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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	D*H	¹Σ_g
1	2	no	C2V	¹A₁

	hartrees
Energy at 0K	-398.891763
Energy at 298.15K	-398.892727
HF Energy	-398.561847
Nuclear repulsion energy	61.844127

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ_g	343	330
2	Σ_u	659	633
3	Π_u	37	36
3	Π_u	37	36

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.000
Na2	0.000	0.000	2.023
Na3	0.000	0.000	-2.023

	O1	Na2	Na3
O1		2.0235	2.0235
Na2	2.0235		4.0469
Na3	2.0235	4.0469

All results from a given calculation for Na₂O (disodium monoxide)

using model chemistry: CCSD(T)/aug-cc-pVQZ

States and conformations

Conformer 1 (D*H)

Conformer 2 (C2V)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for Na2O (disodium monoxide)

using model chemistry: CCSD(T)/aug-cc-pVQZ

States and conformations

Conformer 1 (D*H)

Conformer 2 (C2V)

All results from a given calculation for Na₂O (disodium monoxide)