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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Monge, P., Søgaard, A. B., Andersen, D. G., Chandrawati, R. & Zelikin, A. N. (2021). Synthetic chemical ligands and cognate antibodies for biorthogonal drug targeting and cell engineering. Advanced Drug Delivery Reviews, 170, 281-293. https://doi.org/10.1016/j.addr.2021.01.010
Batista, G. M. F., De Castro, P. P., Dos Santos, J. A., Skrydstrup, T. & Amarante, G. W. (2021). Synthetic developments on the preparation of sulfides from thiol-free reagents. Organic Chemistry Frontiers , 8(2), 326-368. https://doi.org/10.1039/d0qo01226b
Mendes, R. G., Ta, H. Q., Yang, X., Bachmatiuk, A., Praus, P., Mamakhel, A., Iversen, B. B., Su, R., Gemming, T. & Rümmeli, M. H. (2021). Tailoring the stoichiometry of C3N4 nanosheets under electron beam irradiation. Physical Chemistry Chemical Physics, 23(8), 4747-4756. https://doi.org/10.1039/d0cp06518h
Jensen, L. N., Canagaratna, M. R., Kristensen, K., Quéléver, L. L. J., Rosati, B., Teiwes, R., Glasius, M., Pedersen, H. B., Ehn, M. & Bilde, M. (2021). Temperature and volatile organic compound concentrations as controlling factors for chemical composition of α-pinene-derived secondary organic aerosol. Atmospheric Chemistry and Physics, 21(15), 11545-11562. https://doi.org/10.5194/acp-21-11545-2021
Wormer, G. J. & Poulsen, T. B. (2021). The [4.3.0] Piperidine Alkaloids: Architectures, Biology, Biosyntheses, and the Complete Details of the Asymmetric Syntheses of Streptazone A and Abikoviromycin. Synlett, 32(7), 637-654. https://doi.org/10.1055/a-1688-0826
Viuff, A., Salamone, S., McLoughlin, J., Deane, J. E. & Jensen, H. H. (2021). The Bicyclic Form of galacto-Noeurostegine Is a Potent Inhibitor of β-Galactocerebrosidase. ACS Medicinal Chemistry Letters, 12(1), 56-59. https://doi.org/10.1021/acsmedchemlett.0c00377
Thorning, F., Strunge, K., Jensen, F. & Ogilby, P. R. (2021). The complex between molecular oxygen and an organic molecule: modeling optical transitions to the intermolecular charge-transfer state. Physical Chemistry Chemical Physics, 23(28), 15038-15048. https://doi.org/10.1039/D1CP01738A
Dass, R., Corlianò, E. & Mulder, F. A. A. (2021). The contribution of electrostatics to hydrogen exchange in the unfolded protein state. Biophysical Journal, 120(18), 4107-4114. https://doi.org/10.1016/j.bpj.2021.08.003
Christensen, M., Berglund, N. A. & Schiøtt, B. (2021). The Effect of Cholesterol on Membrane-Bound Islet Amyloid Polypeptide. Frontiers in Molecular Biosciences, 8, Article 657946. https://doi.org/10.3389/fmolb.2021.657946
Rosati, B., Christiansen, S., Dinesen, A., Roldin, P., Massling, A., Nilsson, E. D. & Bilde, M. (2021). The impact of atmospheric oxidation on hygroscopicity and cloud droplet activation of inorganic sea spray aerosol. Scientific Reports, 11(1), Article 10008. https://doi.org/10.1038/s41598-021-89346-6
Shyam, P., Vijayan Pillai, H. & Christensen, M. (2021). The journey from disorder to order: transformation of ferrite magnets investigated in situ by combined Bragg and total scattering analysis. Acta Crystallographica Section A: Foundations of Crystallography, A77(Supplement), C367. https://scripts.iucr.org/cgi-bin/paper?S0108767321093181
Fruergaard, S., Lund, M. B., Schramm, A., Vosegaard, T. & Bilde, T. (2021). The myth of antibiotic spider silk. iScience, 24(10), Article 103125. https://doi.org/10.1016/j.isci.2021.103125
