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	hartrees
Energy at 0K	-1343.482250
Energy at 298.15K
HF Energy	-1343.482250
Nuclear repulsion energy	196.506760

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	723	723	0.00	670.47	0.31	0.47
2	A_g	238	238	0.00	796.67	0.07	0.12
3	B_1u	413	413	99.82	0.00	0.07	0.14
4	B_2u	185	185	80.95	0.00	0.00	0.00
5	B_3g	412	412	0.00	30.84	0.75	0.86
6	B_3u	63	63	79.17	0.00	0.00	0.00

Atom	y (Å)	z (Å)
K1	0.000	2.259
K2	0.000	-2.259
O3	0.826	0.000
O4	-0.826	0.000

	K1	K2	O3	O4
K1		4.5186	2.4057	2.4057
K2	4.5186		2.4057	2.4057
O3	2.4057	2.4057		1.6530
O4	2.4057	2.4057	1.6530

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
K1	O3	K2	139.813		K1	O4	K2	139.813
O3	K1	O4	40.187		O3	K2	O4	40.187

All results from a given calculation for K₂O₂ (dipotassium dioxide)

using model chemistry: B97D3/3-21G*

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	K	0.362
2	K	0.362
3	O	-0.362
4	O	-0.362

<r²>	221.014
(<r²>)^1/2	14.867

All results from a given calculation for K2O2 (dipotassium dioxide)

using model chemistry: B97D3/3-21G*

States and conformations

All results from a given calculation for K₂O₂ (dipotassium dioxide)