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-Cl

ROHF/daug-cc-pVTZ

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

Values greater than 1.31 are in the 1.31 bin. Values less than 1.27 are in the 1.27 bin.

	5
	4
	3
	2
	1
	0
		1.27			1.27			1.28			1.28			1.29			1.29			1.30			1.30			1.31
bond lengths (Å)