Back to Search Start Over

Density functional analysis of [sup 13]C and [sup 1]H chemical shifts and bonding in....

Authors :
Kaupp, Martin
Malkina, Olga L.
Source :
Journal of Chemical Physics. 3/1/1998, Vol. 108 Issue 9, p3648. 12p. 6 Diagrams, 8 Charts, 6 Graphs.
Publication Year :
1998

Abstract

Examines the density functional analysis of [sup 13]C and [sup 1]H nuclear magnetic resonance chemical shifts and bonding in mercurymethanes and organomercury hydrides. Impact of scalar relativistic effects on the shift; Factors influencing the spin-orbit contributions; Importance of electron correlations in chemical shifts.

Details

Language :
English
ISSN :
00219606
Volume :
108
Issue :
9
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
4320037
Full Text :
https://doi.org/10.1063/1.475759