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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Bach-Gansmo, F. L., Wittig, N. K., Brüel, A., Thomsen, J. S. & Birkedal, H. (2016). Immobilization and long-term recovery results in large changes in bone structure and strength but no corresponding alterations of osteocyte lacunar properties. Bone, 91, 139-147. https://doi.org/10.1016/j.bone.2016.07.005

El Hage, K., Bereau, T., Jakobsen, S. & Meuwly, M. (2016). Impact of quadrupolar electrostatics on atoms adjacent to the sigma-hole in condensed-phase simulations. Journal of Chemical Theory and Computation, 12(7), 3008-3019. https://doi.org/10.1021/acs.jctc.6b00202

Saura-Múzquiz, M., Granados-Miralles, C., Stingaciu, M., Bøjesen, E. D., Li, Q., Song, J., Dong, MD., Eikeland, E. & Christensen, M. (2016). Improved performance of SrFe₁₂O₁₉ bulk magnets through bottom-up nanostructuring. Nanoscale, 8(5), 2857-2866. https://doi.org/10.1039/C5NR07854G

Straasø, L. A., Shankar, R., Tan, K. O., Hellwagner, J., Meier, B. H., Hansen, M. R., Nielsen, N. C., Vosegaard, T., Ernst, M. & Nielsen, A. B. (2016). Improved transfer efficiencies in radio-frequency-driven recoupling solid-state NMR by adiabatic sweep through the dipolar recoupling condition. The Journal of Chemical Physics, 145(3), Article 034201. https://doi.org/10.1063/1.4958318

Madsen, J. L. H., Hjørringgaard, C. U., Vad, B. S., Otzen, D. & Skrydstrup, T. (2016). Incorporation of β-Silicon-β3-Amino Acids in the Antimicrobial Peptide Alamethicin Provides a 20-Fold Increase in Membrane Permeabilization. Chemistry - A European Journal, 22(24), 8358-8367. https://doi.org/10.1002/chem.201600445

Preus, S., Hildebrandt, L. & Birkedal, V. (2016). Influence of the Background in Single Molecule FRET TIRF Microscopy. Biophysical Journal, 110(3, supp. 1), 194a. Article 970-Plat. https://doi.org/10.1016/j.bpj.2015.11.1083

Philippot, G., Boejesen, E. D., Elissalde, C., Maglione, M., Aymonier, C. & Iversen, B. B. (2016). Insights into BaTi_1–yZr_yO₃ (0 ≤ y ≤ 1) Synthesis under Supercritical Fluid Conditions. Chemistry of Materials, 28(10), 3391-3400. https://doi.org/10.1021/acs.chemmater.6b00635

Nielsen, J. T., Kulminskaya, N. V., Bjerring, M., Linnanto, J. M., Rätsep, M., Pedersen, M. Ø., Lambrev, P. H., Dorogi, M., Garab, G., Thomsen, K., Jegerschöld, C., Frigaard, N. U., Lindahl, M. & Nielsen, N. C. (2016). In situ high-resolution structure of the baseplate antenna complex in Chlorobaculum tepidum. Nature Communications, 7, Article 12454. https://doi.org/10.1038/ncomms12454

Mazzucco, A., Rothuizen, E., Jørgensen, J.-E., Jensen, T. R. & Rokni, M. (2016). Integration of phase change materials in compressed hydrogen gas systems: Modelling and parametric analysis. International Journal of Hydrogen Energy, 41(2), 1060-1073. https://doi.org/10.1016/j.ijhydene.2015.09.034

Macetti, G., Loconte, L., Rizzato, S., Gatti, C. & Lo Presti, L. (2016). Intermolecular Recognition of the Antimalarial Drug Chloroquine: A Quantum Theory of Atoms in Molecules-Density Functional Theory Investigation of the Hydrated Dihydrogen Phosphate Salt from the 103 K X-ray Structure. Crystal Growth & Design, 16(10), 6043-6054. https://doi.org/10.1021/acs.cgd.6b01069

