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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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Shi, Z., Ferreiro, S., Lothenbach, B., Geiker, M. R., Kunther, W., Kaufmann, J., Herfort, D. & Skibsted, J. (2019). Sulfate resistance of calcined clay – Limestone – Portland cements. Cement and Concrete Research, 116, 238-251. https://doi.org/10.1016/j.cemconres.2018.11.003

Hu, X. M., Pedersen, S. U. & Daasbjerg, K. (2019). Supported molecular catalysts for the heterogeneous CO₂ electroreduction. Current Opinion in Electrochemistry, 15, 148-154. https://doi.org/10.1016/j.coelec.2019.05.006

Pries, J., Wei, S., Wuttig, M. & Lucas, P. (2019). Switching between Crystallization from the Glassy and the Undercooled Liquid Phase in Phase Change Material Ge₂Sb₂Te₅. Advanced Materials, 31(39), Article 1900784. https://doi.org/10.1002/adma.201900784

Nazari, P., Nouri, O. & Rahman Setayesh, S. (2019). Synergistic cobalt-nickel co-catalyst for enhanced visible light induced photocatalytic water oxidation. Journal of Chemical Sciences, 132, Article 13. https://doi.org/10.1007/s12039-019-1716-4

Underlin, E. N. & Jensen, H. H. (2019). Synthesis of nortropane alkaloid calystegine B₂ from methyl α-D-xylopyranoside. Carbohydrate Research, 472, 122-126. https://doi.org/10.1016/j.carres.2018.12.002

Molino, A., Holzinger, J., Lukaszuk, K. A., Rojo-Gama, D., Gunnaes, A. E., Skibsted, J., Lundegaard, L. F., Svelle, S., Beato, P., Bordiga, S. & Lillerud, K. P. (2019). Synthesis of ZSM-23 (MTT) zeolites with different crystal morphology and intergrowths: effects on the catalytic performance in the conversion of methanol to hydrocarbons. Catalysis Science & Technology, 9(23), 6782-6792. https://doi.org/10.1039/c9cy01068h

Xu, H., Sommer, S., Broge, N. L. N., Gao, J. & Iversen, B. B. (2019). The Chemistry of Nucleation: In Situ Pair Distribution Function Analysis of Secondary Building Units During UiO-66 MOF Formation. Chemistry - A European Journal, 25(8), 2051-2058. https://doi.org/10.1002/chem.201805024

Liu, X.-R., Chen, X.-M., Zhang, J., Jensen, T. R. & Chen, X. (2019). The interconversion between THF•B₃H₇ and B₃H₈-: an efficient synthetic method for MB₃H₈ (M = Li and Na). Dalton Transactions, 48(16), 5140-5143. https://doi.org/10.1039/c9dt00843h

Zobeydi, R., Nazari, P. & Rahman Setayesh, S. (2019). Theoretical study of the thermodynamic parameters of (CaO)n nanoclusters with n = 2–16 in the gas and solution phases: proton affinity, molecular basicity, and pKb values. Structural Chemistry, 30(5), 1805-1818. https://doi.org/10.1007/s11224-019-01318-9

Madsen, M. M., Jensen, F., Jensen, S. K. & Thøgersen, J. (2019). The primary photo-dissociation dynamics of carboxylate anions in aqueous solution: decarboxylation. Physical Chemistry Chemical Physics, 21(14), 7358-7366. https://doi.org/10.1039/c8cp07621a

Teiwes, R., Elm, J., Bilde, M. & Pedersen, H. B. (2019). The reaction of hydrated iodide I(H₂O)^- with ozone: a new route to IO2− products. Physical Chemistry Chemical Physics, 21(32), 17546-17554. https://doi.org/10.1039/C9CP01734H

Song, L., Zhang, J. & Iversen, B. B. (2019). Thermal stability of p-type Ag-doped Mg ₃ Sb ₂ thermoelectric materials investigated by powder X-ray diffraction. Physical Chemistry Chemical Physics, 21(8), 4295-4305. https://doi.org/10.1039/c8cp07648k

Roldin, P., Ehn, M., Kurtén, T., Olenius, T., Rissanen, M. P., Sarnela, N., Elm, J., Rantala, P., Hao, L., Hyttinen, N., Heikkinen, L., Worsnop, D. R., Pichelstorfer, L., Xavier, C., Clusius, P., Öström, E., Petäjä, T., Kulmala, M., Vehkamäki, H. ... Boy, M. (2019). The role of highly oxygenated organic molecules in the Boreal aerosol-cloud-climate system. Nature Communications, 10(1), Article 4370. https://doi.org/10.1038/s41467-019-12338-8

