Biomaterial Applications. ACS Biomaterials Science and Engineering, 4(6), 2115-2125. https://doi.org/10.1021/acsbiomaterials.7b00979

Monti, M., Milanetti, E., Frans, M. T., Miotto, M., Di Rienzo, L., Baranov, M. V., Gosti, G., Somavarapu, A. K., Nagaraj, M., Golbek, T. W., Rossing, E., Moons, S. J., Boltje, T. J., van den Bogaart, G., Weidner, T., Otzen, D. E., Tartaglia, G. G., Ruocco, G. & Roeters, S. J. (2024). Two Receptor Binding Strategy of SARS-CoV-2 Is Mediated by Both the N-Terminal and Receptor-Binding Spike Domain. The journal of physical chemistry. B, 128(2), 451-464. https://doi.org/10.1021/acs.jpcb.3c06258

Poulsen, T. D., Frederiksen, P. K., Jørgensen, M., Mikkelsen, K. V. & Ogilby, P. R. (2001). Two-Photon Singlet Oxygen Sensitizers: Quantifying, Modeling, and Optimizing the Two-Photon Absorption Cross Section. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 105, 11488-11495.

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.

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

Frederiksen, P. K., McIlroy, S. P., Nielsen, C. B., Nikolajsen, L. N., Skovsen, E., Jørgensen, M., Mikkelsen, K. V. & Ogilby, P. R. (2005). Two-Photon Photosensitized Production of Singlet Oxygen in Water. Journal of the American Chemical Society, 127(1), 255-269.

Frederiksen, P. K., Jørgensen, M. & Ogilby, P. R. (2001). Two-Photon Photosensitized Production of Singlet Oxygen. Journal of the American Chemical Society, 123, 1215-1221.

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.

Pedersen, B. W., Breitenbach, T., Redmond, R. W. & Ogilby, P. R. (2010). Two-Photon Irradiation of an Intracellular Singlet Oxygen Photosensitizer: Achieving Localized Sub-Cellular Excitation in Spatially-Resolved Experiments. Free Radical Research, 44, 1383-1397.

Bregnhøj, M. & Ogilby, P. R. (2019). Two-Photon Excitation of Neat Aerated Solvents with Visible Light Produces Singlet Oxygen. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 123(35), 7567-7575. https://doi.org/10.1021/acs.jpca.9b05517

Thøgersen, J., Scheer, M., Steele, L. D., Haugen, H. K. & Wijesundera, W. P. (1996). Two-photon detachment of negative ions via magnetic dipole transitions. Physical Review Letters, 76(16), 2870-2873. https://www.scopus.com/inward/record.uri?eid=2-s2.0-0000265082&partnerID=40&md5=9810403afd5647fb5d9669cdc15183f3

Arnbjerg, J., Jiménez-Banzo, A., Paterson, M. J., Nonell, S., Borrell, J. I., Christiansen, O. & Ogilby, P. R. (2007). Two-photon absorption in tetraphenylporphycenes: are porphycenes better candidates than porphyrins for providing optimal optical properties for two-photon photodynamic therapy? Journal of the American Chemical Society, 129, 5188-5199.

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.

Madsen, M. R., Koefoed, L., Jensen, H., Daasbjerg, K. & Pedersen, S. U. (2019). Two-phase bipolar electrografting. Electrochimica Acta, 317, 61-69. https://doi.org/10.1016/j.electacta.2019.04.186

Sørensen, M. B., Hazell, R. G., Bentien, A., Bond, A. D. & Jensen, T. R. (2005). Two new cobaltzinc orthophosphate monohydrates: hydrothermal synthesis, crystal structures and thermal investigation. J. Chem. Soc. Dalton, (3), 598-606.

Guo, Y., Nuermaimaiti, A., Kjeldsen, N. D., Gothelf, K. V. & Linderoth, T. R. (2020). Two-Dimensional Coordination Networks from Cyclic Dipeptides. Journal of the American Chemical Society, 142(47), 19814-19818. https://doi.org/10.1021/jacs.0c08700

Nygaard, S., Hansen, S. W., Huffman, J. C., Jensen, F., Flood, A. H. & Jeppesen, J. O. (2007). Two Classes of Alongside Charge-transfer Interactions Defined in One [2]Catenane. Journal of the American Chemical Society, (129), 7354-7363. https://doi.org/10.1021/ja069047w

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Department of Chemistry