• Medientyp: E-Artikel
  • Titel: Lower-Bound Procedure for Energy Eigenvalues by the Partitioning Technique
  • Beteiligte: Choi, Jong H.; Smith, Darwin W.
  • Erschienen: AIP Publishing, 1966
  • Erschienen in: The Journal of Chemical Physics, 45 (1966) 12, Seite 4425-4433
  • Sprache: Englisch
  • DOI: 10.1063/1.1727521
  • ISSN: 0021-9606; 1089-7690
  • Schlagwörter: Physical and Theoretical Chemistry ; General Physics and Astronomy
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  • Beschreibung: <jats:p>A lower-bound procedure for obtaining energy eigenvalues by use of the partitioning technique and bracketing theorem, which have been developed by Löwdin, is extended to the case of a multidimensional reference manifold and is applied to the ground state of the two-electron isoelectronic series. Except for H−, the agreement between upper and lower bounds is quite satisfactory. The process of obtaining lower bounds for excited states is considered.</jats:p>