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MRSD-CI calculations of deuteron quadrupole coupling constants for low-lying rovibrational levels of HD and D2 in their X1Σg+ and B1Σg+ states

✍ Scribed by J. Vojtík; L. Cěšpiva; I. Paidarová; J. Šavrda

Book ID: 113257395
Publisher: Elsevier Science
Year: 1991
Tongue: English
Weight: 848 KB
Volume: 227
Category: Article
ISSN: 0166-1280
DOI: 10.1016/0166-1280(91)85277-e

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## Abstract The ^2^H, ^6^Li, and ^7^Li quadrupole coupling constants of the low‐lying rovibrational levels in the __X__^1^∑^+^ and __A__^1^∑^+^ electronic states of ^7^Li^2^H, ^6^Li^2^H, ^7^Li^1^H, and ^6^Li^1^H are calculated from molecular wave functions which explicitly describe nuclear motion.