Department of Chemistry

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 Department of Chemistry Research Publications

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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Yuan, Y., Mills, M. J. L., Popelier, P. L. A. & Jensen, F. (2014). Comprehensive Analysis of Energy Minima of the 20 Natural Amino Acids. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 118(36), 7876-7891. https://doi.org/10.1021/jp503460m
Elm, J., Norman, P., Bilde, M. & Mikkelsen, K. V. (2014). Computational study of the Rayleigh light scattering properties of atmospheric pre-nucleation clusters. Physical Chemistry Chemical Physics, 16(22), 10883-10890. https://doi.org/10.1039/c4cp01206b
Tosner, Z., Andersen, R., Stevensson, B., Edén, M., Nielsen, N. C. & Vosegaard, T. (2014). Computer-intensive simulation of solid-state NMR experiments using SIMPSON. Journal of Magnetic Resonance, 246, 79-93. https://doi.org/10.1016/j.jmr.2014.07.002
Jørgensen, M. R. V., Hathwar, V. R., Bindzus, N., Wahlberg, N., Chen, Y.-S., Overgaard, J. & Iversen, B. B. (2014). Contemporary X-ray electron-density studies using synchrotron radiation. IUCrJ, 1(5), 267-280. https://doi.org/10.1107/S2052252514018570
Kivekäs, N., Massling, A., Grythe, H., Lange, R., Rusnak, V., Carreno, S., Skov, H., Swietlicki, E., Nguyen, Q., Glasius, M. & Kristensson, A. (2014). Contribution of ship traffic to aerosol particle concentrations downwind of a major shipping lane. Atmospheric Chemistry and Physics, 14, 8255-8267. https://doi.org/10.5194/acp-14-8255-2014
Bjerglund Pedersen, E., Kongsfelt, M., Shimizu, K., Jensen, B. B. E., Koefoed, L., Ceccato, M., Skrydstrup, T., Pedersen, S. U. & Daasbjerg, K. (2014). Controlled Electrochemical Carboxylation of Graphene To Create a Versatile Chemical Platform for Further Functionalization. Langmuir, 30(22), 6622–6628. https://doi.org/10.1021/la501297j
Mi, J., Shen, Y., Becker, J., Bremholm, M. & Iversen, B. B. (2014). Controlling Allotropism in Ruthenium Nanoparticles: A Pulsed-Flow Supercritical synthesis and in Situ Synchrotron X-ray Diffraction Study. The Journal of Physical Chemistry Part C, 118(20), 11104-11110. https://doi.org/10.1021/jp501229p
Wong, J. E. M. M., Alsarraf, H. M. A. B., Kaspersen, J. D., Pedersen, J. S., Stougaard, J., Thirup, S. S. & Blaise, M. (2014). Cooperative binding of LysM domains determines the carbohydrate affinity of a bacterial endopeptidase protein. FEBS journal, 281(4), 1196-1208. https://doi.org/10.1111/febs.12698
Philippot, G., Jensen, K. M. Ø., Christensen, M., Elissalde, C., Maglione, M., Iversen, B. B. & Aymonier, C. (2014). Coupling in situ synchrotron radiation with ex situ spectroscopy characterizations to study the formation of Ba1-xSrxTiO3 nanoparticles in supercritical fluids. Journal of Supercritical Fluids, 87, 111-117. https://doi.org/10.1016/j.supflu.2013.12.009
Slater, C. S., Blake, S., Brouard, M., Lauer, A., Vallance, C., John, J. J., Turchetta, R., Nomerotski, A., Christensen, L., Nielsen, J. H., Johansson, M. P. & Stapelfeldt, H. (2014). Covariance imaging experiments using a pixel-imaging mass-spectrometry camera. Physical Review A, 89(1), Article 011401(R). https://doi.org/10.1103/PhysRevA.89.011401
Su, R., Tiruvalam, R., Logsdail, A., He, Q., Downing, C., Jensen, M. T., Dimitratos, N., Kesavan, L., Wells, P., Bechstein, R., Jensen, H. H., Wendt, S., Catlow, C. R., Kiely, C., Hutchings, G. & Besenbacher, F. (2014). Designer Titania-Supported Au–Pd Nanoparticles for Efficient Photocatalytic Hydrogen Production. ACS Nano, 8(4), 3490-3497. https://doi.org/10.1021/nn500963m
Wright, E. J., Sosna, M., Bloodworth, S., Kilburn, J. D. & Bartlett, P. N. (2014). Design of maleimide-functionalised electrodes for covalent attachment of proteins through free surface cysteine groups. Chemistry - A European Journal, 20(19), 5550-5554. https://doi.org/10.1002/chem.201400246
Leemreize, H., Birkbak, M., Froelich, S., Kenesei, P., Almer, J. D., Stock, S. R. & Birkedal, H. (2014). Diffraction computed tomography reveals the inner structure of complex biominerals. In Developments in X-Ray Tomography IX SPIE - International Society for Optical Engineering. https://doi.org/10.1117/12.2061580
Britz, D. & Strutwolf, J. (2014). Digital Simulation of Electrochemistry at Microelectrodes. In K. Fong Lei (Ed.), Microelectrodes: Techniques, Structures for Biosensing and Potential Applications (2014 ed., pp. 1-85). Nova Science Publishers.
