✦ LIBER ✦

A comparison of ground- and excited-state properties of [Ru(bz)2]2+ and bis(?6-benzene)ruthenium(II)p-toluenesulfonate using the density functional theory

✍ Scribed by Gilardoni, F.; Weber, J.; Hauser, A.; Daul, C.

Publisher: John Wiley and Sons
Year: 1999
Tongue: English
Weight: 406 KB
Volume: 20
Category: Article
ISSN: 0192-8651
DOI: 10.1002/(sici)1096-987x(199910)20:13<1343::aid-jcc2>3.0.co;2-u

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✦ Synopsis

The ground-and excited-state properties of both Ru bz and 2 1 g 1 g 1 g 2 e Renner᎐Teller active coordinate. It vanishes as the crystal packing is taken 1 u into account.