Birkbak, M. E., Guizar-Sicairos, M., Holler, M. & Birkedal, H. (2016). Internal structure of sponge glass fiber revealed by ptychographic nanotomography. Journal of Structural Biology, 194(1), 124-128. https://doi.org/10.1016/j.jsb.2016.02.006

Andersen, J., Ladefoged, L. K., Kristensen, T. N. B., Munro, L., Grouleff, J., Stuhr-Hansen, N., Kristensen, A. S., Schiott, B. & Strømgaard, K. (2016). Interrogating the Molecular Basis for Substrate Recognition in Serotonin and Dopamine Transporters with High-Affinity Substrate-Based Bivalent Ligands. ACS Chemical Neuroscience, 7(10), 1406-1417. https://doi.org/10.1021/acschemneuro.6b00164

Ma, X., Jepsen, M. L., Ivarsen, A. K., Nygaard, J. V., Tesauro, C., Knudsen, B. R. & Ho, Y. P. (2016). Intestinal organoids initiated in microfluidics-based double emulsions. In 20th International Conference on Miniaturized Systems for Chemistry and Life Sciences: MicroTAS 2016 (pp. 513-514). Chemical and Biological Microsystems Society.

Schaffert, D. H., Okholm, A. H., Sørensen, R. S., Nielsen, J., Tørring, T., Rosen, C. B., Kodal, A. L. B., Mortensen, M. R., Gothelf, K. V. & Kjems, J. (2016). Intracellular Delivery of a Planar DNA Origami Structure by the Transferrin-Receptor Internalization Pathway. Small, 12(19), 2634-2640. https://doi.org/10.1002/smll.201503934

Silva, E. F. F. D., Pimenta, F. M., Pedersen, B. W., Blaikie, F. H., Bosio, G., Breitenbach, T., Westberg, M., Bregnhøj, M., Etzerodt, M., Arnaut, L. G. & Ogilby, P. R. (2016). Intracellular singlet oxygen photosensitizers: on the road to solving the problems of sensitizer degradation, bleaching and relocalization. Integrative Biology, 8(2), 177-193. https://doi.org/10.1039/C5IB00295H

Munier, M., Grouleff, J., Gourdin, L., Fauchard, M., Chantreau, V., Henrion, D., Coutant, R., Schiott, B., Chabbert, M. & Rodien, P. (2016). In Vitro Effects of the Endocrine Disruptor p,p '-DDT on Human Follitropin Receptor. Environmental Health Perspectives, 124(7), 991-999. https://doi.org/10.1289/ehp.1510006

Christiansen, L., Nielsen, J. H., Christensen, L., Shepperson, B., Pentlehner, D. & Stapelfeldt, H. (2016). Laser-induced Coulomb explosion of 1,4-diiodobenzene molecules: Studies of isolated molecules and molecules in helium nanodroplets. Physical Review A, 93(2), Article 023411. https://doi.org/10.1103/PhysRevA.93.023411

König, C. & Christiansen, O. (2016). Linear-scaling generation of potential energy surfaces using a double incremental expansion. The Journal of Chemical Physics, 145(6), Article 064105. https://doi.org/10.1063/1.4960189

Frislev, H. K. S., Pedersen, J. N., Pedersen, J. S. & Otzen, D. E. (2016). Liprotides: Nano-Sized Cytotoxic Protein-Fatty Acid Complexes with a Core-Shell or Multi-Layer Structure. Biophysical Journal, 110(3), 577A. https://doi.org/10.1016/j.bpj.2015.11.3087

Frislev, H. K. S., Jessen, C. M., Oliveira, C. L. P., Pedersen, J. S. & Otzen, D. E. (2016). Liprotides made of α-lactalbumin and cis fatty acids form core-shell and multi-layer structures with a common membrane-targeting mechanism. Biochimica et Biophysica Acta - Proteins and Proteomics, 1864(7), 847-859. https://doi.org/10.1016/j.bbapap.2016.04.003

