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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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Meazza, M., Leth, L. A., Erickson, J. D. & Jørgensen, K. A. (2017). Indium(III)-catalyzed Aza-Conia-Ene Reaction for the Synthesis of Indolizines. Chemistry: A European Journal, 23(33), 7905-7909. https://doi.org/10.1002/chem.201701820

Nuermaimaiti, A., Ning, Y., Cramer, J. L., Svane, K. L., Hammer, B., Gothelf, K. V. & Linderoth, T. R. (2017). Influence of CH center dot center dot center dot N Interaction in the Self-Assembly of an Oligo(isoquinolyne-ethynylyne) Molecule with Distinct Conformational States. Langmuir, 33(41), 10782-10791. https://doi.org/10.1021/acs.langmuir.7b02207

Kunther, W., Ferreiro, S. & Skibsted, J. (2017). Influence of the Ca/Si ratio on the compressive strength of cementitious calcium-silicate-hydrate binders. Journal of Materials Chemistry A, 5(33), 17401-17412. https://doi.org/10.1039/c7ta06104h

Hung, L. T., Ngo, D. T., Han, L., Iversen, B. B., Yin, H., Pryds, N. & Van Nong, N. (2017). In Operando Study of High-Performance Thermoelectric Materials for Power Generation: A Case Study of β-Zn₄sb₃. Advanced Engineering Materials, 3(10), Article 1700223. https://doi.org/10.1002/aelm.201700223

Mi, J. L., Nørby, P., Bremholm, M. & Iversen, B. B. (2017). Insight into Nucleation and Growth of Bi_2-xSb_xTe₃ (x = 0-2) Nanoplatelets in Hydrothermal Synthesis. Chemistry of Materials, 29(12), 5070-5079. https://doi.org/10.1021/acs.chemmater.6b05211

Huen, P. & Ravnsbæk, D. B. (2017). Insight into poor cycling stability of MgH2anodes. Journal of The Electrochemical Society, 164(13), A3138-A3143. https://doi.org/10.1149/2.0981713jes

Saha, D., Bojesen, E. D., Mamakhel, M. A. H., Bremholm, M. & Iversen, B. B. (2017). In Situ PDF Study of the Nucleation and Growth of Intermetallic PtPb Nanocrystals. ChemNanoMat, 3(7), 472-478. https://doi.org/10.1002/cnma.201700069

Manna, S., Kamlapure, A., Cornils, L., Hänke, T., Hedegaard, E. M. J., Bremholm, M., Iversen, B. B., Hofmann, P., Wiebe, J. & Wiesendanger, R. (2017). Interfacial superconductivity in a bi-collinear antiferromagnetically ordered FeTe monolayer on a topological insulator. Nature Communications, 8, 1-8. Article 14074. https://doi.org/10.1038/ncomms14074

Eikeland, E. Z., Thomsen, M., Overgaard, J., Spackman, M. A. & Iversen, B. B. (2017). Intermolecular Interaction Energies in Hydroquinone Clathrates at High Pressure. Crystal Growth & Design, 17(7), 3834-3846. https://doi.org/10.1021/acs.cgd.7b00408

Jensen, F. (2017). Introduction to Computational Chemistry 3rd. ed. (3rd ed. ed.) Wiley.

Voisin, T., Erriguible, A., Philippot, G., Ballenghien, D., Mateos, D., Cansell, F., Iversen, B. B. & Aymonier, C. (2017). Investigation of the precipitation of Na₂SO₄ in supercritical water. Chemical Engineering Science, 174, 268-276. https://doi.org/10.1016/j.ces.2017.09.009

Sobhani, S., Zarifi, F. & Skibsted, J. (2017). Ionic liquids grafted onto graphene oxide as a new multifunctional heterogeneous catalyst and its application in the one-pot multi-component synthesis of hexahydroquinolines. New Journal of Chemistry, 41(14), 6219-6225. https://doi.org/10.1039/c7nj00063d

Savelyev, E., Boll, R., Bomme, C., Schirmel, N., Redlin, H., Erk, B., Düsterer, S., Müller, E., Höppner, H., Toleikis, S., Müller, J., Kristin Czwalinna, M., Treusch, R., Kierspel, T., Mullins, T., Trippel, S., Wiese, J., Küpper, J., Braue, F. ... Rolles, D. (2017). Jitter-correction for IR/UV-XUV pump-probe experiments at the FLASH free-electron laser. New Journal of Physics, 19(4), Article 043009. https://doi.org/10.1088/1367-2630/aa652d

