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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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Kjaersgaard, N. L., Nielsen, T. B. & Gothelf, K. V. (2022). Chemical Conjugation to Less Targeted Proteinogenic Amino Acids. ChemBioChem, 23(19), [e202200245]. https://doi.org/10.1002/cbic.202200245

Glasius, M., Thomsen, D., Wang, K., Iversen, L. S., Duan, J. & Huang, R. J. (2022). Chemical characteristics and sources of organosulfates, organosulfonates, and carboxylic acids in aerosols in urban Xi'an, Northwest China. Science of the total Environment, 810, [151187]. https://doi.org/10.1016/j.scitotenv.2021.151187

Singh, G., Phalgune, U. D., Madhu, P. K., Nielsen, N. C. & Ganapathy, S. (2022). Chemical shielding and electric field gradient tensors of disodium 5′-adenosine triphosphate trihydrate determined by solid-state NMR spectroscopy and ab initio calculations. Journal of Magnetic Resonance, 10-11. https://doi.org/10.1016/j.jmro.2022.100051

Montasell, M. C., Monge, P., Carmali, S., Dias Loiola, L. M., Andersen, D. G., Løvschall, K. B., Søgaard, A. B., Kristensen, M. M., Pütz, J. M. & Zelikin, A. N. (2022). Chemical zymogens for the protein cysteinome. Nature Communications, 13(1), [4861]. https://doi.org/10.1038/s41467-022-32609-1

Høyer, N. M., Kjeldal, F. O., Hillers-Bendtsen, A. E., Mikkelsen, K. V., Olsen, J. & Jørgensen, P. (2022). Cluster perturbation theory. VI. Ground-state energy series using the Lagrangian. Journal of Chemical Physics, 157(2), [024106]. https://doi.org/10.1063/5.0082583

Olsen, J., Hillers-Bendtsen, A. E., Kjeldal, F. Ø., Høyer, N. M., Mikkelsen, K. V. & Jørgensen, P. (2022). Cluster perturbation theory. VII. The convergence of cluster perturbation expansions. Journal of Chemical Physics, 157(2), [024107]. https://doi.org/10.1063/5.0082584

Hillers-Bendtsen, A. E., Høyer, N. M., Kjeldal, F. Ø., Mikkelsen, K. V., Olsen, J. & Jørgensen, P. (2022). Cluster perturbation theory. VIII. First order properties for a coupled cluster state. Journal of Chemical Physics, 157(2), [024108]. https://doi.org/10.1063/5.0082585

Elm, J. (2022). Clusteromics III: Acid Synergy in Sulfuric Acid-Methanesulfonic Acid-Base Cluster Formation. ACS Omega, 7(17), 15206-15214. https://doi.org/10.1021/acsomega.2c01396

Knattrup, Y. & Elm, J. (2022). Clusteromics IV: The Role of Nitric Acid in Atmospheric Cluster Formation. ACS Omega, 7(35), 31551–31560. https://doi.org/10.1021/acsomega.2c04278

Shyam, P., Mørch, M., Eikeland, A. Z., Ahlburg, J., Mamakhel, A., Saura-Múzquiz, M. & Christensen, M. (2022). Combined characterization approaches to investigate magnetostructural effects in exchange-spring ferrite nanocomposite magnets. Materials Chemistry Frontiers, 6(17), 2422-2437. https://doi.org/10.1039/d2qm00091a

Birkedal, H. (2022). Comment on Quantitative Evaluation of Osteocyte Morphology and Bone Anisotropic Extracellular Matrix in Rat Femur. Calcified Tissue International, 110(1), 143-143. https://doi.org/10.1007/s00223-021-00902-8

Bertelsen, A. D., Hansen, A. R., Broge, N. L. N., Mamakhel, A., Bondesgaard, M. & Iversen, B. B. (2022). Composition space of PtIrPdRhRu high entropy alloy nanoparticles synthesized by solvothermal reactions. Chemical communications (Cambridge, England), 58(91), 12672-12675. https://doi.org/10.1039/d2cc04827b

Jensen, F. (2022). Computational Chemistry: The Exciting Opportunities and the Boring Details. Israel Journal of Chemistry, 62(1-2), [e202100027]. https://doi.org/10.1002/ijch.202100027

