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Equilibrium structure of LiCCH

✍ Scribed by Jürgen Gauss; John F. Stanton

Publisher
John Wiley and Sons
Year
2000
Tongue
English
Weight
398 KB
Volume
77
Category
Article
ISSN
0020-7608

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✦ Synopsis

A coupled-cluster study of LiCCH is presented to provide state-of-the-art calculations for the equilibrium geometry of LiCCH and to supply vibration-rotation interaction constants, thus making possible the determination of an r e structure based on rotational constants from a recent microwave investigation of various isotopomers of LiCCH. The power of this combined experimental and theoretical approach to accurate equilibrium geometries is emphasized.

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