Salomon, T., Sibbersen, C., Hansen, J., Britz, D. H., Svart, M., Voss, T. S., Møller, N., Gregersen, N., Jørgensen, K. A., Palmfeldt, J., Poulsen, T. & Johannsen, M. (2017). Ketone Body Acetoacetate Buffers Methylglyoxal via a Non-enzymatic Conversion during Diabetic and Dietary Ketosis. Cell Chemical Biology, 24(8), 935-943.e7. https://doi.org/10.1016/j.chembiol.2017.07.012

Shepperson, B., Sondergaard, A. A., Christiansen, L., Kaczmarczyk, J., Zillich, R. E., Lemeshko, M. & Stapelfeldt, H. (2017). Laser-Induced Rotation of Iodine Molecules in Helium Nanodroplets: Revivals and Breaking Free. Physical Review Letters, 118(20), Article 203203. https://doi.org/10.1103/PhysRevLett.118.203203

Wolczyk, A., Paik, B., Sato, T., Nervi, C., Brighi, M., GharibDoust, S. P., Chierotti, M., Matsuo, M., Li, G., Gobetto, R., Jensen, T. R., Cerny, R., Orimo, S. I. & Baricco, M. (2017). Li-5(BH4)(3)NH: Lithium-Rich Mixed Anion Complex Hydride. The Journal of Physical Chemistry Part C, 121(21), 11069-11075. https://doi.org/10.1021/acs.jpcc.7b00821

Hvid, M. S., Lamagni, P. & Lock, N. (2017). Light absorption engineering of a hybrid (Sn3S72-)(n) based semiconductor - from violet to red light absorption. Scientific Reports, 7, Article 45822. https://doi.org/10.1038/srep45822

Donovan, M. A., Lutz, H., Yimer, Y. Y., Pfaendtner, J., Bonn, M. & Weidner, T. (2017). LK peptide side chain dynamics at interfaces are independent of secondary structure. Physical Chemistry Chemical Physics, 19(42), 28507-28511. https://doi.org/10.1039/c7cp05897g

Harczuk, I., Nagy, B., Jensen, F., Vahtras, O. & Ågren, H. (2017). Local decomposition of imaginary polarizabilities and dispersion coefficients. Physical Chemistry Chemical Physics, 19(30), 20241-20250. https://doi.org/10.1039/c7cp02399e

Chandrawati, R., Chang, J. Y. H., Reina-Torres, E., Jumeaux, C., Sherwood, J. M., Stamer, W. D., Zelikin, A. N., Overby, D. R. & Stevens, M. M. (2017). Localized and Controlled Delivery of Nitric Oxide to the Conventional Outflow Pathway via Enzyme Biocatalysis: Toward Therapy for Glaucoma. Advanced Materials, 29(16), Article 1604932. https://doi.org/10.1002/adma.201604932

Vinding, M. S., Guérin, B., Vosegaard, T. & Nielsen, N. C. (2017). Local SAR, global SAR, and power-constrained large-flip- angle pulses with optimal control and virtual observation points. Magnetic Resonance in Medicine, 77(1), 374–384. https://doi.org/10.1002/mrm.26086

Sist, M., Fischer, K. F. F., Kasai, H. & Iversen, B. B. (2017). Low-Temperature Anharmonicity in Cesium Chloride (CsCl). Angewandte Chemie International Edition, 56(13), 3625-3629. https://doi.org/10.1002/anie.201700638

Schandock, F., Riber, C. F., Röcker, A., Müller, J. A., Harms, M., Gajda, P., Zuwala, K., Andersen, A. H. F., Løvschall, K. B., Tolstrup, M., Kreppel, F., Münch, J. & Zelikin, A. N. (2017). Macromolecular Antiviral Agents against Zika, Ebola, SARS, and Other Pathogenic Viruses. Advanced Healthcare Materials, 6(23), Article 1700748. https://doi.org/10.1002/adhm.201700748

Riber, C. F., Hinton, T. M., Gajda, P., Zuwala, K., Tolstrup, M., Stewart, C. & Zelikin, A. N. (2017). Macromolecular Prodrugs of Ribavirin: Structure-Function Correlation as Inhibitors of Influenza Infectivity. Molecular Pharmaceutics, 14(1), 234-241. https://doi.org/10.1021/acs.molpharmaceut.6b00826

Stingaciu, M., Andersen, H. L., Granados-Miralles, C., Mamakhel, M. A. H. & Christensen, M. (2017). Magnetism in CoFe2O4 nanoparticles produced at sub- and near-supercritical conditions of water. CrystEngComm, 19(28), 3986-3996. https://doi.org/10.1039/c7ce00666g