Goesten, M., Xia, Y., Aschauer, U. & Amsler, M. (2022). Conformational Gap Control in CsTaS₃. Journal of the American Chemical Society, 144(8), 3398–3410. https://doi.org/10.1021/jacs.1c10947

Santorelli, A. & Gothelf, K. V. (2022). Conjugation of chemical handles and functional moieties to DNA during solid phase synthesis with sulfonyl azides. Nucleic Acids Research, 50(13), 7235-7246. https://doi.org/10.1093/nar/gkac566

Corti, V., Thøgersen, M. K., Enemærke, V. J., Rezayee, N. M., Barløse, C. L. & Anker Jørgensen, K. (2022). Construction of C-N Atropisomers by Aminocatalytic Enantioselective Addition of Indole-2-carboxaldehydes to o-Quinone Derivatives. Chemistry - A European Journal, 28(60), [e202202395]. https://doi.org/10.1002/chem.202202395

Rasmussen, F. R., Kubecka, J. & Elm, J. (2022). Contribution of Methanesulfonic Acid to the Formation of Molecular Clusters in the Marine Atmosphere. Journal of Physical Chemistry A, 126(40), 7127–7136. https://doi.org/10.1021/acs.jpca.2c04468

Krishnaswamy, S. R., Gabrovski, I. A., Patmanidis, I., Stuart, M. C. A., de Vries, A. H. & Pshenichnikov, M. S. (2022). Cryogenic TEM imaging of artificial light harvesting complexes outside equilibrium. Scientific Reports, 12(1), 5552. [5552]. https://doi.org/10.1038/s41598-022-09496-z

Wili, N., Nielsen, A. B., Völker, L. A., Schreder, L., Nielsen, N. C., Jeschke, G. & Tan, K. O. (2022). Designing broadband pulsed dynamic nuclear polarization sequences in static solids. Science Advances, 8(28), [eabq0536]. https://doi.org/10.1126/sciadv.abq0536

Guralnik, B., Hansen, O., Stilling-Andersen, A. R., Hansen, S. E., Borup, K., Mihiretie, B. M., Beltrán-Pitarch, B., Henrichsen, H. H., Lin, R., Shiv, L., Iversen, B. B., Nielsen, P. F. & Petersen, D. H. (2022). Determination of thermoelectric properties from micro four-point probe measurements. Measurement Science and Technology, 33(12), [125001]. https://doi.org/10.1088/1361-6501/ac88ea

Harms, M., Hansson, R. F., Carmali, S., Almeida-Hernández, Y., Sanchez-Garcia, E., Münch, J. & Zelikin, A. N. (2022). Dimerization of the Peptide CXCR4-Antagonist on Macromolecular and Supramolecular Protraction Arms Affords Increased Potency and Enhanced Plasma Stability. Bioconjugate Chemistry, 33(4), 594-607. https://doi.org/10.1021/acs.bioconjchem.2c00034

Ding, Y., Pedersen, S. S., Lin, A., Qian, R. & Ball, Z. (2022). Direct formation and site-selective elaboration of methionine sulfoximine in polypeptides. Chemical Science, 13(47), 14101-14105. https://doi.org/10.1039/d2sc04220g

Skoryunov, R. V., Babanova, O. A., Soloninin, A. V., Grinderslev, J. B., Skripov, A. V. & Jensen, T. R. (2022). Dynamical properties of lithium borohydride – ammine composite LiBH₄·NH₃: A nuclear magnetic resonance study. Journal of Alloys and Compounds, 894, [162446]. https://doi.org/10.1016/j.jallcom.2021.162446

Jensen, R. B., Pedersen, S. P. & Zinner, N. T. (2022). Dynamical quantum phase transitions in a noisy lattice gauge theory. Physical Review B, 105(22), [224309]. https://doi.org/10.1103/PhysRevB.105.224309

Htet, C. S., Manjón-Sanz, A. M., Liu, J., Kong, J., Marlton, F. P., Nayak, S., Jørgensen, M. R. V. & Pramanick, A. (2022). Effect of Local Structural Distortions on Antiferroelectric-Ferroelectric Phase Transition in Dilute Solid Solutions of K_xNa_1-xNbO₃. Inorganic Chemistry, 61(50), 20277-20287. https://doi.org/10.1021/acs.inorgchem.2c02489

