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	hartrees
Energy at 0K	-607.441025
Energy at 298.15K	-607.441592
HF Energy	-607.441025
Nuclear repulsion energy	8.931393

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-2.917
K2	0.000	0.000	0.461

	Li1	K2
Li1		3.3772
K2	3.3772

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Li	-0.102
2	K	0.102

	x	y	z	Total
	0.000	0.000	2.734	2.734
CHELPG
AIM
ESP

All results from a given calculation for LiK (Lithium Potassium)

using model chemistry: B3LYP/TZVP

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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<r²>	45.695
(<r²>)^1/2	6.760