Publikationer

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Publikationer fra Institut for Kemi

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Xin, Z., Kou, J., Luo, M., Liu, Q., Carraro, M., Dong, M., Daasbjerg, K., Skrydstrup, T. & Huang, Y. (2024). Open frame-like Co-Fe oxides superstructures for highly efficient cross-dehydrogenative coupling reaction of N-phenyltetrahydroisoquinoline under mild conditions. Inorganic Chemistry Communications, 170(2), Artikel 113352. https://doi.org/10.1016/j.inoche.2024.113352

Svane, J., Vosegaard, E. S., Kløve, M. & Iversen, B. B. (2024). Optical Floating-Zone Furnace Single-Crystal Synthesis of van der Waals Material InSe. Crystal Growth and Design, 24(17), 6965-6971. https://doi.org/10.1021/acs.cgd.4c00520

Johansen, M. & Ravnsbæk, D. B. (2024). Order-Disorder Transition in Rutile VO₂(M) Electrodes during Li Intercalation and Extraction. ACS Omega, 9(34), 36291-36298. https://doi.org/10.1021/acsomega.4c02839

Mørch, M. I., Thomas-Hunt, J., Laursen, A. P., Simonsen, J., Frandsen, J. P., Vijayan, H. & Christensen, M. (2024). Oriented Nanomagnets Originating from Topotactic and Pseudomorphic Reactions. Chemistry of Materials, 36(4), 1919-1927. https://doi.org/10.1021/acs.chemmater.3c02616

Kristensen, S. K., Ahrens, A., Donslund, B. S. & Skrydstrup, T. (2024). Perspective on the Development of Monomer Recovery Technologies from Plastics Designed to Last. ACS Organic and Inorganic Au, 4(4), 373-386. https://doi.org/10.1021/acsorginorgau.4c00009

Naver, E. B., Bertelsen, M., Østergaard, M., Battaglia, D., Willendrup, P., Trtik, P., Schmidt, S., Birkedal, H. & Kuhn, L. T. (2024). Phase-contrast neutron imaging compared with wave propagation and McStas simulations. Journal of Applied Crystallography, 57(3), 707-713. https://doi.org/10.1107/S1600576724003030

Teodori, L., Kroer, S., Omer, M., Andersen, V. L., Bech, P., Su, J., Bridoux, J., Nielsen, J. S., Bertelsen, M. B., Hernot, S., Gothelf, K. V. & Kjems, J. (2024). Plug-and-play nucleic acid-mediated multimerization of biparatopic nanobodies for molecular imaging. Molecular Therapy - Nucleic Acids, 35(3), Artikel 102305. https://doi.org/10.1016/j.omtn.2024.102305

Brodszkij, E., Ryberg, C., Lyons, J. A., Juhl, D. W., Nielsen, N. C., Sigalas, N. I., Lyulin, A. V., Pedersen, J. S. & Städler, B. (2024). Poly(Sitosterol)-Based Hydrophobic Blocks in Amphiphilic Block Copolymers for the Assembly of Hybrid Vesicles. Small, 20(40), Artikel 2401934. https://doi.org/10.1002/smll.202401934

Jensen, M. S., Madsen, R. B., Salionov, D. & Glasius, M. (2024). Predicting the chemical composition of biocrude from hydrothermal liquefaction of biomasses using a multivariate statistical approach. Sustainable Energy and Fuels, 8(17), 3877-3891. https://doi.org/10.1039/d4se00860j

Ottosen, R. N., Seefeldt, J. M., Hansen, J., Nielsen, R., Møller, N., Johannsen, M. & Poulsen, T. B. (2024). Preparation and Preclinical Characterization of a Simple Ester for Dual Exogenous Supply of Lactate and Beta-hydroxybutyrate. Journal of Agricultural and Food Chemistry, 72(36), 19883-19890. https://doi.org/10.1021/acs.jafc.4c04849

Madzharova, F., Chatterley, A. S., Roeters, S. J. & Weidner, T. (2024). Probing Backbone Coupling within Hydrated Proteins with Two-Color 2D Infrared Spectroscopy. The Journal of Physical Chemistry Letters, 15(18), 4933-4939. https://doi.org/10.1021/acs.jpclett.4c00401

Bednarz, A., Rosendal, R. T., Lund, L. M. & Birkedal, V. (2024). Probing G-quadruplex-ligand binding using DNA intrinsic fluorescence. Biochimie, 227(Part A), 61-67. https://doi.org/10.1016/j.biochi.2024.06.009

Rasulov, U., Wang, H. K., Viennet, T., Droemer, M. A., Matosin, S., Schindler, S., Sun, Z. Y. J., Mureddu, L., Vuister, G. W., Robson, S. A., Arthanari, H. & Kuprov, I. (2024). Protein NMR assignment by isotope pattern recognition. Science Advances, 10(36), Artikel eado0403. https://doi.org/10.1126/sciadv.ado0403

