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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 the Department of Chemistry

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Nakhaei, M., Nobre, M. A. L., Khoshnoud, D. S., Bremholm, M. & Khonakdar, H. A. (2025). Chemical synthesis, structural and magnetic properties of Al-doped neodymium orthoferrite. Journal of Alloys and Compounds, 1010, Article 176987. https://doi.org/10.1016/j.jallcom.2024.176987

Hillers-Bendtsen, A. E., Johansen, M. B., Juncker von Buchwald, T., Mikkelsen, K. V., Olsen, J., Jørgensen, P. & Helgaker, T. (2025). Cluster perturbation theory: XI. Excitation-energy series using a variational excitation-energy function. The Journal of Chemical Physics, 162(2), Article 024114. https://doi.org/10.1063/5.0236908

Johansen, M. B., Juncker von Buchwald, T., Iuel Lunøe Dünweber, P. G., Olsen, L. H., Hillers-Bendtsen, A. E., Kjeldal, F. I., Olsen, J., Jørgensen, P. & Mikkelsen, K. V. (2025). Cluster perturbation theory: XII. Parallel implementation of variational excitation energy series for the coupled cluster singles and doubles model. Journal of Chemical Physics, 162(21), Article 214110. https://doi.org/10.1063/5.0271032

Bendtsen, M. K., Nowak, J. S., Paiva, P., López Hernández, M., Ferreira, P., Pedersen, J. S., Bekker, N. S., Viezzi, E., Bisiak, F., Brodersen, D. E., Pedersen, L. H., Zervas, A., Fernandes, P. A., Ramos, M. J., Stougaard, P., Thøgersen, M. S. & Otzen, D. E. (2025). Cold-Active Starch-Degrading Enzymes from a Cold and Alkaline Greenland Environment: Role of Ca²⁺ Ions and Conformational Dynamics in Psychrophilicity. Biomolecules, 15(3), Article 415. https://doi.org/10.3390/biom15030415

Britz, D. & Strutwolf, J. (2025). Comments on A. Eswari and L. Rajendran, “Mathematical Modeling of Cyclic Voltammetry for EC Reaction” in Russ. J. Electrochem. 47 (2011) 195 and “Mathematical Modeling of Cyclic Voltammetry for EC2 Reaction”, in Russ. J. Electrochem. 47 (2011) 205. Russian Journal of Electrochemistry, 61(6), 239–242. https://doi.org/10.1134/S1023193525700041

Ehrenreich-Petersen, E., Nielsen, M. B., Ceresoli, D., Ottesen, M., Parisiades, P. & Bremholm, M. (2025). Comparing the compression behavior of the antiperovskites CePt₃Si, CePt₃B, and YPt₃B from combined X-ray diffraction experiments and density functional theory. Journal of Alloys and Compounds, 1010, Article 177204. https://doi.org/10.1016/j.jallcom.2024.177204

Digel, L., Justesen, M. L., Madsen, N. S., Fransaert, N., Wouters, K., Bonné, R., Plum-Jensen, L. E., Marshall, I. P. G., Jensen, P. B., Nicolas-Asselineau, L., Drace, T., Bøggild, A., Hansen, J. L., Schramm, A., Bøjesen, E. D., Nielsen, L. P., Manca, J. V. & Boesen, T. (2025). Comparison of cable bacteria genera reveals details of their conduction machinery. EMBO Reports, 26(7), 1749-1767. Article 13699. https://doi.org/10.1038/s44319-025-00387-8

Neefjes, I., Reischl, B. & Yang, H. (2025). Comparison of collision rate coefficient model predictions for different interaction strengths and temperatures. Journal of Aerosol Science, 189, Article 106638. https://doi.org/10.1016/j.jaerosci.2025.106638

Jensen, T. R. & Černý, R. (2025). Complex metal hydridoborates. In Metal Hydrides for Hydrogen-Based Energy Storage, Volume 1: Fundamentals (Vol. 1, pp. 233-264). Elsevier. https://doi.org/10.1016/B978-0-443-33370-5.00002-7