Lee, Y.-S., Ley, M. B., Jensen, T. R. & Cho, Y. W. (2016). Lithium Ion Disorder and Conduction Mechanism in LiCe(BH₄)₃Cl. The Journal of Physical Chemistry Part C, 120(34), 19035-19042. https://doi.org/10.1021/acs.jpcc.6b06564

Baudin, P. & Kristensen, K. (2016). LoFEx — A local framework for calculating excitation energies: Illustrations using RI-CC2 linear response theory. Journal of Chemical Physics, 144(22), Article 224106. https://doi.org/10.1063/1.4953360

Wahlberg, N., Bindzus, N., Christensen, S., Becker, J., Dippel, A.-C., Jørgensen, M. R. V. & Iversen, B. B. (2016). Low-temperature powder X-ray diffraction measurements in vacuum: analysis of the thermal displacement of copper. Journal of Applied Crystallography, 49(1), 110-119. Article 10. https://doi.org/10.1107/S1600576715022621

Peng, Y., Bodenstein, T., Fink, K., Mereacre, V., Anson, C. E. & Powell, A. K. (2016). Magnetic anisotropy of a Co-II single ion magnet with distorted trigonal prismatic coordination: theory and experiment. Physical Chemistry Chemical Physics, 18(43), 30135-30143. https://doi.org/10.1039/c6cp03157a

Jørgensen, J. E. & Hansen, T. C. (2016). Magnetic–crystallographic p,T-phase diagram of Fe_1.141Te: A high-pressure neutron diffraction study. IPPS physica status solidi (b), 253(11), 2257-2264. https://doi.org/10.1002/pssb.201600285

Li, Q., Song, J., Saura-Múzquiz, M., Besenbacher, F., Christensen, M. & Dong, MD. (2016). Magnetic Properties of Strontium Hexaferrite Nanostructures Measured with Magnetic Force Microscopy. Scientific Reports, 6, Article 25985. https://doi.org/10.1038/srep25985

Overgaard, J., Møller, L., Borup, M., Tricoire, M., Walsh, J. P. S., Diehl, M. & Rentschler, E. (2016). Magnetism and variable temperature and pressure crystal structures of a linear oligonuclear cobalt bis-semiquinonate. Dalton Transactions, 45(32), 12924-12932. https://doi.org/10.1039/c6dt02024k

Zelikin, A. N., Ehrhardt, C. & Healy, A. M. (2016). Materials and methods for delivery of biological drugs. Nature Chemistry, 8(11), 997-1007. https://doi.org/10.1038/nchem.2629

Su, R., Dimitratos, N., Liu, J., Carter, E., Althahban, S., Wang, X., Shen, Y., Wendt, S., Wen, X., Niemantsverdriet, J. W., Iversen, B. B., Kiely, C., Hutchings, G. J. & Besenbacher, F. (2016). Mechanistic Insight into the Interaction Between a Titanium Dioxide Photocatalyst and Pd Cocatalyst for Improved Photocatalytic Performance. ACS Catalysis, 6(7), 4239-4247. https://doi.org/10.1021/acscatal.6b00982

Roca-Lõpez, D., Uria, U., Reyes, E., Carrillo, L., Jørgensen, K. A., Vicario, J. L. & Merino, P. (2016). Mechanistic Insights into the Mode of Action of Bifunctional Pyrrolidine-Squaramide-Derived Organocatalysts. Chemistry - A European Journal, 22(3), 884-889. https://doi.org/10.1002/chem.201504705

R. S. Hansen, B., Paskevicius, M., Li, H., Akiba, E. & Jensen, T. R. (2016). Metal boranes: Progress and applications. Coordination Chemistry Reviews, 323, 60-70. https://doi.org/10.1016/j.ccr.2015.12.003

