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Lower Bounds for the Energy Levels of Anharmonic OscillatorsThe lower‐bounds method presented by Löwdin in the preceding paper has been applied to oscillators perturbed by third‐ and fourth‐power terms in the potential‐energy expression. For favorable cases agreement between upper and lower bounds is easily carried to many more figures than are likely to be physically significant. In many cases the lower bounds agreed more closely to the true eigenvalue than did the corresponding upper bounds. For a given basis set, this method gives closer bounds than that of Bazley and Fox, except for energy levels too high to be satisfactorily treated in the given basis. The only disadvantage found was that for close bounds double precision proved necessary, indicating more than ordinary loss of computational accuracy.
Document ID
19660036877
Acquisition Source
Headquarters
Document Type
Reprint (Version printed in journal)
External Source(s)
Authors
Reid, Charles E.
(Florida Univ. Gainesville, FL, United States)
Date Acquired
August 3, 2013
Publication Date
November 15, 1965
Publication Information
Publication: Journal of Chemical Physics
Publisher: American Institute of Physics
Volume: 43
ISSN: 0021-9606
e-ISSN: 1089-7690
Subject Category
Atomic And Molecular Physics
Report/Patent Number
E-ISSN: 1089-7690
ISSN: 0021-9606
Accession Number
66A16167
Funding Number(s)
CONTRACT_GRANT: NSG-512
Distribution Limits
Public
Copyright
Other

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