AlF
		Aluminum
	Nuclear Quadrupole Coupling Constants
		in Aluminum Fluoride
	Table 1. Aluminum nqcc's in AlF (MHz).     Calc. Expt.     27Al eQqo - 37.34 * - 37.487(43) [1]   - 37.53 ** - 37.59(25) [2] - 37.53(12) [3] - 37.6(10) [4]   eQqe - 37.75(8) [3]
	* HF/TZV(2d) model.
	** HF/aug-cc-pCVDZ/aug-cc-pVDZ model.
	Bond Length, re = 1.6543883 Å [5].
	[1] R.Honerjäger and R.Tischer, Z.Naturforsch. 29a,342(1974).
	[2] F.C.Wyse, W.Gordy, and E.F.Pearson, J.Chem.Phys. 52,3887(1970).
	[3] J.Hoeft, F.J.Lovas, E.Tiemann, and T.Törring, Z.Naturforsch. 25a,1029(1970).
	[4] D.R.Lide, Jr. J.Chem.Phys. 38,2027(1963); 42,1013(1965).
	[5] F.J.Lovas and E.Tiemann, J.Phys.Chem.Ref.Data 3,609(1974).
	AlCN		AlNC		AlH
	AlCl		AlBr		GaF
	Table of Contents
	Molecules/Aluminum
						AlF.html
						Last Modified 10 Dec 2004