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januszc's Pecul [4 articles]

Recent papers posted to januszc's library by the author Pecul. You can also see everyone's Pecul.
  • Relativistic effects on the electric polarizabilities and their geometric derivatives for hydrogen halides and dihalogens – a Dirac–Hartree–Fock study
    Chemical Physics Letters, Vol. 370, No. 3-4. (14 March 2003), pp. 578-588.
    by M Pecul
    posted to no-tag by januszc on 2008-12-08 11:40:00 as **
  • Electric field effects on the shielding constants of noble gases: A four-component relativistic Hartree-Fock study
    The Journal of Chemical Physics, Vol. 121, No. 7. (2004), pp. 3051-3057.
    by Magdalena Pecul, Trond Saue, Kenneth Ruud, Antonio Rizzo
    posted to no-tag by januszc on 2008-11-12 15:03:40 as **
  • Relativistic calculation of NMR properties of XeF2, XeF4 and XeF6
    Chemical Physics Letters, Vol. 427, No. 4-6. (31 August 2006), pp. 281-288.
    by A Antusek, M Pecul, J Sadlej
    posted to no-tag by januszc on 2008-11-12 13:55:55 as **
  • The quantum-chemical calculation of NMR indirect spin-spin coupling constants
    Progress in Nuclear Magnetic Resonance Spectroscopy, Vol. In Press, Corrected Proof
    by Trygve Helgaker, Michal Jaszunski, Magdalena Pecul
    posted to no-tag by januszc on 2008-08-01 12:48:38 as **
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