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	hartrees
Energy at 0K	-761.876398
Energy at 298.15K	-761.877532
HF Energy	-761.876398
Nuclear repulsion energy	31.229324

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-2.260
K2	0.000	0.000	1.309

	Na1	K2
Na1		3.5689
K2	3.5689

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	-0.089
2	K	0.089

	x	y	z	Total
	0.000	0.000	2.641	2.641
CHELPG
AIM
ESP

All results from a given calculation for NaK (Sodium Potassium)

using model chemistry: PBEPBE/Def2TZVPP

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>	104.892
(<r²>)^1/2	10.242