Gouveia, G., Saateh, A., Swietlikowska, A., Scarpellini, C., Tsang, E., Altug, H., Merkx, M., Dillen, A., Leirs, K., Spasic, D., Lammertyn, J., Gothelf, K. V., Bonedeau, E., Porzberg, N., Smeets, R. L., Koenen, H. J. P. M., Prins, M. W. J. & de Jonge, M. I. (2025). Continuous Biosensing to Monitor Acute Systemic Inflammation, a Diagnostic Need for Therapeutic Guidance. ACS Sensors, 10(1), 4-14. https://doi.org/10.1021/acssensors.4c02569

Cao, F., Sørensen, S. S., Christensen, A. K. R., Mollick, S., Ge, X., Sun, D., Nielsen, A. B., Nielsen, N. C., Lock, N., Lu, R., Klemmt, R., Kristensen, P. K., Jensen, L. R., Dallari, F., Baglioni, J., Monaco, G., Karlsen, M. A., Baran, V. & Smedskjaer, M. M. (2025). Continuous structure modification of metal-organic framework glasses via halide salts. Nature Communications, 16(1), Article 7001. https://doi.org/10.1038/s41467-025-62143-9

Nielsen, A. B., Carvalho, J. P., Wili, N., Jensen, F. V., Goodwin, D. L., Untidt, T. S., Tošner, Z. & Nielsen, N. C. (2025). Controlling effective Hamiltonians: Broadband pulsed dynamic nuclear polarization by constrained random walk and non-linear optimization. The Journal of Chemical Physics, 163(14), Article 144111. https://doi.org/10.1063/5.0287050

Koppe, J., Yakimov, A. V., Gioffrè, D., Usteri, M. E., Vosegaard, T., Pintacuda, G., Lesage, A., Pell, A. J., Mitchell, S., Pérez-Ramírez, J. & Copéret, C. (2025). Coordination environments of Pt single-atom catalysts from NMR signatures. Nature, 642(8068), 613-619. https://doi.org/10.1038/s41586-025-09068-x

Bertelsen, A. D., Klemmt, R., Kolding, K. N., Bøjesen, E. D. & Iversen, B. B. (2025). Copper-Rich Pd_xCu_1–xAlloy Nanoparticles as Catalyst for Electrochemical Reduction of CO₂. Chemistry of Materials, 37(17), 6619-6628. https://doi.org/10.1021/acs.chemmater.5c01148

Janewithayapun, R., Cousin, F., de Moura Pereira, P. F., Herranz-Trillo, F., Terry, A. E., Pedersen, J. S., Jiménez-Quero, A. & Ström, A. (2025). Correlation between arabinose content and the conformation of arabinoxylan in water dispersions. Carbohydrate Polymers, 368(Part 2), Article 124082. https://doi.org/10.1016/j.carbpol.2025.124082

Andreasen, M. D., Souza, P. C. T., Schiøtt, B. & Zuzic, L. (2025). Creating Coarse-Grained Systems with COBY: Toward Higher Accuracy of Complex Biological Systems. Journal of Chemical Information and Modeling, 65(10), 4760-4766. https://doi.org/10.1021/acs.jcim.5c00069

Valli, D., Ooi, S. A., Kaya, I., Thomassen, A. B., Chaudhary, H., Weidner, T., Andrén, P. E. & Maj, M. (2025). Cryo-Electron Microscopy Provides Mechanistic Insights into Solution-Dependent Polymorphism and Cross-Aggregation Phenomena of the Human and Rat Islet Amyloid Polypeptides. Biochemistry, 64(12), 2583-2595. https://doi.org/10.1021/acs.biochem.5c00042

Andersen, H. L., Saura-Múzquiz, M., Granados-Miralles, C., Klemmt, R., Bøjesen, E. D. & Christensen, M. (2025). Crystal/magnetic structure and cation inversion in hydrothermally synthesized MnFe₂O₄, CoFe₂O₄, NiFe₂O₄, and ZnFe₂O₄ nanoparticles: a neutron powder diffraction study. CrystEngComm, 27(6), 850-864. https://doi.org/10.1039/d4ce01001a

