Anders Østergaard Madsen

Anders Østergaard Madsen

Associate Professor


  1. Published

    Determining short-lived solid forms during phase transformations using molecular dynamics

    Larsen, A. S., Olsen, M. A., Moustafa, H., Larsen, F. H., Sauer, Stephan P. A., Rantanen, Jukka & Madsen, Anders Østergaard, 2019, In: CrystEngComm. 21, 27, p. 4020-4024 5 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  2. Published

    Making a robust carbon-cobalt(III) bond

    Larsen, Erik, Madsen, Anders Østergaard, Kofod, P. & Song, Y., 2009, In: Inorganic Chemistry. 48, 15, p. 7159-7164 6 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  3. Published

    Discovery of a cyclic 6 + 6 hexamer of d-biotin and formaldehyde

    Lisbjerg, M., Jessen, B. M., Rasmussen, B., Nielsen, B. E., Madsen, Anders Østergaard & Pittelkow, Michael, 2014, In: Chemical Science. 5, 7, p. 2647-2650 4 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  4. Published

    Synthesis of dithiafulvene–quinone donor–acceptor systems: isolation of a Michael adduct

    Lissau, H. S., Jevric, M., Madsen, Anders Østergaard & Nielsen, Mogens Brøndsted, 2015, In: Acta Crystallographica Section C. 71, 6, p. 452-455 4 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  5. Published

    CuAAC and RuAAC with alkyne-functionalised Dihydroazulene photoswitches and determination of Hammett σ-constants for Triazoles

    Lissau, H. S., Broman, S. L., Jevric, M., Madsen, Anders Østergaard & Nielsen, Mogens Brøndsted, 2014, In: Australian Journal of Chemistry. 67, 3, p. 531-534 4 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  6. Published

    SHADE web server: http://www.shade.ki.ku.dk

    Madsen, Anders Østergaard, 2006

    Research output: Non-textual formComputer programmeResearch

  7. Published

    Modeling and analysing thermal motion in experimental charge density studies

    Madsen, Anders Østergaard, 2012, Modern charge-density analysis. Gatti, C. & Macchi, P. (eds.). Springer, p. 133-163 31 p.

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  8. Published

    Insight into Solid-State Entropy from Diffraction Data

    Madsen, Anders Østergaard & Larsen, Sine, 2007, In: Angewandte Chemie - International Edition. 46, 45, p. 8609-8613

    Research output: Contribution to journalJournal articleResearchpeer-review

  9. Published

    A neutron diffraction study of xylitol: derivation of mean square internal vibrations for H atoms from a rigid-body description

    Madsen, Anders Østergaard, Mason, S. & Larsen, Sine, 2003, In: Acta Crystallographica. Section B: Structural Science. 59, p. 653-663

    Research output: Contribution to journalJournal articleResearchpeer-review

  10. Published

    Modeling and analysis of hydrogen atoms

    Madsen, Anders Østergaard, 2012, Electron density and chemical bonding I: experimental charge density studies. Stalke, D. (ed.). Springer, p. 21-52 32 p. (Structure and Bonding, Vol. 146).

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  11. Published

    SHADE3 server: a streamlined approach to estimate H-atom anisotropic displacement parameters using periodic ab initio calculations or experimental information

    Madsen, Anders Østergaard & Hoser, A. A., 2014, In: Journal of Applied Crystallography. 47, 6, p. 2100-2104 5 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  12. Published

    A simple approach to estimate isotropic displacement parameters for hydrogen atoms

    Madsen, Anders Østergaard & Hoser, A. A., 2015, In: Acta Crystallographica. Section A: Foundations of Crystallography. 71, 2, p. 169-174 6 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  13. Published

    Modeling of the nuclear parameters for H atoms in X-ray charge-density studies

    Madsen, Anders Østergaard, Osholm, H., Flensburg, C., Stewart, R. F. & Larsen, Sine, 2004, In: Acta Crystallographica. Section A: Foundations of Crystallography. 60, 6, p. 550-561

    Research output: Contribution to journalJournal articleResearchpeer-review

  14. Published

    Anisotropic displacement parameters for molecular crystals from periodic Hartree-Fock and density functional theory calculations

    Madsen, Anders Østergaard, Civalleri, B., Ferrabone, M., Pascale, F. & Erba, A., 2013, In: Acta Crystallographica. Section A: Foundations of Crystallography. 69, p. 309-321 13 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  15. Published

