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	hartrees
Energy at 0K	-473.385419
Energy at 298.15K
HF Energy	-473.385419
Nuclear repulsion energy	129.130341

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A_g	886	807	0.00	68.74	0.42	0.59
2	A_g	378	344	0.00	3.61	0.12	0.21
3	B_1u	584	532	175.47	0.00	0.03	0.05
4	B_2u	255	232	118.57	0.00	0.75	0.85
5	B_3g	518	472	0.00	5.13	0.75	0.86
6	B_3u	71	65	138.69	0.00	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.928
Na2	0.000	-1.928
O3	0.752	0.000
O4	-0.752	0.000

	Na1	Na2	O3	O4
Na1		3.8561	2.0695	2.0695
Na2	3.8561		2.0695	2.0695
O3	2.0695	2.0695		1.5040
O4	2.0695	2.0695	1.5040

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O3	Na2	137.384		Na1	O4	Na2	137.384
O3	Na1	O4	42.616		O3	Na2	O4	42.616

All results from a given calculation for Na₂O₂ (disodium dioxide)

using model chemistry: HF/aug-cc-pVDZ

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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Number	Element	Mulliken
1	Na	0.806
2	Na	0.806
3	O	-0.806
4	O	-0.806

<r²>	98.561
(<r²>)^1/2	9.928

All results from a given calculation for Na2O2 (disodium dioxide)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for Na₂O₂ (disodium dioxide)