Wittig, N. K., Pedersen, C., Palle, J., Østergaard, M., Christensen, T. E. K., Kahnt, M., Sadetskaia, A., Thomsen, J. S., Brüel, A. & Birkedal, H. (2024). Protocols for preparation of biomineralized samples for computed tomography. Tomography of Materials and Structures, 5, Artikel 100027. https://doi.org/10.1016/j.tmater.2024.100027

Camenisch, G.-M., Wili, N., Jeschke, G. & Ernst, M. (2024). Pulsed dynamic nuclear polarization: a comprehensive Floquet description. Physical Chemistry Chemical Physics, 26(25), 17666-17683. https://doi.org/10.1039/d4cp01788a

Høyer, N. M. & Christiansen, O. (2024). Quasi-direct Quantum Molecular Dynamics: The Time-Dependent Adaptive Density-Guided Approach for Potential Energy Surface Construction. Journal of Chemical Theory and Computation, 20(2), 558-579. https://doi.org/10.1021/acs.jctc.3c00962

Maia Neto, F., Snellings, R. & Skibsted, J. (2024). Reactivity of aqueous carbonated cement pastes: Effect of chemical composition and carbonation conditions. Journal of CO2 Utilization, 89, Artikel 102970. https://doi.org/10.1016/j.jcou.2024.102970

Duncan, A. L., Gao, Y., Haanappel, E., Im, W. & Chavent, M. (2024). Recent Advances in Modeling Membrane β-Barrel Proteins Using Molecular Dynamics Simulations: From Their Lipid Environments to Their Assemblies. I R. Ieva (red.), Transmembrane β-Barrel Proteins (Bind 2778, s. 311-330). Humana Press. https://doi.org/10.1007/978-1-0716-3734-0_19

Poppe, R., Roth, N., Neder, R. B., Palatinus, L., Iversen, B. B. & Hadermann, J. (2024). Refining short-range order parameters from the three-dimensional diffuse scattering in single-crystal electron diffraction data. IUCrJ, 11(Pt 1), 82-91. https://doi.org/10.1107/S2052252523010254

Grinderslev, J. B., Häussermann, U., Jensen, T. R., Faraone, A., Nagao, M., Karlsson, M., Udovic, T. J. & Andersson, M. S. (2024). Reorientational Dynamics in Y(BH₄)₃·xNH₃ (x = 0, 3, and 7): The Impact of NH₃ on BH₄^- Dynamics. Journal of Physical Chemistry C, 128(11), 4431-4439. https://doi.org/10.1021/acs.jpcc.4c00265

Knattrup, Y., Kubečka, J., Wu, H., Jensen, F. & Elm, J. (2024). Reparameterization of GFN1-xTB for atmospheric molecular clusters: applications to multi-acid-multi-base systems. RSC Advances, 14(28), 20048-20055. https://doi.org/10.1039/d4ra03021d

Lo, C.-W., Kariv, O., Hao, C., Gammeltoft, K. A., Bukh, J., Gottwein, J., Westberg, M., Lin, M. Z. & Einav, S. (2024). Replication capacity and susceptibility of nirmatrelvir-resistant mutants to next-generation Mpro inhibitors in a SARS-CoV-2 replicon system. Antiviral Research, 231, Artikel 106022. https://doi.org/10.1016/j.antiviral.2024.106022

Zhang, L., Kühling, F., Mattsson, A. M., Knijff, L., Hou, X., Ek, G., Dufils, T., Holm Gjørup, F., Kantor, I., Zhang, C., Brant, W. R., Edström, K. & Berg, E. J. (2024). Reversible Hydration Enabling High-Rate Aqueous Li-Ion Batteries. ACS Energy Letters, 9(3), 959-966. https://doi.org/10.1021/acsenergylett.4c00224

Youssef, S., Tsang, E., Samanta, A., Kumar, V. & Gothelf, K. V. (2024). Reversible Protection and Targeted Delivery of DNA Origami with a Disulfide-Containing Cationic Polymer. Small, 20(10), Artikel 2301058. https://doi.org/10.1002/smll.202301058

Bai, Y., Cordero-Lanzac, T., Nova, A., Olsbye, U., Taarning, E. & Martinez-Espin, J. S. (2024). Selective linear ethylene oligomerization over nickel-containing zeotypes with tetravalent framework heteroatoms. Catalysis Science and Technology, 14(7), 1991-2002. https://doi.org/10.1039/d3cy01736b