Artiukhin, D. G., Eschenbach, P., Matysik, J. & Neugebauer, J. (2021). Theoretical Assessment of Hinge-Type Models for Electron Donors in Reaction Centers of Photosystems i and II as well as of Purple Bacteria. Journal of Physical Chemistry B, 125(12), 3066-3079. https://doi.org/10.1021/acs.jpcb.0c10656
Persch, C., Müller, M. J., Yadav, A., Pries, J., Honné, N., Kerres, P., Wei, S., Tanaka, H., Fantini, P., Varesi, E., Pellizzer, F. & Wuttig, M. (2021). The potential of chemical bonding to design crystallization and vitrification kinetics. Nature Communications, 12, Article 4978. https://doi.org/10.1038/s41467-021-25258-3
Thøgersen, J., Vaida, V., Bregnhøj, M., Weidner, T. & Jensen, F. (2021). The primary photo-dissociation dynamics of lactate in aqueous solution: decarboxylation prevents dehydroxylation. Physical Chemistry Chemical Physics, 23(8), 4555-4568. https://doi.org/10.1039/d0cp05650b
Thøgersen, J., Weidner, T. & Jensen, F. (2021). The primary photolysis dynamics of oxalate in aqueous solution: decarboxylation. Physical Chemistry Chemical Physics, 23(16), 10040-10050. https://doi.org/10.1039/d1cp00205h
Legendre, C. M., Damgaard-Møller, E., Overgaard, J. & Stalke, D. (2021). The Quest for Optimal 3 d Orbital Splitting in Tetrahedral Cobalt Single-Molecule Magnets Featuring Colossal Anisotropy and Hysteresis. European Journal of Inorganic Chemistry, 2021(30), 3108-3114. https://doi.org/10.1002/ejic.202100465
Amini, N., Pries, J., Cheng, Y., Persch, C., Wuttig, M., Stolpe, M. & Wei, S. (2021). Thermodynamics and kinetics of glassy and liquid phase-change materials. Materials Science in Semiconductor Processing, 135, Article 106094. https://doi.org/10.1016/j.mssp.2021.106094
Zhao, K., Eikeland, E., He, D., Qiu, W., Jin, Z., Song, Q., Wei, T. R., Qiu, P., Liu, J., He, J., Iversen, B. B., He, J., Chen, L. & Shi, X. (2021). Thermoelectric materials with crystal-amorphicity duality induced by large atomic size mismatch. Joule, 5(5), 1183-1195. https://doi.org/10.1016/j.joule.2021.03.012
Poulsen, T. B. (2021). Total Synthesis of Natural Products Containing Enamine or Enol Ether Derivatives. Accounts of Chemical Research, 54(8), 1830-1842. https://doi.org/10.1021/acs.accounts.0c00851
Elm, J. (2021). Toward a Holistic Understanding of the Formation and Growth of Atmospheric Molecular Clusters: A Quantum Machine Learning Perspective. The Journal of Physical Chemistry A, 125(4), 895-902. https://doi.org/10.1021/acs.jpca.0c09762
Jakubauskas, D., Jansen, M., Lyngsø, J., Cheng, Y., Pedersen, J. S. & Cárdenas, M. (2021). Toward reliable low-density lipoprotein ultrastructure prediction in clinical conditions: A small-angle X-ray scattering study on individuals with normal and high triglyceride serum levels. Nanomedicine: Nanotechnology, Biology, and Medicine, 31, Article 102318. https://doi.org/10.1016/j.nano.2020.102318
Grinderslev, J. B. & Jensen, T. R. (2021). Trends in the Series of Ammine Rare-Earth-Metal Borohydrides: Relating Structural and Thermal Properties. Inorganic Chemistry, 60(4), 2573-2589. https://doi.org/10.1021/acs.inorgchem.0c03464
Xie, H. B. & Elm, J. (2021). Tri-base synergy in sulfuric acid-base clusters. Atmosphere, 12(10), Article 1260. https://doi.org/10.3390/atmos12101260
Roth, N., Beyer, J., Fischer, K. F. F., Xia, K., Zhu, T. & Iversen, B. B. (2021). Tuneable local order in thermoelectric crystals. IUCrJ, 8(4), 695-702. https://doi.org/10.1107/S2052252521005479
