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      How well does the Hartree–Fock model predict equilibrium geometries of transition metal complexes? Large‐scale LCAO–SCF studies on ferrocene and decamethylferrocene

      Author(s): , , ,
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      Journal: The Journal of Chemical Physics
      Publisher: AIP Publishing

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          Gaussian-Type Functions for Polyatomic Systems. I

          Sigeru Huzinaga (1965)
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            Gaussian basis sets for the first and second row atoms

            B. Roos, P. Siegbahn (1970)
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              Counterintuitive orbital mixing in semiempirical and ab initio molecular orbital calculations

              J. Ammeter, H. Buergi, J. C. Thibeault … (1978)
              Article 0 comments Cited 70 times – based on 0 reviews     Review now
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                Author and article information

                Journal
                Title: The Journal of Chemical Physics
                Abbreviated Title: The Journal of Chemical Physics
                Publisher: AIP Publishing
                ISSN (Print): 0021-9606
                ISSN (Electronic): 1089-7690
                Publication date Created: August 15 1982
                Publication date (Print): August 15 1982
                Volume: 77
                Issue: 4
                Pages: 2002-2009
                Article
                DOI: 10.1063/1.444053
                SO-VID: c12e21d7-5986-4e6a-89c2-cd198a1a8a6e
                Copyright © © 1982
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