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	hartrees
Energy at 0K	-1349.734627
Energy at 298.15K
HF Energy	-1349.734627
Nuclear repulsion energy	199.214696

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	785	749	0.00	17.81	0.20	0.33
2	A_g	257	245	0.00	5.47	0.04	0.08
3	B_1u	460	440	186.49	0.00	0.00	0.00
4	B_2u	186	177	111.40	0.00	0.00	0.00
5	B_3g	448	428	0.00	0.98	0.75	0.86
6	B_3u	63	60	100.86	0.00	0.00	0.00

Atom	y (Å)	z (Å)
K1	0.000	2.258
K2	0.000	-2.258
O3	0.769	0.000
O4	-0.769	0.000

	K1	K2	O3	O4
K1		4.5158	2.3852	2.3852
K2	4.5158		2.3852	2.3852
O3	2.3852	2.3852		1.5378
O4	2.3852	2.3852	1.5378

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
K1	O3	K2	142.389		K1	O4	K2	142.389
O3	K1	O4	37.611		O3	K2	O4	37.611

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

using model chemistry: HSEh1PBE/6-31+G**

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	0.822
2	K	0.822
3	O	-0.822
4	O	-0.822

<r²>	217.851
(<r²>)^1/2	14.760

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

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

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