    SHADE web server for estimation of hydrogen anisotropic displacement parameters

    Madsen, Anders Østergaard, 2006, In: Journal of Applied Crystallography. 39, 5, p. 757-758 2 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  16. Published

    Understanding Thermodynamic Properties at the Molecular Level: Multiple Temperature Charge Density Study of Ribitol and Xylitol

    Madsen, Anders Østergaard, Mattson, R. & Larsen, Sine, 2011, In: Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory. 115, p. 7794–7804

    Research output: Contribution to journalJournal articleResearchpeer-review

  17. Published

    Unveiling polyamorphism and polyamorphic interconversions in pharmaceuticals: the peculiar case of hydrochlorothiazide

    Batista Martins, Inês Catarina, Larsen, A. S., Madsen, Anders Østergaard, Aalling-Frederiksen, Olivia, Correia, A., Jensen, Kirsten Marie Ørnsbjerg, Jeppesen, H. S. & Rades, Thomas, 2023, In: Chemical Science. 14, 41, p. 11447-11455 9 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  18. Published

    Crystal structures and thermodynamic properties of polymorphs and hydrates of selected 2-pyridinecarboxaldehyde hydrazones

    Mazur, L., Jarzembska, K. N., Kaminski, R., Hoser, A. A., Madsen, Anders Østergaard, Pindelska, E. & Zielinska-Pisklak, M., 2016, In: Crystal Growth & Design. 16, 6, p. 3101-3112 12 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  19. Published

    Experimental evidence of a 3-centre, 2-electron covalent bond character of the central O-H-O fragment on the Zundel cation in crystals of Zundel nitranilate tetrahydrate

    Molcanov, K., Jelsch, C., Wenger, E., Stare, J., Madsen, Anders Østergaard & Kojic-Prodic, B., 28 Jul 2017, In: CrystEngComm. 19, 28, p. 3898-3901

    Research output: Contribution to journalJournal articleResearchpeer-review

  20. Published

    13C NMR Chemical Shifts of Saccharides in the Solid State: A Density Functional Theory Study

    Moustafa, H., Larsen, F. H., Madsen, Anders Østergaard & Sauer, Stephan P. A., 2023, In: Magnetochemistry. 9, 8, 15 p., 192.

    Research output: Contribution to journalJournal articleResearchpeer-review

  21. Published

    Estimated H-atom anisotropic displacement parameters: a comparison between different methods and with neutron diffraction results

    Munshi, P., Madsen, Anders Østergaard, Spackman, M. A., Larsen, Sine & Destro, R., 2008, In: Acta Crystallographica. Section A: Foundations of Crystallography. A64, p. 465-75 10 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  22. Published

    Structure of the cross-ß spine of amyloid-like fibrils

    Nelson, R., Sawaya, M. R., Balbirnie, M., Madsen, Anders Østergaard, Riekel, C., Grothe, R. & Eisenberg, D., 2005, In: Nature. 435, 7043, p. 773-778 6 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  23. Published

    Low-temperature crystal structure evolution of (Na,Ca)(Cr,Mg)Si2O6 pyroxene

    Nestola, F., Madsen, Anders Østergaard, Tribaudino, M., Balic Zunic, Tonci, Ohashi, H., Secco, L. & Dal Negro, A., 2008, In: Mineralogical Magazine. 72, 3, p. 809-816 8 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  24. Published

    Determination of the crystal structure of magnesium stearate hydrate using micrometre size single crystals

    Rekis, T., Herzberg, M., Larsen, A. S., Gonzalez, A., Rantanen, Jukka & Madsen, Anders Østergaard, 2021, In: Acta Crystallographica Section A: Foundations and Advances. 77, p. C901-C901 1 p.

    Research output: Contribution to journalConference abstract in journalResearchpeer-review

  25. Published

    Design, synthesis, and time-gated cell imaging of carbon-bridged triangulenium dyes with long fluorescence lifetime and red emission

    Rosenberg, M., Rostgaard, K. R., Liao, Z., Madsen, Anders Østergaard, Martinez, Karen Laurence, Vosch, Tom & Laursen, Bo Wegge, 2018, In: Chemical Science. 9, 12, p. 3122-3130 9 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

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