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Journals in DBLP

Journal of Computational Chemistry
2002, volume: 23, number: 8

  1. Lucas Visscher
    The Dirac equation in quantum chemistry: Strategies to overcome the current computational problems. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:759-766 [Journal]
  2. Hermann Stoll, Bernhard Metz, Michael Dolg
    Relativistic energy-consistent pseudopotentials - Recent developments. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:767-778 [Journal]
  3. Christoph Van Wüllen
    Spin densities in two-component relativistic density functional calculations: Noncollinear versus collinear approach. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:779-785 [Journal]
  4. Kenneth G. Dyall
    A systematic sequence of relativistic approximations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:786-793 [Journal]
  5. Martin Kaupp, Roman Reviakine, Olga L. Malkina, Alexei Arbuznikov, Bernd Schimmelpfennig, Vladimir G. Malkin
    Calculation of electronic g-tensors for transition metal complexes using hybrid density functionals and atomic meanfield spin-orbit operators. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:794-803 [Journal]
  6. J. Autschbach, S. Siekierski, M. Seth, P. Schwerdtfeger, W. H. E. Schwarz
    Dependence of relativistic effects on electronic configuration in the neutral atoms of d- and f-block elements. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:804-813 [Journal]
  7. Trond Saue, Trygve Helgaker
    Four-component relativistic Kohn-Sham theory. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:814-823 [Journal]
  8. Martin Kleinschmidt, Jörg Tatchen, Christel M. Marian
    Spin-orbit coupling of DFT/MRCI wavefunctions: Method, test calculations, and application to thiophene. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:824-833 [Journal]
  9. Maite García-Hernández, Christa Lauterbach, Sven Krüger, Alexei Matveev, Notker Rüsch
    Comparative study of relativistic density functional methods applied to actinide species AcO22+ and AcF6 for Ac = U, Np. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:834-846 [Journal]
  10. Takahito Nakajima, Takeshi Yanai, Kimihiko Hirao
    Relativistic electronic structure theory. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:8, pp:847-860 [Journal]
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