Yu, J., Sondergaard-Pedersen, F., Mamakhel, A., Lamagni, P. & Iversen, B. B. (2019). Three-dimensional morphology of anatase nanocrystals obtained from supercritical flow synthesis with industrial grade TiOSO₄ precursor. Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 75, 1086-1095. https://doi.org/10.1107/S2052520619012733

Hansen, M. B., Madsen, N. K., Zoccante, A. & Christiansen, O. (2019). Time-dependent vibrational coupled cluster theory: Theory and implementation at the two-mode coupling level. The Journal of Chemical Physics, 151(15), Article 154116. https://doi.org/10.1063/1.5117207

Roelsgaard, M., Dippel, A.-C., Borup, K., Nielsen, I. G., Broge, N. L. N., Röh, J. T., Gutowski, O. & Iversen, B. B. (2019). Time-resolved grazing-incidence pair distribution functions during deposition by radio-frequency magnetron sputtering. IUCrJ, 6(2), 299-304. https://doi.org/10.1107/S2052252519001192

Nguyen, T. J. D., Manuguerra, I., Kumar, V. & Gothelf, K. V. (2019). Toehold-Mediated Strand Displacement in a Triplex Forming Nucleic Acid Clamp for Reversible Regulation of Polymerase Activity and Protein Expression. Chemistry - A European Journal, 25(53), 12303-12307. https://doi.org/10.1002/chem.201903496

Dnestryan, A. I., Tolstikhin, O. I., Jensen, F. & Madsen, L. B. (2019). Torsional effects in strong-field ionization of molecules. Physical Review Research , 1(2), Article 023018. https://doi.org/10.1103/PhysRevResearch.1.023018

Keshavarz, M., Ottesen, M., Wiedmann, S., Wharmby, M., Küchler, R., Yuan, H., Debroye, E., Steele, J. A., Martens, J., Hussey, N. E., Bremholm, M., Roeffaers, M. B. J. & Hofkens, J. (2019). Tracking Structural Phase Transitions in Lead-Halide Perovskites by Means of Thermal Expansion. Advanced Materials, 31(24), 1900521-1 til 1900521-8. Article 1900521. https://doi.org/10.1002/adma.201900521

Fischer, K. F. F., Roth, N. & Iversen, B. B. (2019). Transport properties and crystal structure of layered LaSb₂. Journal of Applied Physics, 125(4), 045110-1 - 045110-7. Article 045110. https://doi.org/10.1063/1.5081819

Grinderslev, J. B., Møller, K. T., Bremholm, M. & Jensen, T. R. (2019). Trends in Synthesis, Crystal Structure, and Thermal and Magnetic Properties of Rare-Earth Metal Borohydrides. Inorganic Chemistry, 58(9), 5503-5517. https://doi.org/10.1021/acs.inorgchem.8b03258

Bregnhøj, M., Strunge, K., Sørensen, R. J., Ströbele, M., Hummel, T., Meyer, H. J., Jensen, F. & Ogilby, P. R. (2019). Tungsten Iodide Clusters as Singlet Oxygen Photosensitizers: Exploring the Domain of Resonant Energy Transfer at 1 eV. The Journal of Physical Chemistry A, 123(9), 1730-1739. https://doi.org/10.1021/acs.jpca.9b00541

Madsen, M. R., Koefoed, L., Jensen, H., Daasbjerg, K. & Pedersen, S. U. (2019). Two-phase bipolar electrografting. Electrochimica Acta, 317, 61-69. https://doi.org/10.1016/j.electacta.2019.04.186

Bregnhøj, M. & Ogilby, P. R. (2019). Two-Photon Excitation of Neat Aerated Solvents with Visible Light Produces Singlet Oxygen. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 123(35), 7567-7575. https://doi.org/10.1021/acs.jpca.9b05517

Blom, J., Reyes Rodriguez, G. J., Tobiesen, H. N., Lamhauge, J. N., Iversen, M. V., Barløse, C. L., Hammer, N., Rusbjerg, M. & Jørgensen, K. A. (2019). Umpolung Strategy for α-Functionalization of Aldehydes for the Addition of Thiols and other Nucleophiles. Angewandte Chemie - International Edition, 58(49), 17856-17862. https://doi.org/10.1002/anie.201911793

