Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Compare Calculated Bonds for O-F

CCSD=FULL/daug-cc-pVTZ

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

Values greater than 1.45 are in the 1.45 bin. Values less than 1.41 are in the 1.41 bin.

	5
	4
	3
	2
	1
	0
		1.41			1.42			1.42			1.43			1.43			1.44			1.44			1.45
bond lengths (Å)