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LiCl |
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Lithium
and Chlorine |
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Nuclear
Quadrupole Coupling Constants |
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in
Lithium Chloride |
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Table 1. Lithium and Chlorine
nqcc's in LiCl (MHz). |
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Calc. |
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Expt. |
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7Li |
eQqo |
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0.2468 |
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0.24993(50) [1] |
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35Cl |
eQqo |
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3.07212(11) [2] |
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eQqe |
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2.864 |
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Bond
Length, re = 2.020700(8) Å [2] |
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[1] Landolt-Börnstein |
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[2] F.J.Lovas and E.Tiemann,
J.Phys.Chem.Ref.Data 3,609(1974). |
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"Nuclear quadrupole coupling
constants in alkali halide molecules: an ab initio
quantum chemical study" G.B.Bacskay and A.D.Buckingham, Mol.Phys.
91,391(1997). |
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"Vibrational-rotational dependence of
molecular properties, Electric
field gradients for HCl, LiCl, NaCl and KCl" M.Seth, M.Pernpointner,
G.A.Bowmaker, and P.Schwerdtfeger, Mol.Phys. 96,1767(1999). |
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LiH |
LiF |
LiBr |
LiOH |
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LiNC |
Li2 |
LiBH4 |
BCl |
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NaCl |
KCl |
AlCl |
GaCl |
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Table of Contents |
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Molecules/Lithium |
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Molecules/Bromine |
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LiCl.html |
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Last
Modified 6 Dec 2004 |
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