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 H-O

LSDA/Def2TZVPP

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

Values greater than 1.18 are in the 1.18 bin. Values less than 0.94 are in the 0.94 bin.

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	1
	0
		0.94			0.96			0.98			1.00			1.02			1.04			1.06			1.08			1.10			1.12			1.14			1.16			1.18
bond lengths (Å)