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F. Matthias Bickelhaupt: [Publications] [Author Rank by year] [Co-authors] [Prefers] [Cites] [Cited by]

Publications of Author

  1. F. Matthias Bickelhaupt
    Understanding reactivity with Kohn-Sham molecular orbital theory: E2-SN2 mechanistic spectrum and other concepts. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1999, v:20, n:1, pp:114-128 [Journal]
  2. F. Matthias Bickelhaupt, Miquel Solà, Paul von Ragué Schleyer
    Theoretical Investigation of the Relative Stabilites of XSSX and X2SS Isomers (X=F, C1, H, and CH3. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1995, v:16, n:4, pp:465-477 [Journal]
  3. Célia Fonseca Guerra, Jan-Willem Handgraaf, Evert Jan Baerends, F. Matthias Bickelhaupt
    Voronoi deformation density (VDD) charges: Assessment of the Mulliken, Bader, Hirshfeld, Weinhold, and VDD methods for charge analysis. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2004, v:25, n:2, pp:189-210 [Journal]
  4. G. Theodoor De Jong, Daan P. Geerke, Axel Diefenbach, Miquel Solà, F. Matthias Bickelhaupt
    Oxidative addition of the ethane C-C bond to Pd. An ab initio benchmark and DFT validation study. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:10, pp:1006-1020 [Journal]
  5. G. te Velde, F. Matthias Bickelhaupt, Evert Jan Baerends, Célia Fonseca Guerra, Stan J. A. van Gisbergen, Jaap G. Snijders, T. Ziegler
    Chemistry with ADF. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:9, pp:931-967 [Journal]
  6. A. Patrícia Bento, Miquel Solà, F. Matthias Bickelhaupt
    Ab initio and DFT benchmark study for nucleophilic substitution at carbon (SN2@C) and silicon (SN2@Si). [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:14, pp:1497-1504 [Journal]
  7. Marcel Swart, Ernst Rösler, F. Matthias Bickelhaupt
    Proton affinities of maingroup-element hydrides and noble gases: Trends across the periodic table, structural effects, and DFT validation. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:13, pp:1486-1493 [Journal]

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