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Interpretation of Indirect Nuclear Spin-Spin Coupling Tensors for Polyatomic Xenon Fluorides and Group 17 Fluorides: Results from Relativistic Density-Functional Calculations.
- Source :
-
Inorganic Chemistry . 6/17/2002, Vol. 41 Issue 12, p3091. 11p. 12 Diagrams, 4 Charts, 4 Graphs. - Publication Year :
- 2002
-
Abstract
- Examines the nuclear spin-spin coupling tensors for polyatomic xenon fluorides and group 17 fluorides. Reduction of coupling constants for halogen-noble gas spin pairs; Use of zeroth-order regular approximation density-functional theory method in interpreting spin-spin coupling of polyatomic systems; Mechanisms of chlorine-fluorine isotropic coupling constants.
- Subjects :
- *COUPLING constants
*FLUORIDES
*DENSITY functionals
Subjects
Details
- Language :
- English
- ISSN :
- 00201669
- Volume :
- 41
- Issue :
- 12
- Database :
- Academic Search Index
- Journal :
- Inorganic Chemistry
- Publication Type :
- Academic Journal
- Accession number :
- 7097309
- Full Text :
- https://doi.org/10.1021/ic020025u