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 Angles

HSEh1PBE/6-31G* for aClAsCl

Histogram of angle differences (in degrees) vs number of species

Differences greater than 0.011 are in the 0.011 bin. Differences less than -0.001 are in the -0.001 bin.

	10
	8
	6
	4
	2
	0
		-0.001			0			0.001			0.002			0.003			0.004			0.005			0.006			0.007			0.008			0.009			0.01			0.011
Angle difference calc. - exp. (degrees)