Amdisen, M. B., Lee, Y.-S. & Jensen, T. R. (2025). Cyclopropylamine Magnesium Borohydrides as Solid-State Electrolytes. Inorganic Chemistry, 64(8), 3696-3706. https://doi.org/10.1021/acs.inorgchem.4c04287

Ahongshangbam, E., Franzon, L., Almeida, T. G., Hasan, G., Frandsen, B. N. & Myllys, N. (2025). Decomposition pathways of isoprene-derived hydrotrioxides and their clustering abilities in the atmosphere. Physical Chemistry Chemical Physics, 27(11), 5889-5901. https://doi.org/10.1039/d4cp04329d

Ladefoged, L. K., Schiøtt, B. & Fedosova, N. (2025). Derivatization of Bufadienolides at Carbon-3 of the Steroid Core and Their Consequences for the Interaction with Na+,K+-ATPase. International Journal of Molecular Sciences , 26(22), 11027. Article 11027. https://doi.org/10.3390/ijms262211027

Iversen, E. M., Bilde, M. & Pedersen, H. B. (2025). Developments at the AURA atmospheric simulation chamber to characterize chamber volume, air mixing, and charging. Aerosol Science and Technology, 59(5), 521-543. https://doi.org/10.1080/02786826.2024.2429658

Silva, R. C., Martins Ferreira Batista, G., Brocksom, T. J. & de Oliveira, K. T. (2025). Discovery of EDA-Complex Photochemical Reactions Using Computational Vision. Advanced Synthesis and Catalysis, 367(5), Article e202401045. https://doi.org/10.1002/adsc.202401045

Tsang, E., Scarpellini, C., Dillen, A., Jeminejs, A., Sivertsen, M. V. T., Sutherland, D. S., Lammertyn, J. & Gothelf, K. V. (2025). DNA Origami-Guided Assembly of Gold Nanoparticles for Plasmonic Enhancement in Fiber Optic Surface Plasmon Resonance Sensing. Small Methods, 9(12), Article e02111. https://doi.org/10.1002/smtd.202502111

Novosylna, O., Shalak, V., Dąbrowska, K., Patmanidis, I., Lozhko, D., Bondarchuk, T., Schiøtt, B., Pedersen, J. S., Knudsen, C. R., Nissen, P., Dadlez, M. & Negrutskii, B. (2025). Dynamics and structural features of the eEF1A1 and eEF1A2 paralogs. Nucleic Acids Research, 53(21), Article gkaf1177. https://doi.org/10.1093/nar/gkaf1177

Neefjes, I., Knattrup, Y., Wu, H., Trolle, G. B., Elm, J. & Kubečka, J. (2025). Effect of humidity on the first steps of atmospheric new particles formation: Computational study of hydrated molecular clusters. Aerosol Research, 2025, 1-34. https://doi.org/10.5194/ar-2025-30

Kristensen, L. R., Herrmann, G. J., Skibsted, J. & Jensen, T. R. (2025). Effect of Mechanical Pressure on the Ionic Conductivity of Sodium Dodecahydrido-closo-dodecaborate. ACS Materials Letters, 7(3), 990-995. https://doi.org/10.1021/acsmaterialslett.4c02153

Zheng, A. C., Zou, Y. B., Du, L., Zhang, Q., Daasbjerg, K. & Hu, X. M. (2025). Efficient Direct Air Capture in Industrial Cooling Towers Mediated by Electrochemical CO₂ Release. Angewandte Chemie - International Edition, 64(5), Article e202412697. https://doi.org/10.1002/anie.202412697

Hu, X.-M., Liang, H.-Q., Rosas-Hernández, A. & Daasbjerg, K. (2025). Electrochemical valorization of captured CO₂: recent advances and future perspectives. Chemical Society Reviews, 54(3), 1216-1250. https://doi.org/10.1039/d4cs00480a