Elm, J. (2019). Unexpected Growth Coordinate in Large Clusters Consisting of Sulfuric Acid and C ₈ H ₁₂ O ₆ Tricarboxylic Acid. The Journal of Physical Chemistry A, 123(14), 3170-3175. https://doi.org/10.1021/acs.jpca.9b00428

Shrivastava, M., Andreae, M. O., Artaxo, P., Barbosa, H. M. J., Berg, L. K., Brito, J., Ching, J., Easter, R. C., Fan, J., Fast, J. D., Feng, Z., Fuentes, J. D., Glasius, M., Goldstein, A. H., Alves, E. G., Gomes, H., Gu, D., Guenther, A., Jathar, S. H. ... Zhao, C. (2019). Urban pollution greatly enhances formation of natural aerosols over the Amazon rainforest. Nature Communications, 10(1), Article 1046. https://doi.org/10.1038/s41467-019-08909-4

Bregnhøj, M., Dichmann, L., McLoughlin, C. K., Westberg, M. & Ogilby, P. R. (2019). Uric Acid: A Less-than-Perfect Probe for Singlet Oxygen. Photochemistry and Photobiology, 95(1), 202-210. https://doi.org/10.1111/php.12971

Madsen, D., Christiansen, O., Norman, P. & Koenig, C. (2019). Vibrationally resolved emission spectra of luminescent conjugated oligothiophenes from anharmonic calculations. Physical Chemistry Chemical Physics, 21(31), 17410-17422. https://doi.org/10.1039/c9cp03039e

Bak, E. N., Larsen, M. G., Jensen, S. K., Nornberg, P., Moeller, R. & Finster, K. (2019). Wind-Driven Saltation: An Overlooked Challenge for Life on Mars. Astrobiology, 19(4), 497-505. https://doi.org/10.1089/ast.2018.1856

Yu, W., Hjerrild, P., Jacobsen, K. M., Tobiesen, H. N., Clemmensen, L. & Poulsen, T. B. (2018). A Catalytic Oxidative Quinone Heterofunctionalization Method: Synthesis of Strongylophorine-26. Angewandte Chemie - International Edition, 57(31), 9805-9809. https://doi.org/10.1002/anie.201805580

Kumar, C., Fliegl, H., Jensen, F., Teale, A. M., Reine, S. & Kjærgaard, T. (2018). Accelerating Kohn-Sham response theory using density fitting and the auxiliary-density-matrix method. International Journal of Quantum Chemistry, 118(16), Article e25639. https://doi.org/10.1002/qua.25639

Hansen-Bruhn, M., de Ávila, B. E. F., Beltrán-Gastélum, M., Zhao, J., Ramírez-Herrera, D. E., Angsantikul, P., Vesterager Gothelf, K., Zhang, L. & Wang, J. (2018). Active Intracellular Delivery of a Cas9/sgRNA Complex Using Ultrasound-Propelled Nanomotors. Angewandte Chemie - International Edition, 57(10), 2657-2661. https://doi.org/10.1002/anie.201713082

Kjelstrup, M. V., Nielsen, L. D. F., Hansen-Bruhn, M. & Gothelf, K. V. (2018). A DNA-based assay for digoxin detection. Biosensors, 8(1), 19-30. https://doi.org/10.3390/bios8010019

Nazari, P. & Rahman Setayesh, S. (2018). Advanced Oxidation Treatment of Acid Blue 92 using Fe3O4/rGO Nanocatalyst as High Performance Catalyst. In 5th International Conference on Applied Research in Chemistry and Chemical Engineerin

Tamtögl, A., Pusterhofer, M., Bremholm, M., Hedegaard, E. M. J., Iversen, B. B., Hofmann, P., Ellis, J., Allison, W., Miret-Artés, S. & Ernst, W. E. (2018). A Helium-Surface Interaction Potential of Bi₂Te₃(111) from Ultrahigh-Resolution Spin-Echo Measurements. Surface Science, 678(12), 25 - 31. https://doi.org/10.1016/j.susc.2018.02.006

Pickering, J. D., Shepperson, B., Hübschmann, B. A. K., Thorning, F. & Stapelfeldt, H. (2018). Alignment and Imaging of the CS2 Dimer Inside Helium Nanodroplets. Physical Review Letters, 120(11), Article 113202. https://doi.org/10.1103/PhysRevLett.120.113202