Joseph, S., Skibsted, J. & Cizer, Ö. (2022). Effect of Water–Solid Mixing Sequence and Crystallization Water of Calcium Sulphate on the Hydration of C₃ A. Materials, 15(6), [2297]. https://doi.org/10.3390/ma15062297

Yan, Y., Yang, S. Y., Miron, G. D., Collings, I. E., L'Hôpital, E., Skibsted, J., Winnefeld, F., Scrivener, K. & Lothenbach, B. (2022). Effect of alkali hydroxide on calcium silicate hydrate (C-S-H). Cement and Concrete Research, 151, [106636]. https://doi.org/10.1016/j.cemconres.2021.106636

Fehér, B., Varga, I. & Pedersen, J. S. (2022). Effect of concentration and ionic strength on the lower critical solution temperature of poly(N-isopropylacrylamide) investigated by small-angle X-ray scattering. Soft Materials, 20(S1), S10-S18. https://doi.org/10.1080/1539445X.2021.1979041

Zajac, M., Skibsted, J., Lothenbach, B., Bullerjahn, F., Skocek, J. & Ben Haha, M. (2022). Effect of sulfate on CO₂ binding efficiency of recycled alkaline materials. Cement and Concrete Research, 157, [106804]. https://doi.org/10.1016/j.cemconres.2022.106804

Beyer, J., Roth, N. & Brummerstedt Iversen, B. (2022). Effects of Voigt diffraction peak profiles on the pair distribution function. Acta crystallographica. Section A, Foundations and advances, A78(Part 1), 10-20. https://doi.org/10.1107/S2053273321011840

Hansen-Felby, M., Pedersen, S. U. & Daasbjerg, K. (2022). Electrocatalytic Depolymerization of Self-Immolative Poly(Dithiothreitol) Derivatives. Molecules, 27(19), [6292]. https://doi.org/10.3390/molecules27196292

Sosna, M. & Ferapontova, E. E. (2022). Electron Transfer in Binary Hemin-Modified Alkanethiol Self-Assembled Monolayers on Gold: Hemin's Lateral and Interfacial Interactions. Langmuir, 38(37), 11180-11190. https://doi.org/10.1021/acs.langmuir.2c01064

Madzharova, F., Bregnhøj, M., Chatterley, A. S., Løvschall, K. B., Drace, T., Andersen Dreyer, L. S., Boesen, T. & Weidner, T. (2022). Electrostatics Trigger Interfacial Self-Assembly of Bacterial Ice Nucleators. Biomacromolecules, 23(2), 505-512. https://doi.org/10.1021/acs.biomac.1c01217

Chacon-Parra, A. D., Hall, P. A., Lewis, D. M., Glasius, M. & van Eyk, P. J. (2022). Elucidating the Maillard Reaction Mechanism in the Hydrothermal Liquefaction of Binary Model Compound Mixtures and Spirulina. ACS Sustainable Chemistry & Engineering, 10(33), 10989-11003. https://doi.org/10.1021/acssuschemeng.2c03111

McLeod, D. A., Thøgersen, M. K., Barløse, C. L., Skipper, M. L., Obregón, E. B. & Jørgensen, K. A. (2022). Enantioselective (8+3) Cycloadditions by Activation of Donor–Acceptor Cyclopropanes Employing Chiral Brønsted Base Catalysis. Angewandte Chemie - International Edition, 61(29), [e202206096]. https://doi.org/10.1002/anie.202206096

Neumann, K. T. & Skrydstrup, T. (2022). Enriched amino acids. Nature Chemistry, 14(12), 1339-1340. https://doi.org/10.1038/s41557-022-01089-7

Stockler, K. A. H., Roth, N., Gronbech, T. B. E. & Iversen, B. B. (2022). Epitaxial intergrowths and local oxide relaxations in natural bixbyite Fe_2-xMn_xO₃. IUCrJ, 9(4), 523-532. https://doi.org/10.1107/S2052252522006315

Gausas, L., Donslund, B. S., Kristensen, S. K. & Skrydstrup, T. (2022). Evaluation of Manganese Catalysts for the Hydrogenative Deconstruction of Commercial and End-of-Life Polyurethane Samples. ChemSusChem, 15(1), [e202101705]. https://doi.org/10.1002/cssc.202101705