Han, X., Liu, H., Cao, P., Tang, W., Zhang, C. Y., Biset-Peiró, M., Xiao, K., Tang, P., Heggen, M., Vega-Paredes, M., Garzón Manjón, A., Zheng, L., Dunin-Borkowski, R. E., Cabot, A., Daasbjerg, K., Morante, J. R., Zhang, T. & Arbiol, J. (2025). Electron delocalization engineering via hierarchical modulation in single-atom catalysts for highly efficient electrochemical CO₂ reduction. Chemical Engineering Journal, 507, Article 160634. https://doi.org/10.1016/j.cej.2025.160634

Jeschke, G., Wili, N., Wu, Y., Kuzin, S., Karas, H., Hintz, H. & Godt, A. (2025). Electron-spin decoherence in trityl radicals in the absence and presence of microwave irradiation. Magnetic Resonance, 6(1), 15-32. https://doi.org/10.5194/mr-6-15-2025

Salionov, D., Nikolic, M. & Glasius, M. (2025). Emission simulation using direct thermal extraction gas chromatography-mass spectrometry: Case study with curing of lignin-based binder. Journal of Chromatography A, 1753, Article 465970. https://doi.org/10.1016/j.chroma.2025.465970

Rodriguez-Palomo, A., Jacobsen, M. S. B., Christensen, T. E. K., Jørgensen, M. R. V., Kantor, I., Willan, G., Herrel, A., Marghoub, A., Moazen, M., Evans, S., Vickaryous, M., Williams, C. J. A. & Birkedal, H. (2025). Enamel-like stiffness achieved by poorly oriented nanocrystals in the capping tissue of Mexican beaded lizard osteoderms. Acta Biomaterialia, 204, 457-469. https://doi.org/10.1016/j.actbio.2025.08.025

Faghtmann, J., Østergaard, A. R., Fritz, F., Andresen, S. S. P. & Jørgensen, K. A. (2025). Enantioselective and Divergent Trienamine-Mediated Reactions of Halogenated Maleimides. Organic Letters, 27(20), 5236-5240. https://doi.org/10.1021/acs.orglett.5c01444

Faghtmann, J., Pladsbjerg Andresen, S. S., Rask Østergaard, A. & Anker Jørgensen, K. (2025). Enantioselective Cascade Reactions of Aminocatalytic Dienamines and Trienamines Initiated by a Cycloaddition Reaction. Chemistry - A European Journal, 31(1), Article e202403656. https://doi.org/10.1002/chem.202403656

Obregón, E. B., Villaescusa, L., Trujillo-Sierra, J., Mastroddi, R. & Jørgensen, K. A. (2025). Enantioselective Formation of Isoxazolidines via Brønsted-Base Catalyzed (3 + 2) Annulation of Cyclopropanes with Nitrosoarenes. Journal of the American Chemical Society, 147(17), 14071-14076. https://doi.org/10.1021/jacs.5c04032

Nazari, P., Zhao, S., Christensen, O., Sun, Z., Ceccato, M., Lauritsen, J. V., Pedersen, S. U., Rossmeisl, J., Rosas-Hernández, A. & Daasbjerg, K. (2025). Enhancing Carbon Dioxide Reduction Performance on Copper via Surface Reconstruction Induced by Spontaneous Diazonium Salt Grafting. Journal of the American Chemical Society, 147(34), 31395-31408. https://doi.org/10.1021/jacs.5c11431

Donath, T., Trampari, S., Wagner, L., Jørgensen, M. R. V., Gjørup, F. H., Checchia, S., Di Michiel, M., Papillon, E. & Vaughan, G. (2025). Enhancing high-energy powder X-ray diffraction applications using a PILATUS4 CdTe detector. Journal of Synchrotron Radiation, 32(Pt 2), 378-384. https://doi.org/10.1107/S1600577525000566

Islam, R., Madsen, S. P. & Christensen, M. (2025). Enhancing magnetocrystalline anisotropy in W-type SrFe₁₈O₂₇ hexaferrite via tailored substitutions. Acta Materialia, 288, 120828. Article 120828. https://doi.org/10.1016/j.actamat.2025.120828

Mardal, F., Coskun, O., Razi Parjikolaei, B., Møller, T. L., Pedersen, J. S. & Corredig, M. (2025). Evaluating the impact of diafiltration media and heat treatment on the structure and gelation of microfiltered casein-rich concentrates. Food Hydrocolloids, 164, Article 111221. https://doi.org/10.1016/j.foodhyd.2025.111221

