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	hartrees
Energy at 0K	-473.427242
Energy at 298.15K
HF Energy	-473.427242
Nuclear repulsion energy	129.259056

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	913	831	0.00	53.92	0.47	0.64
2	A_g	375	341	0.00	4.36	0.07	0.12
3	B_1u	578	527	170.51	0.00	0.08	0.14
4	B_2u	252	229	117.86	0.00	0.72	0.84
5	B_3g	517	471	0.00	4.51	0.75	0.86
6	B_3u	79	72	136.94	0.00	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.930
Na2	0.000	-1.930
O3	0.747	0.000
O4	-0.747	0.000

	Na1	Na2	O3	O4
Na1		3.8594	2.0694	2.0694
Na2	3.8594		2.0694	2.0694
O3	2.0694	2.0694		1.4948
O4	2.0694	2.0694	1.4948

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O3	Na2	137.656		Na1	O4	Na2	137.656
O3	Na1	O4	42.344		O3	Na2	O4	42.344

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

using model chemistry: HF/aug-cc-pVTZ

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	0.909
2	Na	0.909
3	O	-0.909
4	O	-0.909

<r²>	98.586
(<r²>)^1/2	9.929

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

using model chemistry: HF/aug-cc-pVTZ

States and conformations

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