Rasmussen, M. H., Holler, K. R., Baio, J. E., Jaye, C., Fischer, D. A., Gorb, S. N. & Weidner, T. (2022). Evidence that gecko setae are coated with an ordered nanometre-thin lipid film. Biology Letters, 18(7), [20220093]. https://doi.org/10.1098/rsbl.2022.0093

Jakobsen, C. L., Brighi, M., Andersen, B. P., Ducrest, G., Černý, R. & Ravnsbæk, D. B. (2022). Expanded solid-solution behavior and charge-discharge asymmetry in Na_xCrO₂ Na-ion battery electrodes. Journal of Power Sources, 535, [231317]. https://doi.org/10.1016/j.jpowsour.2022.231317

Vijayan Pillai, H., Povlsen, A., Thomas-Hunt, J., Mørch, M. & Christensen, M. (2022). Exploiting different morphologies of non-ferromagnetic interacting precursor’s for preparation of hexaferrite magnets. Journal of Alloys and Compounds, 915, [165333]. https://doi.org/10.1016/j.jallcom.2022.165333

Zhang, X. L., Berglund, N. A., Burgdorf, J. S., Donello, J. E., Moskal, J. R. & Stanton, P. K. (2022). Extracellular application of the N-methyl-D-aspartate receptor allosteric modulator rapastinel acts remotely to regulate Ca²⁺inactivation at an intracellular locus. NeuroReport, 33(7), 312-319. https://doi.org/10.1097/WNR.0000000000001787

Anker, A. S., Kjær, E. T. S., Juelsholt, M., Christiansen, T. L., Skjærvø, S. L., Jørgensen, M. R. V., Kantor, I., Sørensen, D. R., Billinge, S. J. L., Selvan, R. & Jensen, K. M. Ø. (2022). Extracting structural motifs from pair distribution function data of nanostructures using explainable machine learning. npj Computational Materials, 8, [213]. https://doi.org/10.1038/s41524-022-00896-3

Yan, Y., Grinderslev, J. B., Burankova, T., Wei, S., Embs, J. P., Skibsted, J. & Jensen, T. R. (2022). Fast Room-Temperature Mg²⁺ Conductivity in Mg(BH₄)₂·1.6NH₃-Al₂O₃ Nanocomposites. The Journal of Physical Chemistry Letters, 13(9), 2211-2216. https://doi.org/10.1021/acs.jpclett.2c00136

Kristensen, L. G., Amdisen, M. B., Skov, L. N. & Jensen, T. R. (2022). Fast magnesium ion conducting isopropylamine magnesium borohydride enhanced by hydrophobic interactions. Physical Chemistry Chemical Physics, (30), 18185-18197. [24]. https://doi.org/10.1039/D1CP05063J

Qiang, J., Zhou, L., Lu, P., Lin, K., Ma, Y., Pan, S., Lu, C., Jiang, W., Sun, F., Zhang, W., Li, H., Gong, X., Averbukh, I. S., Prior, Y., Schouder, C. A., Stapelfeldt, H., Cherepanov, I. N., Lemeshko, M., Jäger, W. & Wu, J. (2022). Femtosecond Rotational Dynamics of D2 Molecules in Superfluid Helium Nanodroplets. Physical Review Letters, 128(24), [243201]. https://doi.org/10.1103/PhysRevLett.128.243201

Linnartz, J. F., Müller, C. S. A., Hsu, Y. T., Nielsen, C. B., Bremholm, M., Hussey, N. E., Carrington, A. & Wiedmann, S. (2022). Fermi surface and nested magnetic breakdown in WTe₂. Physical Review Research , 4(1), [L012005 ]. https://doi.org/10.1103/PhysRevResearch.4.L012005

Sønderby, T. V., Rasmussen, H. Ø., Frank, S. A., Skov Pedersen, J. & Otzen, D. E. (2022). Folding steps in the fibrillation of functional amyloid: denaturant sensitivity reveals common features in nucleation and elongation. Journal of Molecular Biology, 434(2), [167337]. https://doi.org/10.1016/j.jmb.2021.167337

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Marianne Sommer