Hyperfine and nuclear quadrupole coupling in chlorine and flourine dioxides

Fernandez, Berta; Christiansen, Ove
February 1997
Journal of Chemical Physics;2/1/1997, Vol. 106 Issue 5, p1847
Academic Journal
Presents a calculation of the hyperfine and nuclear quadrupole coupling tensors for the two chlorine dioxide isomers OClO and ClOO and for flourine dioxide FOO. Theory and calculational procedure; Theoretical results; Comparison with experiment; Spin multiplicities for the isomers; Geometry optimization for FOO.


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