Ding, Y., Pedersen, S. S., Wang, H., Xiang, B., Wang, Y., Yang, Z., Gao, Y., Morosan, E., Jones, M. R., Xiao, H. & Ball, Z. (2024). Selective Macrocyclization of Unprotected Peptides with an Ex Situ Gaseous Linchpin Reagent. Angewandte Chemie International Edition, 63(30), Artikel e202405344. https://doi.org/10.1002/anie.202405344

Nielsen, H. H., Vilariño, P., Rodríguez, G., Trepard, F., Roubeau, O., Aromí, G. & Aguilà, D. (2024). Self-assembly of a supramolecular spin-crossover tetrahedron. Dalton Transactions, 53(23), 9792-9797. https://doi.org/10.1039/d4dt00578c

Skaanning, M. K., Bønnelykke, J., Nijenhuis, M. A. D., Samanta, A., Smidt, J. M. & Gothelf, K. V. (2024). Self-Assembly of Ultrasmall 3D Architectures of (L)-Acyclic Threoninol Nucleic Acids with High Thermal and Serum Stability. Journal of the American Chemical Society, 146(29), 20141-20146. https://doi.org/10.1021/jacs.4c04919

Bregnhøj, M., Thorning, F. & Ogilby, P. R. (2024). Singlet Oxygen Photophysics: From Liquid Solvents to Mammalian Cells. Chemical Reviews, 124(17), 9949-10051. https://doi.org/10.1021/acs.chemrev.4c00105

Insinska-Rak, M., Henke, P., Breitenbach, T. & Ogilby, P. R. (2024). Singlet oxygen quenching by riboflavin. Journal of Photochemistry and Photobiology A: Chemistry, 446, Artikel 115108. https://doi.org/10.1016/j.jphotochem.2023.115108

Liu, L., Chen, K., Wang, D., Hinterstein, M., Hansen, A. L., Knapp, M., Peng, B., Xing, X., Zhang, Y., Kong, J., Pramanick, A., Vogel Jørgensen, M. R. & Marlton, F. (2024). Size and orientation of polar nanoregions characterized by PDF analysis and using a statistical model in a Bi(Mg_1/2Ti_1/2)O₃-PbTiO₃ ferroelectric re-entrant relaxor. Journal of Materials Chemistry A, 12(19), 11580-11590. https://doi.org/10.1039/d4ta00240g

Hammond, O., Morris, D., Bousrez, G., Li, S., de Campo, L., Recsei, C., Moir, M., Glavatskih, S., Rutland, M. & Mudring, A.-V. (2024). Small-Angle Neutron Scattering Insights into 2-Ethylhexyl Laurate: A Remarkable Bioester. ACS Sustainable Chemistry & Engineering, 12(5), 1816-1821. https://doi.org/10.1021/acssuschemeng.3c04736

Oh, H., Tumanov, N., Ban, V., Li, X., Richter, B., Hudson, M. R., Brown, C. M., Iles, G. N., Wallacher, D., Jorgensen, S. W., Daemen, L., Balderas-Xicohténcatl, R., Cheng, Y., Ramirez-Cuesta, A. J., Heere, M., Posada-Pérez, S., Hautier, G., Hirscher, M., Jensen, T. R. & Filinchuk, Y. (2024). Small-pore hydridic frameworks store densely packed hydrogen. Nature Chemistry, 16(5), 809-816. https://doi.org/10.1038/s41557-024-01443-x

Kjær, T. S. S., Grinderslev, J. B., Skov, L. N. & Jensen, T. R. (2024). Sodium decahydrido-closo-1-carbadecaborate as a solid electrolyte: new insight into polymorphism and electrochemical performance. Journal of Materials Chemistry A, 12(30), 19485-19496. https://doi.org/10.1039/d4ta02293a

Yang, S. Y. & Skibsted, J. (2024). Sodium Sites and Hydration State in C-S-H Phases Synthesized under Alkaline Conditions from ¹H and ²³Na NMR Experiments. Journal of Physical Chemistry C, 128(26), 10888-10902. https://doi.org/10.1021/acs.jpcc.4c01982

Sørensen, M. K., Lemming, C., Jensen, O. N. & Nielsen, N. C. (2024). Soil Analysis by Mobile Multinuclear NMR: Quantification of Phosphorus, Aluminum, and Sodium. Analytical Chemistry, 96(43), 17086-17091. https://doi.org/10.1021/acs.analchem.4c01333

Nguyen, T. P. T., Humphries, T. D., Hagemann, H., Buckley, C. E., Jensen, T. R. & Paskevicius, M. (2024). Solubility of metal-boron-hydrogen compounds. Dalton Transactions, 54(3), 1199-1211. https://doi.org/10.1039/d4dt02256d