Kristensen, K., Cui, T., Zhang, H., Gold, A., Glasius, M. & Surratt, J. D. (2014). Dimers in α-pinene secondary organic aerosol: effect of hydroxyl radical, ozone, relative humidity and aerosol acidity. Atmospheric Chemistry and Physics, 14(8), 4201-4218. https://doi.org/10.5194/acp-14-4201-2014
Lopes, P., Xu, M., Zhang, M., Zhou, T., Yang, Y., Wang, C. & Ferapontova, E. (2014). Direct electrochemical and AFM detection of amyloid-β peptide aggregation on basal plane HOPG. Nanoscale, 6(14), 7853-7857. https://doi.org/10.1039/C4NR02413C
Kock, A., Zuwala, K., Smith, A. A. A., Ruiz-Sanchis, P., Wohl, B. M., Tolstrup, M. & Zelikin, A. N. (2014). Disulfide reshuffling triggers the release of a thiol-free anti-HIV agent to make up fast-acting, potent macromolecular prodrugs. Chemical Communications, 50(93), 14498-500. https://doi.org/10.1039/c4cc04280h
de Almeida Campos, R. C., Kotlyar, A. & Ferapontova, E. (2014). DNA-Mediated Electron Transfer in DNA Duplexes Tethered to Gold Electrodes via Phosphorothioated dA Tags. Langmuir, 30(40), 11853–11857. https://doi.org/10.1021/la502766g
Rosen, C. B., Tørring, T. & Gothelf, K. V. (2014). DNA-Templated Synthesis: in Nucleic Acid Nanotechnology, Nucleic Acids and Molecular Biology. In J. Kjems, E. Ferapontova & K. V. Gothelf (Eds.), Nucleic Acid Nanotechnology (Vol. 29). Springer. https://doi.org/10.1007/978-3-642-38815-6_7
Shimizu, K., Malmos, K., Spiegelhauer, S. A., Hinke, J., Holm, A. H., Pedersen, S. U., Daasbjerg, K. & Hinge, M. (2014). Durability of PEEK adhesive to stainless steel modified with aryldiazonium salts. International Journal of Adhesion and Adhesives, 51, 1-12. https://doi.org/10.1016/j.ijadhadh.2014.02.002
Christensen, L., Nielsen, J. H., Brandt, C. B., Madsen, C. B., Madsen, L. B., Slater, C. S., Lauer, A., Brouard, M., Johansson, M. P., Shepperson, B. & Stapelfeldt, H. (2014). Dynamic Stark Control of Torsional Motion by a Pair of Laser Pulses. Physical Review Letters, 113, Article 073005. https://doi.org/10.1103/PhysRevLett.113.073005
Utke, R. G., Thiangviriya, S., Javadian, P., Laipple, D., Pistidda, C., Bergemann, N., Horstmann, C., Jensen, T. R., Klassen, T. & Dornheim, M. (2014). Effective nanoconfinement of 2LiBH4-MgH2 via simply MgH2 premilling for reversible hydrogen storages. International Journal of Hydrogen Energy, 39(28), 15614-15626. https://doi.org/10.1016/j.ijhydene.2014.07.167
List, N. H., Pimenta, F. M., Holmegaard, L., Jensen, R. L., Etzerodt, M., Schwabe, T., Kongsted, J., Ogilby, P. R. & Christiansen, O. (2014). Effect of chromophore encapsulation on linear and nonlinear optical properties: the case of "miniSOG", a protein-encased flavin. Physical Chemistry Chemical Physics, 16(21), 9950-9959. https://doi.org/10.1039/c3cp54470b
Pistidda, C., Karimi, F., Garroni, S., Rzeszutek, A., Bonatto Minella, C., Milanese, C., Le, T. T., Rude, L. H., Skibsted, J., Jensen, T. R., Horstmann, C., Gundlach, C., Tolkiehn, M., Pranzas, P. K., Schreyer, A., Klassen, T. & Dornheim, M. (2014). Effect of the Partial Replacement of CaH2 with CaF2 in the Mixed System CaH2 + MgB2. The Journal of Physical Chemistry Part C, 118(49), 28409-28417. https://doi.org/10.1021/jp508780b
