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	hartrees
Energy at 0K	-0.392798
Energy at 298.15K	-0.393744
HF Energy	-0.392798
Nuclear repulsion energy	0.165968

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.594
Na2	0.000	0.000	-1.594

	Na1	Na2
Na1		3.1884
Na2	3.1884

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	0.000
2	Na	0.000

	x	y	z	Total
	0.000	0.000	0.000	0.000
CHELPG
AIM
ESP

All results from a given calculation for Na₂ (Sodium diatomic)

using model chemistry: PBEPBEultrafine/CEP-121G

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>	13.492
(<r²>)^1/2	3.673

All results from a given calculation for Na2 (Sodium diatomic)

using model chemistry: PBEPBEultrafine/CEP-121G

States and conformations

All results from a given calculation for Na₂ (Sodium diatomic)