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The 2S(+) - 2P separation in KOThe 2S(+) - 2P separation in KO is investigated using large basis sets and high levels of correlation treatment. Relativistic effects are included at the Dirac-Fock level and reduce the separation only slightly. The basis set superposition error is considered in detail. On the basis of these calculations, our best estimate places the 2p sub 3/2 state about 200 cm(exp -1) above the ground 2 sigma(+) state in agreement with our previous estimate.
Document ID
19930003712
Acquisition Source
Legacy CDMS
Document Type
Technical Memorandum (TM)
Authors
Bauschlicher, Charles W., Jr.
(NASA Ames Research Center Moffett Field, CA, United States)
Partridge, Harry
(NASA Ames Research Center Moffett Field, CA, United States)
Dyall, Kenneth G.
(Eloret Corp. Palo Alto, CA., United States)
Date Acquired
September 6, 2013
Publication Date
January 1, 1991
Subject Category
Atomic And Molecular Physics
Report/Patent Number
NASA-TM-108086
NAS 1.15:108086
Report Number: NASA-TM-108086
Report Number: NAS 1.15:108086
Accession Number
93N12900
Distribution Limits
Public
Copyright
Work of the US Gov. Public Use Permitted.
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