Kourtchev, I., O'Connor, I. P., Giorio, C., Fuller, S. J., Kristensen, K., Maenhaut, W., Wenger, J. C., Sodeau, J. R., Glasius, M. & Kalberer, M. (2014). Effects of anthropogenic emissions on the molecular composition of urban organic aerosols: An ultrahigh resolution mass spectrometry study. Atmospheric Environment, 89, 525-532. https://doi.org/10.1016/j.atmosenv.2014.02.051
Sigaard Christensen, P., Mørup, A. J., Mamakhel, M. A. H., Glasius, M., Becker, J. & Iversen, B. B. (2014). Effects of heterogeneous catalyst in hydrothermal liquefaction of dried distillers grains with solubles. Fuel, 123, 158-166. https://doi.org/10.1016/j.fuel.2014.01.037
Lescot, C., Nielsen, D. U., Makarov, I., Lindhardt, A. T., Daasbjerg, K. & Skrydstrup, T. (2014). Efficient Fluoride-Catalyzed Conversion of CO2 to CO at Room Temperature. Journal of the American Chemical Society, 136(16), 6142-6147. https://doi.org/10.1021/ja502911e
Equbal, A., Paul, S., Mithu, V. S., Madhu, P. K. & Nielsen, N. C. (2014). Efficient Heteronuclear Decoupling in MAS Solid-State NMR using Non-rotor-synchronized rCW Irradiation. Journal of Magnetic Resonance, 246, 104-109. https://doi.org/10.1016/j.jmr.2014.07.006
Basse, K., Jain, S. K., Bakharev, O. N. & Nielsen, N. C. (2014). Efficient Polarization Transfer between Spin-1/2 and 14N Nuclei in Solid-State MAS NMR Spectroscopy. Journal of Magnetic Resonance, 244, 85-89. https://doi.org/10.1016/j.jmr.2014.04.017
Bremholm, M., Becker, J., Nielsen, M. B. & Søndergaard-Pedersen, S. (2014). Ekstrem kemi - nye materialer med højtryk. Aktuel Naturvidenskab, (5), 28-32.
Mirbagheri, N., Chevallier, J., Kibsgaard, J., Besenbacher, F. & Ferapontova, E. (2014). Electrocatalysis of Water Oxidation by H2O-Capped Iridium-Oxide Nanoparticles Electrodeposited on Spectroscopic Graphite. ChemPhysChem, 15(13), 2844–2850. https://doi.org/10.1002/cphc.201402079
Lopes, P., Dyrnesli, H., Lorenzen, N., Otzen, D. & Ferapontova, E. (2014). Electrochemical Analysis of the Fibrillation of Parkinson's Disease α-synuclein. Analyst, 139(4), 749-756. https://doi.org/10.1039/C3AN01616A
Kibena, E., Marandi, M., Sammelselg, V., Tammeveski, K., Jensen, B. B. E., Mortensen, A. B., Lillethorup, M., Kongsfelt, M., Pedersen, S. U. & Daasbjerg, K. (2014). Electrochemical Behaviour of HOPG and CVD-grown Graphene Electrodes Modified with Thick Anthraquinone Films by Diazonium Reduction. Electroanalysis, 26(12), 2619-2630. https://doi.org/10.1002/elan.201400290
Abi, A., Lin, M., Pei, H., Fan, C., Ferapontova, E. & Zuo, X. (2014). Electrochemical Switching with 3D DNA Tetrahedral Nanostructures Self-Assembled at Gold Electrodes. A C S Applied Materials and Interfaces, 6(11), 8928–8931. https://doi.org/10.1021/am501823q
de Almeida Campos, R. C. & Ferapontova, E. (2014). Electrochemistry of weakly adsorbed species: Voltammetric analysis of electron transfer between gold electrodes and Ru hexaamine electrostatically interacting with DNA duplexes. Electrochimica Acta, 126, 151-157. https://doi.org/10.1016/j.electacta.2013.07.083
Kamarchik, E., Toffoli, D., Christiansen, O. & Bowman, J. M. (2014). Ab initio potential energy and dipole moment surfaces of the F- (H2O) complex. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 119, 59-62. https://doi.org/10.1016/j.saa.2013.04.076
Bøjesen, E. D., Jensen, K. M. Ø., Tyrsted, C., Lock, N., Christensen, M. & Iversen, B. B. (2014). In Situ Powder Diffraction Study of the Hydrothermal Synthesis of ZnO Nanoparticles. Crystal Growth & Design, 14(6), 2803-2810. https://doi.org/10.1021/cg5000606
