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Frank Jensen

  1. 2019
  2. Published

    Describing Molecular Polarizability by a Bond Capacity Model. / Poier, Pier Paolo; Jensen, Frank.

    In: Journal of Chemical Theory and Computation, Vol. 15, No. 5, 05.2019, p. 3093-3107.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  3. Published

    The primary photo-dissociation dynamics of carboxylate anions in aqueous solution: decarboxylation. / Madsen, Marlene Møller; Thøgersen, Jan; Jensen, Frank; Jensen, Svend Knak.

    In: Physical Chemistry Chemical Physics, 18.03.2019.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  4. Published

    Tungsten Iodide Clusters as Singlet Oxygen Photosensitizers : Exploring the Domain of Resonant Energy Transfer at 1 eV. / Bregnhøj, Mikkel; Strunge, Kris; Sørensen, Rasmus Juhl; Ströbele, Markus; Hummel, Thorsten; Meyer, H. Jürgen; Jensen, Frank; Ogilby, Peter R.

    In: Journal of Physical Chemistry A, Vol. 123, No. 9, 02.2019, p. 1730-1739.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  5. Published

    Probing Basis Set Requirements for Calculating Core Ionization and Core Excitation Spectroscopy by the Δ Self-Consistent-Field Approach. / Ambroise, Maximilien A. ; Jensen, Frank.

    In: Journal of Chemical Theory and Computation, Vol. 15, No. 1, 01.2019, p. 325-337.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  6. E-pub ahead of print

    Structure, DFT based investigations on vibrational and nonlinear optical behavior of a new guanidinium cobalt thiocyanate complex. / Triki, H.; Nagy, B.; Overgaard, J.; Jensen, Frank; Kamoun, S.

    In: Structural Chemistry, 2019.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  7. 2018
  8. Published

    Structure factors for tunneling ionization rates of molecules : General grid-based methodology and convergence studies. / Dnestryan, Andrey I.; Tolstikhin, Oleg I.; Madsen, Lars Bojer; Jensen, Frank.

    In: The Journal of Chemical Physics, Vol. 149, No. 16, 28.10.2018, p. 164107-1 - 164107-9.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  9. Published

    Method Calibration or Data Fitting? / Jensen, Frank.

    In: Journal of Chemical Theory and Computation, Vol. 14, No. 9, 11.09.2018, p. 4651-4661.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  10. Published

    Accelerating Kohn-Sham response theory using density fitting and the auxiliary-density-matrix method. / Kumar, Chandan; Fliegl, Heike; Jensen, Frank; Teale, Andrew M.; Reine, Simen; Kjærgaard, Thomas.

    In: International Journal of Quantum Chemistry, Vol. 118, No. 16, e25639, 15.08.2018.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  11. Published

    Development of polarization consistent basis sets for spin-spin coupling constant calculations for the atoms Li, Be, Na, and Mg. / Aggelund, Patrick A.; Sauer, Stephan P.A.; Jensen, Frank.

    In: Journal of Chemical Physics, Vol. 149, No. 4, 044117, 28.07.2018.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  12. Published

    Structural Investigation of Ye'elimite, Ca4Al6O12SO4, by 27Al MAS and MQMAS NMR at Different Magnetic Fields. / Pedersen, Malene Thostrup; Jensen, Frank; Skibsted, Jørgen.

    In: Journal of Physical Chemistry C, Vol. 122, No. 22, 07.06.2018, p. 12077-12089.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

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