Ibsen, C. J. S., Leemreize, H., Mikladal, B. F., Skovgaard, J., Bremholm, M., Eltzholtz, J. R., Iversen, B. B. & Birkedal, H. (2018). Alkali Counterions Impact Crystallization Kinetics of Apatite Nanocrystals from Amorphous Calcium Phosphate in Water at High pH. Crystal Growth and Design, 18(11), 6723-6728. https://doi.org/10.1021/acs.cgd.8b01008

Huen, P. & Ravnsbæk, D. B. (2018). All-solid-state lithium batteries – The Mg₂FeH₆-electrode LiBH₄-electrolyte system. Electrochemistry Communications, 87, 81-85. https://doi.org/10.1016/j.elecom.2018.01.001

Madsen, D., Christiansen, O. & König, C. (2018). Anharmonic vibrational spectra from double incremental potential energy and dipole surfaces. Physical Chemistry Chemical Physics, 20(5), 3445-3456. https://doi.org/10.1039/c7cp07190f

Granados-Miralles, C., Saura-Múzquiz, M., Andersen, H. L., Quesada, A., Ahlburg, J. V., Dippel, A.-C., Canévet, E. & Christensen, M. (2018). Approaching Ferrite-Based Exchange-Coupled Nanocomposites as Permanent Magnets. ACS Applied Nano Materials, 1(7), 3693-3704. https://doi.org/10.1021/acsanm.8b00808

Krieger, U. K., Siegrist, F., Marcolli, C., Emanuelsson, E. U., Gøbel, F. M., Bilde, M., Marsh, A., Reid, J. P., Huisman, A. J., Riipinen, I., Hyttinen, N., Myllys, N., Kurtén, T., Bannan, T., Percival, C. J. & Topping, D. (2018). A reference data set for validating vapor pressure measurement techniques: Homologous series of polyethylene glycols. Atmospheric Measurement Techniques, 11(1), 49-63. https://doi.org/10.5194/amt-11-49-2018

Schmitz, G. A. & Christiansen, O. (2018). Assessment of the overlap metric in the context of RI-MP2 and atomic batched tensor decomposed MP2. Chemical Physics Letters, 701(8), 7-14. https://doi.org/10.1016/j.cplett.2018.04.014

Teiwes, R., Elm, J., Handrup, K., Jensen, E. P., Bilde, M. & Pedersen, H. B. (2018). Atmospheric chemistry of iodine anions: Elementary reactions of I^-, IO^-, and IO₂ ^- with ozone studied in the gas-phase at 300 K using an ion trap. Physical Chemistry Chemical Physics, 20(45), 28606-28615. https://doi.org/10.1039/c8cp05721d

Ma, F., Ding, Z., Elm, J., Xie, H. B., Yu, Q., Liu, C., Li, C., Fu, Z., Zhang, L. & Chen, J. (2018). Atmospheric Oxidation of Piperazine Initiated by ·cl: Unexpected High Nitrosamine Yield. Environmental Science & Technology, 52(17), 9801-9809. https://doi.org/10.1021/acs.est.8b02510

Freedman, M., Bilde, M., Donahue, N. M. & Glasius, M. (2018). Atmospheric surfaces. Environmental Science: Processes & Impacts, 20(11), 1498-1499. https://doi.org/10.1039/c8em90043d

Olesen, M. T. J., Winther, A., Fejerskov, B., Dagnæs-Hansen, F., Simonsen, U. & Zelikin, A. N. (2018). Bi‐Enzymatic Embolization Beads for Two‐Armed Enzyme‐Prodrug Therapy. Advanced Therapeutics, 1(4), Article 1800023. https://doi.org/10.1002/adtp.201800023

Wei, S., Evenson, Z., Stolpe, M., Lucas, P. & Austen Angell, C. (2018). Breakdown of the Stokes-Einstein relation above the melting temperature in a liquid phase-change material. Science Advances, 4(11), Article eaat8632. https://doi.org/10.1126/sciadv.aat8632

Lu, H., Lutz, H., Roeters, S. J., Hood, M. A., Schäfer, A., MunÌoz-Espí, R., Berger, R., Bonn, M. & Weidner, T. (2018). Calcium-Induced Molecular Rearrangement of Peptide Folds Enables Biomineralization of Vaterite Calcium Carbonate. Journal of the American Chemical Society, 140(8), 2793-2796. https://doi.org/10.1021/jacs.8b00281

Displaying results 1601 to 1650 out of 5239

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Department of Chemistry