Thomas, R., Thomas, S. P., Lakhotiya, H., Mamakhel, A. H., Bondesgaard, M., Birkedal, V. & Iversen, B. B. (2021). Tuning of bandgaps and emission properties of light-emitting diode materials through homogeneous alloying in molecular crystals. Chemical Science, 12(37), 12391-12399. https://doi.org/10.1039/d1sc03714e
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
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
Christensen, R. S., Kløve, M., Roelsgaard, M., Sommer, S. & Iversen, B. B. (2021). Unravelling the complex formation mechanism of HfO2 nanocrystals using in situ pair distribution function analysis. Nanoscale, 13(29), 12711-12719. https://doi.org/10.1039/D1NR03044B
Wang, K., Huang, R. J., Brüggemann, M., Zhang, Y., Yang, L., Ni, H., Guo, J., Wang, M., Han, J., Bilde, M., Glasius, M. & Hoffmann, T. (2021). Urban organic aerosol composition in eastern China differs from north to south: Molecular insight from a liquid chromatography-mass spectrometry (Orbitrap) study. Atmospheric Chemistry and Physics, 21(11), 9089-9104. https://doi.org/10.5194/acp-21-9089-2021
Sherin, P. S., Vysniauskas, A., Lopez-Duarte, I., Ogilby, P. R. & Kuimova, M. K. (2021). Visualising UV-A Light-Induced Damage to Plasma Membranes of Eye Lens. Journal of Photochemistry and Photobiology B: Biology, 225, Article 112346. https://doi.org/10.1016/j.jphotobiol.2021.112346
Okhrimenko, D. V., Budi, A., Ceccato, M., Johansson, D. B., Lybye, D., Bechgaard, K. & Stipp, S. L. S. (2021). Wettability and hydrolytic stability of 3-aminopropylsilane coupling agent and phenol-urea-formaldehyde binder on silicate surfaces and fibers. Polymer Degradation and Stability, 183, Article 109431. https://doi.org/10.1016/j.polymdegradstab.2020.109431
Schmüser, L., Golbek, T. W. & Weidner, T. (2021). Windowless detection geometry for sum frequency scattering spectroscopy in the C-D and amide i regions. Biointerphases, 16(1), Article 011201. https://doi.org/10.1116/6.0000419
Johansen, M. B., Gedde, O. R., Mayer, T. S. & Skrydstrup, T. (2020). Access to Aryl and Heteroaryl Trifluoromethyl Ketones from Aryl Bromides and Fluorosulfates with Stoichiometric CO. Organic Letters, 22(11), 4068–4072. https://doi.org/10.1021/acs.orglett.0c01117
Capelli, R., Lyu, W., Bolnykh, V., Meloni, S., Olsen, J. M. H., Rothlisberger, U., Parrinello, M. & Carloni, P. (2020). Accuracy of Molecular Simulation-Based Predictions of koff Values: A Metadynamics Study. The Journal of Physical Chemistry Letters, 11(15), 6373-6381. https://doi.org/10.1101/2020.03.30.015396, https://doi.org/10.1021/acs.jpclett.0c00999
Krause, L., Tolborg, K., Grønbech, T. B. E., Sugimoto, K., Iversen, B. B. & Overgaard, J. (2020). Accurate high-resolution single-crystal diffraction data from a Pilatus3 X CdTe detector. Journal of Applied Crystallography, 53(3), 635-649. https://doi.org/10.1107/S1600576720003775
Hu, X. M., Mendoza, D., Madsen, M. R., Joulié, D., Lassalle-Kaiser, B., Robert, M., Pedersen, S. U., Skrydstrup, T. & Daasbjerg, K. (2020). Achieving Near-Unity CO Selectivity for CO2 Electroreduction on an Iron-Decorated Carbon Material. ChemSusChem, 13(23), 6360-6369. https://doi.org/10.1002/cssc.202001311
Maikawa, C. L., Smith, A. A. A., Zou, L., Roth, G. A., Gale, E. C., Stapleton, L. M., Baker, S. W., Mann, J. L., Yu, A. C., Correa, S., Grosskopf, A. K., Liong, C. S., Meis, C. M., Chan, D., Troxell, M., Maahs, D. M., Buckingham, B. A., Webber, M. J. & Appel, E. A. (2020). A co-formulation of supramolecularly stabilized insulin and pramlintide enhances mealtime glucagon suppression in diabetic pigs. Nature Biomedical Engineering, 4(5), 507-517. https://doi.org/10.1038/s41551-020-0555-4
