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	hartrees
Energy at 0K	-13.099388
Energy at 298.15K	-13.097055
HF Energy	-13.099388
Nuclear repulsion energy	5.895998

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	-1.526
Se2	0.000	0.000	0.628

	Si1	Se2
Si1		2.1540
Se2	2.1540

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Si	0.277
2	Se	-0.277

	x	y	z	Total
	0.000	0.000	-1.579	1.579
CHELPG
AIM
ESP

All results from a given calculation for SiSe (Silicon Monoselenide)

using model chemistry: B3LYP/LANL2DZ

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>	28.438
(<r²>)^1/2	5.333