Møller, K. T., Fogh, A., Paskevicius, M., Skibsted, J. & Jensen, T. R. (2016). Metal borohydride formation from aluminium boride and metal hydrides. Physical Chemistry Chemical Physics, 18(39), 27545-27553. https://doi.org/10.1039/C6CP05391B

Sheppard, D. A., Paskevicius, M., Humphries, T. D., Felderhoff, M., Capurso, G., Bellosta von Colbe, J., Dornheim, M., Klassen, T., Ward, P. A., Teprovich, J. A., Corgnale, C., Zidan, R., Grant, D. M. & Buckley, C. E. (2016). Metal hydrides for concentrating solar thermal power energy storage. Applied Physics A: Materials Science & Processing, 122(4), Article 395. https://doi.org/10.1007/s00339-016-9825-0

Bak, E. N., Jensen, S. K., Nørnberg, P. & Finster, K. (2016). Methylated silicates may explain the release of chlorinated methane from Martian soil. Earth and Planetary Science Letters, 433, 226-231. https://doi.org/10.1016/j.epsl.2015.10.044

Crivello, J. C., Denys, R. V., Dornheim, M., Felderhoff, M., Grant, D. M., Huot, J., Jensen, T. R., de Jongh, P., Latroche, M., Walker, G. S., Webb, C. J. & Yartys, V. A. (2016). Mg-based compounds for hydrogen and energy storage. Applied Physics A: Materials Science & Processing, 122(2), Article 85. https://doi.org/10.1007/s00339-016-9601-1

Calizzi, M., Chericoni, D., Jepsen, L. H., Jensen, T. R. & Pasquini, L. (2016). Mg–Ti nanoparticles with superior kinetics for hydrogen storage. International Journal of Hydrogen Energy, 41(32), 14447-14454. https://doi.org/10.1016/j.ijhydene.2016.03.071

Spratley, S. J., Hill, C. H., Viuff, A. H., Edgar, J. R., Skjødt, K. & Deane, J. E. (2016). Molecular Mechanisms of Disease Pathogenesis Differ in Krabbe Disease Variants. Traffic (Malden), 17(8), 908-922. https://doi.org/10.1111/tra.12404

Coriani, S., Pawlowski, F. L., Olsen, J. & Jørgensen, P. (2016). Molecular response properties in equation of motion coupled cluster theory: A time-dependent perspective. Journal of Chemical Physics, 144(2), Article 024102. https://doi.org/10.1063/1.4939183

Jensen, A. C. S., Brif, A., Pokroy, B., Hinge, M. & Birkedal, H. (2016). Morphology-preserving transformation of minerals mediated by a temperature-responsive polymer membrane: Calcite to hydroxyapatite. CrystEngComm, 18(13), 2289-2293. https://doi.org/10.1039/c5ce02245b

Kasai, H. & Nishibori, E. (2016). Multiple powder diffraction data for an accurate charge density study using synchrotron radiation x-ray. Physica Scripta, 91(4), Article 043009. https://doi.org/10.1088/0031-8949/91/4/043009

Schmid, A. J., Dubbert, J., Rudov, A. A., Pedersen, J. S., Lindner, P., Karg, M., Potemkin, I. I. & Richtering, W. (2016). Multi-Shell Hollow Nanogels with Responsive Shell Permeability. Scientific Reports, 6, Article 22736. https://doi.org/10.1038/srep22736

Krogsgaard, M., Nue, V. & Birkedal, H. (2016). Mussel-Inspired Materials: Self-Healing through Coordination Chemistry. Chemistry - A European Journal, 22(3), 844-857. https://doi.org/10.1002/chem.201503380