Pedersen, J. N., Lyngsø, J., Zinn, T., Otzen, D. & Pedersen, J. S. (2020). A complete picture of protein unfolding and refolding in surfactants. Chemical Science, 11(3), 699-712. https://doi.org/10.1039/C9SC04831F
Artiukhin, D., Klinting, E. L., König, C. & Christiansen, O. (2020). Adaptive density-guided approach to double incremental potential energy surface construction. Journal of Chemical Physics, 152(19), Article 194105. https://doi.org/10.1063/5.0004686
Markushyna, Y., Lamagni, P., Catalano, J., Lock, N., Zhang, G., Antonietti, M. & Savateev, A. (2020). Advantages in Using Inexpensive CO2 to Favor Photocatalytic Oxidation of Benzylamines. ACS Catalysis, 10(13), 7336-7342. https://doi.org/10.1021/acscatal.0c02176
Schmitz, G., Klinting, E. L. & Christiansen, O. (2020). A Gaussian process regression adaptive density guided approach for potential energy surface construction. Journal of Chemical Physics, 153(6), Article 064105. https://doi.org/10.1063/5.0015344
Madsen, N. K. K., Jensen, A. B., Hansen, M. B. & Christiansen, O. (2020). A general implementation of time-dependent vibrational coupled-cluster theory. Journal of Chemical Physics, 153(23), 234109. Article 234109. https://doi.org/10.1063/5.0034013
Sobhani, S., Hosseini Moghadam, H., Skibsted, J. & Sansano, J. M. (2020). A hydrophilic heterogeneous cobalt catalyst for fluoride-free Hiyama, Suzuki, Heck and Hirao cross-coupling reactions in water. Green Chemistry, 22(4), 1353-1365. https://doi.org/10.1039/c9gc03455b
Grinderslev, J. B., Ley, M. B., Lee, Y. S., Jepsen, L. H., Jørgensen, M., Cho, Y. W., Skibsted, J. & Jensen, T. R. (2020). Ammine Lanthanum and Cerium Borohydrides, M(BH4)3· nNH3; Trends in Synthesis, Structures, and Thermal Properties. Inorganic Chemistry, 59(11), 7768-7778. https://doi.org/10.1021/acs.inorgchem.0c00817
Yan, Y., Grinderslev, J. B., Jo̷rgensen, M., Skov, L. N., Skibsted, J. & Jensen, T. R. (2020). Ammine Magnesium Borohydride Nanocomposites for All-Solid-State Magnesium Batteries. ACS Applied Energy Materials, 3(9), 9264-9270. https://doi.org/10.1021/acsaem.0c01599
Yan, Y., Grinderslev, J. B., Lee, Y. S., Jørgensen, M., Cho, Y. W., Černý, R. & Jensen, T. R. (2020). Ammonia-assisted fast Li-ion conductivity in a new hemiammine lithium borohydride, LiBH4·1/2NH3. Chemical Communications, 56(28), 3971-3974. https://doi.org/10.1039/c9cc09990e
Grinderslev, J. B., Lee, Y. S., Paskevicius, M., Møller, K. T., Yan, Y., Cho, Y. W. & Jensen, T. R. (2020). Ammonium-Ammonia Complexes, N2H7+, in Ammonium closo-Borate Ammines: Synthesis, Structure, and Properties. Inorganic Chemistry, 59(16), 11449-11458. https://doi.org/10.1021/acs.inorgchem.0c01257
Hammer, N., Christensen, M. L., Chen, Y., Naharro, D., Liu, F., Jørgensen, K. A. & Houk, K. N. (2020). An Experimental Stereoselective Photochemical [1s,3s]-Sigmatropic Silyl Shift and the Existence of Silyl/Allyl Conical Intersections. Journal of the American Chemical Society, 142(13), 6030-6035. https://doi.org/10.1021/jacs.9b11579
Dalgaard, K., Lei, S., Wiedmann, S., Bremholm, M. & Schoop, L. (2020). Anomalous Shubnikov-de Haas quantum oscillations in rare-earth tritelluride NdTe3. Physical Review B, 102(24), Article 245109. https://doi.org/10.1103/PhysRevB.102.245109

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Department of Chemistry