Chemical Physics Letters, 0009-2614

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  1. 2009
  2. On the coupling of intermolecular polarization and repulsion through pseudo-potentials

    Pär Söderhjelm & Öhrn, A., 2009, In : Chemical Physics Letters. 468, 1-3, p. 94-99

    Research output: Contribution to journalArticle

  3. 2008
  4. High resolution X-ray emission spectroscopy of liquid water: The observation of two structural motifs

    T. Tokushima, Harada, Y., Takahashi, O., Senba, Y., Ohashi, H., Pettersson, L. G. M., Nilsson, A. & Shin, S., 2008 Jul 30, In : Chemical Physics Letters. 460, 4-6, p. 387-400 14 p.

    Research output: Contribution to journalArticle

  5. An electronic signature of hydrolysation in the X-ray absorption spectrum of aqueous formaldehyde

    Ottosson, N., Aziz, E. F., Bradeanu, I. L., Legendre, S., Gunnar Öhrwall, Svensson, S., Bjoerneholm, O. & Eberhardt, W., 2008, In : Chemical Physics Letters. 460, 4-6, p. 540-542

    Research output: Contribution to journalArticle

  6. On the excited-state multi-dimensionality in cyanines

    Dietzek, B., Brüggemann, B., Petter Persson & Arkady Yartsev, 2008, In : Chemical Physics Letters. 455, 1-3, p. 13-19

    Research output: Contribution to journalArticle

  7. Solvent effects on the nitrogen NMR shielding and nuclear quadrupole coupling constants in 1-methyltriazoles

    Mogelhoj, A., Aidas, K., Mikkelsen, K. V. & Kongsted, J., 2008, In : Chemical Physics Letters. 460, 1-3, p. 129-136

    Research output: Contribution to journalArticle

  8. Solvent effects on zero-point vibrational corrections to optical rotations and nuclear magnetic resonance shielding constants

    Kongsted, J. & Ruud, K., 2008, In : Chemical Physics Letters. 451, 4-6, p. 226-232

    Research output: Contribution to journalArticle

  9. The Douglas-Kroll-Hess electron density at an atomic nucleus

    Mastalerz, R., Lindh, R. & Reiher, M., 2008, In : Chemical Physics Letters. 465, 1-3, p. 157-164

    Research output: Contribution to journalArticle

  10. The influence of the sigma resonance on the Auger decay of core-ionized molecular nitrogen

    Stacey Ristinmaa Sörensen, Miron, C., Feifel, R., Piancastelli, M. -N., Bjorneholm, O. & Svensson, S., 2008, In : Chemical Physics Letters. 456, 1-3, p. 1-6

    Research output: Contribution to journalArticle

  11. The ozone ring closure as a test for multi-state multi-configurational second order perturbation theory (MS-CASPT2)

    De Vico, L., Pegado, L., Heimdal, J., Pär Söderhjelm & Roos, B., 2008, In : Chemical Physics Letters. 461, 1-3, p. 136-141

    Research output: Contribution to journalArticle

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