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januszc's tbc [8 articles]

Recent papers added to januszc's library classified by the tag tbc. You can also see everyone's tbc.
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  • Blue shifting and red shifting hydrogen bonds: A study of the HArFN2 and HArFP2 complexes
    Phys. Chem. Chem. Phys., Vol. 5, No. 5. (2003), pp. 808-811.
    by Sean A Mcdowell
    posted to tbc by januszc on 2008-11-12 15:45:25 as **
  • A computational study of the dihydrogen bonded complexes HBeH[centered ellipsis]HArF and HBeH[centered ellipsis]HKrF
    The Journal of Chemical Physics, Vol. 121, No. 12. (2004), pp. 5728-5732.
    by Sean AC Mcdowell
    posted to tbc by januszc on 2008-11-12 15:39:19 as **
  • Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
    The Journal of Chemical Physics, Vol. 90, No. 2. (1989), pp. 1007-1023.
    by Thom H Dunning
    posted to tbc by januszc on 2008-11-12 15:37:33 as ** along with 1 person and 1 group mkowa Femtochemistry_LMU
  • Electron affinities of the first-row atoms revisited. Systematic basis sets and wave functions
    The Journal of Chemical Physics, Vol. 96, No. 9. (1992), pp. 6796-6806.
    by Rick A Kendall, Thom H Dunning, Robert J Harrison
    posted to tbc by januszc on 2008-11-12 15:34:47 as ** along with 1 person and 1 group mkowa Femtochemistry_LMU
  • Direct calculation of the Hartree-Fock interaction energy via exchange-perturbation expansion. The He … He interaction
    International Journal of Quantum Chemistry, Vol. 32, No. 2. (1987), pp. 149-164.
    by Małgorzata Jeziorska, Bogumił Jeziorski, Jiri Cizek
    posted to tbc by januszc on 2008-11-12 15:31:44 as **
  • Relativistic effects in the intermolecular interaction-induced nuclear magnetic resonance parameters of xenon dimer
    The Journal of Chemical Physics, Vol. 127, No. 16. (2007)
    by Matti Hanni, Perttu Lantto, Miroslav Ilias, Hans, Juha Vaara
    posted to tbc by januszc on 2008-11-12 14:38:51 as **
  • Full four-component relativistic calculations of NMR shielding and indirect spin-spin coupling tensors in hydrogen halides
    Journal of Computational Chemistry, Vol. 20, No. 12. (1999), pp. 1262-1273.
    by Lucas Visscher, Thomas Enevoldsen, Trond Saue, Hans J Jensen, Jens Oddershede
    posted to tbc by januszc on 2008-11-12 14:16:01 as **
  • Calculation of electromagnetic properties of the noble gases
    Chemical Physics Letters, Vol. 211, No. 2-3. (13 August 1993), pp. 255-258.
    by David M Bishop, Sławomir M Cybulski
    posted to tbc by januszc on 2008-11-12 14:09:52 as **
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