Vijayan, H., Ramasamy, G., Chakaravarthy, R., Ramasamy, G. & Kishor, K. S. S. (2025). Evaluation of the structural and magnetic properties of Sr₄Fe₆O₁₃ ceramics prepared from nanoplatelets of α-Fe₂O₃. Journal of Materials Science: Materials in Electronics, 36(29), Article 1893. https://doi.org/10.1007/s10854-025-15912-7

Slavensky, H. H., Parmar, V. S., Leiszner, S. S., Thiel, A. M., Lassen, H., Calder, S., Kibalin, I. & Iversen, B. B. (2025). Experimental determination of the magnetic anisotropy in five-coordinated Co(ii) field-induced single molecule magnets. Chemical Science, 16(36), 16610-16624. https://doi.org/10.1039/d5sc03103f

Stange, A. D., Zuzic, L., Schiøtt, B. & Berglund, N. A. (2025). Exploring insulin-receptor dynamics: Stability and binding mechanisms. Structure, 33(8), 1425-1435.e2. https://doi.org/10.1016/j.str.2025.04.022

Bregnhøj, M., Knak Jensen, S. J., Thøgersen, J. & Finster, K. (2025). Exploring the impact of wind-driven saltation on methane in the atmosphere of Mars. Icarus, 441, Article 116734. https://doi.org/10.1016/j.icarus.2025.116734

Knattrup, Y. & Elm, J. (2025). Extrapolating Local Coupled Cluster Calculations toward CCSD(T)/CBS Binding Energies of Atmospheric Molecular Clusters. ACS Omega, 10(40), 46794-46808. https://doi.org/10.1021/acsomega.5c04476

Nisticò, R. & Jensen, T. R. (2025). Featured Papers in Inorganic Materials 2024. Inorganics, 13(4), Article 110. https://doi.org/10.3390/inorganics13040110

Albrechtsen, S. H., Christensen, J. K., Petersen, C. E., Schouder, C. A., Carchi-Villalta, P. J., Sánchez-Pérez, I., Bartolomei, M., González-Lezana, T., Pirani, F. & Stapelfeldt, H. (2025). Femtosecond-and-atom-resolved solvation dynamics of a Na⁺ ion in a helium nanodroplet. The Journal of Chemical Physics, 162(17), 174309, 1-13. Article 174309. https://doi.org/10.1063/5.0260588

Mandayo, G. G., Fernández-Menéndez, M. J., Beldarrain, O., Paredes, J., Dong, M. & Olaizola, S. M. (2025). Femtosecond Laser Processing of Surfaces for Health-Related Applications. In M. Yu, Y. Zeng, B. Wang, J. Wang, H. Wu, D. Wang, Z. Song & Z. Wang (Eds.), 2025 IEEE International Conference on Manipulation, Manufacturing and Measurement on the Nanoscale, 3M-NANO 2025 - Conference Proceedings (pp. 42-45). IEEE. https://doi.org/10.1109/3M-NANO65639.2025.11261004

Fujita, T., Sun, Y., Li, H., Albert, T. J., Song, S., Sato, T., Moesgaard, J., Cornet, A., Sun, P., Chen, Y., Mo, M., Amini, N., Yang, F., Lucas, P., Esposito, V., Vila-Comamala, J., Wang, N., Mamyrbayev, T., David, C. ... Wei, S. (2025). Femtosecond x-ray photon correlation spectroscopy enables direct observations of atomic-scale relaxations of glass forming liquids. Journal of Chemical Physics, 162(19), Article 194201. https://doi.org/10.1063/5.0264574

Leng, F., Clark, R., Zhang, W., Viennet, T., Wang, C., Arthanari, H., Wang, X. & Hur, S. (2025). FoxP3 forms a head-to-head dimer in vivo and stabilizes its multimerization on adjacent microsatellites. Cell Reports, 44(12), Article 116633. https://doi.org/10.1016/j.celrep.2025.116633

Displaying results 201 to 250 out of 5955

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Department of Chemistry