Kragh-Hansen, U., Minchiotti, L., Coletta, A., Bienk, K., Galliano, M., Schiøtt, B., Iwao, Y., Ishima, Y. & Otagiri, M. (2016). Mutants and molecular dockings reveal that the primary L-thyroxine binding site in human serum albumin is not the one which can cause familial dysalbuminemic hyperthyroxinemia. B B A - General Subjects, 1860(4), 648-660. https://doi.org/10.1016/j.bbagen.2016.01.001

Callini, E., Aguey-Zinsou, K. F., Ahuja, R., Ares, J. R., Bals, S., Biliškov, N., Chakraborty, S., Charalambopoulou, G., Chaudhary, A. L., Cuevas, F., Dam, B., de Jongh, P., Dornheim, M., Filinchuk, Y., Grbović Novaković, J., Hirscher, M., Jensen, T. R., Jensen, P. B., Novaković, N. ... Montone, A. (2016). Nanostructured materials for solid-state hydrogen storage: A review of the achievement of COST Action MP1103. International Journal of Hydrogen Energy, 41(32), 14404-14428. https://doi.org/10.1016/j.ijhydene.2016.04.025

Sørensen, M. K., Bakharev, O. N., Jensen, O. & Nielsen, N. C. (2016). Natural abundant O-17 NMR in a 1.5-T Halbach magnet. Magnetic Resonance in Chemistry, 54(6), 510-512. https://doi.org/10.1002/mrc.4207

Kulminskaya, N. V., Yoshimura, Y., Runager, K., Sørensen, C. S., Bjerring, M., Andreasen, M., Otzen, D. E., Enghild, J. J., Nielsen, N. C. & Mulder, F. A. A. (2016). Near-complete ¹H, ¹³C, ¹⁵N resonance assignments of dimethylsulfoxide-denatured TGFBIp FAS1-4 A546T. Biomolecular N M R Assignments, 10(1), 25-29. https://doi.org/10.1007/s12104-015-9630-2

Ringsted, T., Dupont, S., Ramsay, J., Jespersen, B. M., Sørensen, K. M., Keiding, S. R. & Engelsen, S. B. (2016). Near-Infrared Spectroscopy Using a Supercontinuum Laser: Application to Long Wavelength Transmission Spectra of Barley Endosperm and Oil. Applied Spectroscopy, 70(7), 1176-1185. https://doi.org/10.1177/0003702816652361

Bubenzer-Busch, S., Herpertz-Dahlmann, B., Kuzmanovic, B., Gaber, TJ., Helmbold, K., Ullisch, M. G., Baurmann, D., Eickhoff, SB., Fink, GR. & Zepf, FD. (2016). Neural correlates of reactive aggression in children with attention-deficit/hyperactivity disorder and comorbid disruptive behaviour disorders. Acta Psychiatrica Scandinavica, 133(4), 310-323. https://doi.org/10.1111/acps.12475

Vondráček, M., Cornils, L., Minár, J., Warmuth, J., Michiardi, M., Piamonteze, C., Barreto, L., Miwa, J. A., Bianchi, M., Hofmann, P., Zhou, L., Kamlapure, A., Khajetoorians, A. A., Wiesendanger, R., Mi, J. L., Iversen, B. B., Mankovsky, S., Borek, S., Ebert, H. ... Honolka, J. (2016). Nickel: The time-reversal symmetry conserving partner of iron on a chalcogenide topological insulator. Physical Review B, 94(16), Article 161114. https://doi.org/10.1103/PhysRevB.94.161114

Jakobsen, H. J., Song, L., Gan, Z., Hung, I., Bildsoe, H., Skibsted, J., Bak, E. N., Finster, K., Nornberg, P. & Jensen, S. K. (2016). NMR and EPR Studies of Free-Radical Intermediates from Experiments Mimicking the Winds on Mars: A Sink for Methane and Other Gases. The Journal of Physical Chemistry Part C, 120(45), 26138-26149. https://doi.org/10.1021/acs.jpcc.6b08847

Displaying results 2451 to 2500 out of 5900

Revised 08.05.2026

Department of Chemistry