Sun, H., Ahrens, A., Batista, G. M. F., Donslund, B. S., Ravn, A. K., Schwibinger, E. V., Nova, A. & Skrydstrup, T. (2024). Solvent-base mismatch enables the deconstruction of epoxy polymers and bisphenol A recovery. Green Chemistry, 26(2), 815-824. https://doi.org/10.1039/d3gc03707j

Kløve, M., Philippot, G., Auxéméry, A., Aymonier, C. & Iversen, B. B. (2024). Stabilizing tetragonal ZrO₂ nanocrystallites in solvothermal synthesis. Nanoscale, 16(6), 3185-3190. https://doi.org/10.1039/d3nr05364d

Støckler, K. A. H., Zhang, J. & Brummerstedt Iversen, B. (2024). Stereochemically Active Lone Pairs Stabilizing Intrinsic Vacancy Defects in Thermoelectric InTe. Chemistry - A European Journal, 30(50), Artikel e202402001. https://doi.org/10.1002/chem.202402001

Møller, T. L., Bang Nielsen, S., Pedersen, J. S. & Corredig, M. (2024). Structural and compositional characterization of Ca- and β-casein enriched casein micelles. Food Hydrocolloids, 151, Artikel 109811. https://doi.org/10.1016/j.foodhyd.2024.109811

López-Sánchez, U., Munro, L. J., Ladefoged, L. K., Pedersen, A. J., Brun, C. C., Lyngby, S. M., Baud, D., Juillan-Binard, C., Pedersen, M. G., Lummis, S. C. R., Bang-Andersen, B., Schiøtt, B., Chipot, C., Schoehn, G., Neyton, J., Dehez, F., Nury, H. & Kristensen, A. S. (2024). Structural determinants for activity of the antidepressant vortioxetine at human and rodent 5-HT₃ receptors. Nature Structural and Molecular Biology, 31(8), 1232-1242. https://doi.org/10.1038/s41594-024-01282-x

Liu, C., Li, Z., Nie, S., Skibsted, J. & Ye, G. (2024). Structural evolution of calcium sodium aluminosilicate hydrate (C-(N-)A-S-H) gels induced by water exposure: The impact of Na leaching. Cement and Concrete Research, 178, Artikel 107432. https://doi.org/10.1016/j.cemconres.2024.107432

Pries, J., Stenz, C., Wei, S., Wuttig, M. & Lucas, P. (2024). Structural relaxation of amorphous phase change materials at room temperature. Journal of Applied Physics, 135(13), Artikel 135101. https://doi.org/10.1063/5.0198312

Madzharova, F. & Weidner, T. (2024). Structure and Dynamics of Milk Proteins Interacting with Caffeine and Espresso Determined by Two-Dimensional Infrared Spectroscopy. ACS Food Science & Technology, 4(6), 1430-1435. https://doi.org/10.1021/acsfoodscitech.4c00070

Jakobsen, C. L., Andersen, B. P., Johansen, M., Christensen, C. K., Drejer, A. Ø., Karlsen, M. A. & Ravnsbæk, D. B. (2024). Structure and evolution of disordered deep-charge phases in Na_xCrO₂ Na-ion battery electrodes. Journal of Power Sources, 591, Artikel 233875. https://doi.org/10.1016/j.jpowsour.2023.233875

Kranabetter, L., Kristensen, H. H., Schouder, C. A. & Stapelfeldt, H. (2024). Structure determination of alkali trimers on helium nanodroplets through laser-induced Coulomb explosion. The Journal of Chemical Physics, 160(13), Artikel 131101. https://doi.org/10.1063/5.0200389

Aryal, U. K., Atajanov, R., Broløs, L., El-Sayed, A. A., Henke, P., Jespersen, M. F., Langhorn, L. M., Madsen, M., Martos, D. G., Mikkelsen, K. V., Mogensen, J., Nielsen, M. B., Ogilby, P. R., Rasmussen, M. G., Rindom, C. & Turkovic, V. (2024). Structure–Property Relationships with Functionalized Subphthalocyanines: Toward Photovoltaic Devices More Stable to Photooxidative Degradation Mediated by Singlet Oxygen. Advanced Functional Materials, 34(50), Artikel 2310222. https://doi.org/10.1002/adfm.202310222

Thomsen, S. R. & Goesten, M. (2024). Symmetry-Shaped Singularities in High-Temperature Superconductor H₃S. Journal of the American Chemical Society, 146(27), 18298-18305. https://doi.org/10.1021/jacs.4c02038

Vosegaard, E. S., Mamakhel, M. A. H., Parmar, V. S., Bertelsen, A. D. & Iversen, B. B. (2024). Synthesis and characterization of an organic-inorganic hybrid crystal: 2[Co(en)₃](V₄O₁₃)·4H₂O. Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 80(Part 5), 488-494. https://doi.org/10.1107/S2052520624007509

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Institut for Kemi