Birgisson, S., Jensen, K. M. Ø., Christiansen, T. L., von Bülow, J. F. & Iversen, B. B. (2014). In situ powder X-ray diffraction study of the hydro-thermal formation of LiMn2O4 nanocrystallites. Dalton Transactions , 43(40), 15075-15084. https://doi.org/10.1039/c4dt01307g
Nørby, P., Johnsen, S. & Iversen, B. B. (2014). In Situ X-ray Diffraction Study of the Formation, Growth, and Phase Transition of Colloidal Cu2-xS Nanocrystals. ACS Nano, 8(5), 4295-4303. https://doi.org/10.1021/nn5010638
Poulsen, P. H., Overgaard, M. K., Jensen, K. L. & Jørgensen, K. A. (2014). Enantioselective Organocatalytic α-Arylation of Aldehydes. Organic Synthesis, 91, 175-184. https://doi.org/10.15227/orgsyn.091.0175
Jepsen, L. H. & Jensen, T. R. (2014). Energiopbevaring - nøglen til fossilfri fremtid. Aktuel Naturvidenskab, (6), 20-24. http://aktuelnaturvidenskab.dk/fileadmin/Aktuel_Naturvidenskab/nr-6/AN6-2014-H2.pdf
Javadian, P. & Jensen, T. R. (2014). Enhanced hydrogen reversibility of nanoconfined LiBH4–Mg(BH4)2. International Journal of Hydrogen Energy, 39(18), 9871-9876. https://doi.org/10.1016/j.ijhydene.2014.03.007
Mendes, A. C. & Zelikin, A. N. (2014). Enzyme prodrug therapy engineered into biomaterials. Advanced Functional Materials, 24(33), 5202-5210. https://doi.org/10.1002/adfm.201304312
Eriksen, J. J., Jørgensen, P., Olsen, J. & Gauss, J. (2014). Equation-of-motion coupled cluster perturbation theory revisited. Journal of Chemical Physics, 140, 174114. https://doi.org/10.1063/1.4873138
Song, J. J., Zhang, Z. Z., Zhang, S. S., Liu, L. L., Li, Q. Q., Xie, E. E., Gothelf, K. V. K. V., Besenbacher, F. F. & Dong, MD. (2014). Erratum: Isothermal hybridization kinetics of DNA assembly of two-dimensional DNA origami (Small (2013) 17 (2954-2959) DOI: 10.1002/smll.201202861). Small, 10(4), 630. https://doi.org/10.1002/smll.201303931
Ley, M. B., Roedern, E. & Jensen, T. R. (2014). Eutectic melting of LiBH4-KBH4. Physical Chemistry Chemical Physics, 16(44), 24194-24199. https://doi.org/10.1039/c4cp03207a
Tyrsted, C., Lock, N., Jensen, K. M. Ø., Christensen, M., Bøjesen, E. D., Emerich, H., Vaughan, G., Billinge, S. J. L. & Iversen, B. B. (2014). Evolution of atomic structure during nanoparticle formation. IUCrJ, 1(3), 165-171. https://doi.org/10.1107/S2052252514006538
Choudhury, D., Suzuki, T., Okuyama, D., Morikawa, D., Kato, K., Takata, M., Kobayashi, K., Kumai, R., Nakao, H., Murakami, Y., Bremholm, M., Iversen, B. B., Arima, T., Tokura, Y. & Taguchi, Y. (2014). Evolution of magnetic and structural transitions and enhancement of magnetocaloric effect in Fe1-xMnxV2O4. Physical Review B, 89(10), 104427. https://doi.org/10.1103/PhysRevB.89.104427
Bindzus, N., Straasø, T., Wahlberg, N., Becker, J., Bjerg, L., Lock, N., Dippel, A.-C. & Iversen, B. B. (2014). Experimental determination of core electron deformation in diamond. Acta Crystallographica Section A: Foundations of Crystallography, 70(1), 39-48. https://doi.org/10.1107/S2053273313026600
Yin, H., Blichfeld, A. B., Christensen, M. & Iversen, B. B. (2014). Fast Direct Synthesis and Compaction of Homogenous Phase-Pure Thermoelectric Zn4Sb3. A C S Applied Materials and Interfaces, 6(13), 10542-10548. https://doi.org/10.1021/am502089a

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Department of Chemistry