Kjærgaard, T., Baudin, P., Bykov, D., Eriksen, J. J., Ettenhuber, P., Kristensen, K., Larkin, J., Liakh, D., Pawlowski, F., Vose, A., Wang, Y. M. & Jørgensen, P. (2017). Massively parallel and linear-scaling algorithm for second-order Møller–Plesset perturbation theory applied to the study of supramolecular wires. Computer Physics Communications, 212, 152-160. https://doi.org/10.1016/j.cpc.2016.11.002

Knudsen, E. B., Willendrup, P. K., Garde, J., Jørgensen, M. R. V. & Kantor, I. (2017). McXtrace 1.4: latest developments in the new release. In Advances in Computational Methods for X-Ray Optics IV : Proceedings Volume 10388 (Vol. 1038809). Article 1038809 SPIE - International Society for Optical Engineering. https://doi.org/10.1117/12.2274416

Paskevicius, M., Jepsen, L. H., Schouwink, P., Černý, R., Ravnsbæk, D. B., Filinchuk, Y., Dornheim, M., Besenbacher, F. & Jensen, T. R. (2017). Metal borohydrides and derivatives - synthesis, structure and properties. Chemical Society Reviews, 46(5), 1565-1634. https://doi.org/10.1039/c6cs00705h

Bayati, S., Bergquist, K.-E., Zhu, K., Nystrom, B., Pedersen, J. S., Galantini, L. & Schillen, K. (2017). Mixed micelles of oppositely charged poly(N-isopropylacrylamide) diblock copolymers. Journal of Polymer Science. Part B, Polymer Physics, 55(19), 1457-1470. https://doi.org/10.1002/polb.24403

Maric, S., Lind, T. K., Lyngsø, J., Cárdenas, M. & Pedersen, J. S. (2017). Modeling Small-Angle X-ray Scattering Data for Low-Density Lipoproteins: Insights into the Fatty Core Packing and Phase Transition. ACS Nano, 11(1), 1080-1090. https://doi.org/10.1021/acsnano.6b08089

Banerjee, C., Westberg, M., Breitenbach, T., Bregnhøj, M. & Ogilby, P. R. (2017). Monitoring Interfacial Lipid Oxidation in Oil-in-Water Emulsions Using Spatially Resolved Optical Techniques. Analytical Chemistry, 89(11), 6239-6247. https://doi.org/10.1021/acs.analchem.7b01228

Paskevicius, M., Hansen, B. R. S., Jorgensen, M., Richter, B. & Jensen, T. R. (2017). Multifunctionality of silver closo-boranes. Nature Communications, 8, Article 15136. https://doi.org/10.1038/ncomms15136

Kasai, H., Song, L., Andersen, H. L., Yin, H. & Iversen, B. B. (2017). Multi-temperature structure of thermoelectric Mg2Si and Mg2Sn. Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 73(6), 1158-1163. https://doi.org/10.1107/S2052520617014044

Nielsen, N. S., Juhl, D. W., Poulsen, E. T., Lukassen, M. V., Poulsen, E. C., Risør, M. W., Scavenius, C. & Enghild, J. J. (2017). Mutation-Induced Deamidation of Corneal Dystrophy-Related Transforming Growth Factor β-Induced Protein. Biochemistry, 56(49), 6470–6480. https://doi.org/10.1021/acs.biochem.7b00668

Mortensen, H. G., Madsen, J. K., Andersen, K. K., Vosegaard, T., Deen, G. R., Otzen, D. E. & Pedersen, J. S. (2017). Myoglobin and α-Lactalbumin Form Smaller Complexes with the Biosurfactant Rhamnolipid Than with SDS. Biophysical Journal, 113(12), 2621-2633. https://doi.org/10.1016/j.bpj.2017.10.024

Huen, P., Peru, F., Charalambopoulou, G., Steriotis, T., Jensen, T. R. & Ravnsbæk, D. (2017). Nanoconfined NaAlH₄ Conversion Electrodes for Li Batteries. ACS Omega, 2(5), 1956-1967. https://doi.org/10.1021/acsomega.7b00143

Jepsen, L., Paskevicius, M. & Jensen, T. R. (2017). Nanostructured and Complex Hydrides for Hydrogen Storage. In B. Raj , M. Van de Voorde & Y. Mahajan (Eds.), Nanotechnology for Energy Sustainability (Vol. 1, pp. 415 416). Wiley. https://doi.org/10.1002/9783527696109.ch18

