Soft-Sphere Model for Closed-Shell Atoms and Ions

• T. L. Gilbert

  Argonne National Laboratory, Argonne, Illinois

抄録

Using recent spectroscopic data for the alkali halide monomers, it is shown that approximate additivity rules of the form Rij = Ri + Rj and ρij = ρi + ρj hold for the radii and hardness parameters in the Born–Mayer repulsive potential, Uij(R) = fρijexp[(Rij − R) / ρij].

収録刊行物

• The Journal of Chemical Physics

  The Journal of Chemical Physics 49 (6), 2640-2642, 1968-09-15

  AIP Publishing

キーワード

• Physical and Theoretical Chemistry
• General Physics and Astronomy

詳細情報

• CRID: 1363670318270893440
• NII論文ID: 30015696115
• DOI: 10.1063/1.1670463
• ISSN: 10897690
• ISSN: 00219606
• ISSN: http://id.crossref.org/issn/03010104
• ISSN: http://id.crossref.org/issn/00219606
• Web Site: https://pubs.aip.org/aip/jcp/article-pdf/49/6/2640/18857765/2640_1_online.pdf
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