III.G.1.a.

Compare Calculated Bonds for F-H

B1B95/aug-cc-pVQZ

Histogram of Bond lengths (in Å) vs number of species

Values greater than 1.02 are in the 1.02 bin. Values less than 1.00 are in the 1.00 bin.

	5
	4
	3
	2
	1
	0
		1.00			1.01			1.02
bond lengths (Å)

Summary: (Å)

Average bond length	Standard deviation
1.008	0.000

	Species	Name	Bond Length (Å)
Lowest value	HF-	hydrogen fluoride anion	1.008
Highest value	HF-	hydrogen fluoride anion	1.008

Calculated Bond lengths
Click on entry for all calculated results.

Species	Name	Bond Length (Å)	Atom1 index	Atom2 index
HF-	hydrogen fluoride anion	1.008	1	2
HF	Hydrogen fluoride	1.008	1	2
HF+	hydrogen fluoride cation	1.008	1	2