Jørgensen, M. R. V., Piccoli, P. M. B., Hathwar, V. R., Wang, X., Hoffmann, C. M., Yakovenko, A. A., Halder, G. J., Schlueter, J. A., Iversen, B. B. & Schultz, A. J. (2017). Neutron and X-ray investigations of the Jahn-Teller switch in partially deuterated ammonium copper Tutton salt, (NH₄)₂[Cu(H₂O)₆](SO₄)₂. Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 73(1), 87-93. https://doi.org/10.1107/S2052520616018412

Stefanescu, I., Christensen, M., Fenske, J., Hall-Wilton, R., Henry, P. F., Kirstein, O., Mueller, M., Nowak, G., Pooley, D., Raspino, D., Rhodes, N., Saroun, J., Schefer, J., Schooneveld, E., Sykora, J. & Schweika, W. (2017). Neutron detectors for the ESS diffractometers. Journal of Instrumentation, 12(1), Article P01019. https://doi.org/10.1088/1748-0221/12/01/P01019

Franz, J., Bereau, T., Pannwitt, S., Anbazhagan, V., Lehr, A., Nubbemeyer, U., Dietz, U., Bonn, M., Weidner, T. & Schneider, D. (2017). Nitrated Fatty Acids Modulate the Physical Properties of Model Membranes and the Structure of Transmembrane Proteins. Chemistry: A European Journal, 23(40), 9690-9697. https://doi.org/10.1002/chem.201702041

Sondergaard, A. A., Shepperson, B. & Stapelfeldt, H. (2017). Nonadiabatic laser-induced alignment of molecules: Reconstructing <cos(2) theta > directly from <cos(2) theta(2D)> by Fourier analysis. Journal of Chemical Physics, 147(1), Article 013905. https://doi.org/10.1063/1.4975817

Westberg, M., Bregnhøj, M., Etzerodt, M. & Ogilby, P. R. (2017). No Photon Wasted: An Efficient and Selective Singlet Oxygen Photosensitizing Protein. Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical, 121(40), 9366-9371. https://doi.org/10.1021/acs.jpcb.7b07831

Koefoed, L., Vase, K. H., Stenlid, J. H., Brinck, T., Yoshimura, Y., Lund, H., Pedersen, S. U. & Daasbjerg, K. (2017). On the Kinetic and Thermodynamic Properties of Aryl Radicals Using Electrochemical and Theoretical Approaches. ChemElectroChem, 4(12), 3212-3221. https://doi.org/10.1002/celc.201700772

Mose, R., Preegel, G., Larsen, J., Jakobsen, S., Iversen, E. H. & Jørgensen, K. A. (2017). Organocatalytic stereoselective [8+2] and [6+4] cycloadditions. Nature Chemistry, 9(5), 487-492. https://doi.org/10.1038/nchem.2682

Skogh, A., Friis, S. D., Skrydstrup, T. & Sandström, A. (2017). Palladium-Catalyzed Aminocarbonylation in Solid-Phase Peptide Synthesis: A Method for Capping, Cyclization, and Isotope Labeling. Organic Letters, 19(11), 2873-2876. https://doi.org/10.1021/acs.orglett.7b01068

Equbal, A., Madhu, P. K., Meier, B. H., Nielsen, N. C., Ernst, M. & Agarwal, V. (2017). Parameter independent low-power heteronuclear decoupling for fast magic-angle spinning solid-state NMR. Journal of Chemical Physics, 146(8), Article 139901. https://doi.org/10.1063/1.4979997, https://doi.org/10.1063/1.4976997

Linderberg, J., Öhm, Y., Brändas, E. & Sabin, J. R. (2017). Per-Olov Löwdin. In J. R. Sabin & E. J. Brändas (Eds.), Advances in Quantum Chemistry: Löwdin Volume (Vol. 74, pp. 1-7). Article 3558 Elsevier. https://doi.org/10.1016/bs.aiq.2016.04.001

Møller, K. T., Jørgensen, M., Fogh, A. S. & Jensen, T. R. (2017). Perovskite alkali metal samarium borohydrides: crystal structures and thermal decomposition. Dalton Transactions , 46(35), 11905-11912. https://doi.org/10.1039/c7dt02405c

Dematteis, E. M., Pinatel, E. R., Corno, M., Jensen, T. R. & Baricco, M. (2017). Phase diagrams of the LiBH₄-NaBH₄-KBH₄ system. Physical Chemistry Chemical Physics, 19(36), 25071-25079. https://doi.org/10.1039/c7cp03816j

Sveegaard, S. G., Nielsen, M., Andersen, M. H. & Gothelf, K. V. (2017). Phosphines as Efficient Dioxygen Scavengers in Nitrous Oxide Sensors. ACS Sensors, 2(5), 695-702. https://doi.org/10.1021/acssensors.7b00152

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Department of Chemistry