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	hartrees
Energy at 0K	-491.879677
Energy at 298.15K	-491.880831
Nuclear repulsion energy	98.174377

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1068	1033	3.64
2	A₁	387	374	27.12
3	B₂	1305	1261	79.69

Atom	y (Å)	z (Å)
P1	0.000	0.303
O2	1.360	-0.284
O3	-1.360	-0.284

	P1	O2	O3
P1		1.4816	1.4816
O2	1.4816		2.7199
O3	1.4816	2.7199

Number	Element	Mulliken
1	P	0.704
2	O	-0.352
3	O	-0.352

All results from a given calculation for PO₂ (Phosphorus dioxide)

using model chemistry: B3LYP/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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<r²>	47.005
(<r²>)^1/2	6.856

All results from a given calculation for PO2 (Phosphorus dioxide)

using model chemistry: B3LYP/cc-pVTZ

States and conformations

All results from a given calculation for PO₂ (Phosphorus dioxide)