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 C-Li

wB97X-D/6-31G(2df,p)

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

Values greater than 1.97 are in the 1.97 bin. Values less than 1.92 are in the 1.92 bin.

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	1
	0
		1.92			1.92			1.93			1.93			1.94			1.94			1.95			1.95			1.96			1.96			1.97
bond lengths (Å)