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	hartrees
Energy at 0K	-541.116750
Energy at 298.15K
HF Energy	-541.116750
Nuclear repulsion energy	107.511233

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	866	831	116.09	5.80	0.28	0.43
2	A₁	358	344	7.78	0.81	0.59	0.74
3	B₂	850	816	170.76	5.15	0.75	0.86

Atom	y (Å)	z (Å)
P1	0.000	0.566
F2	1.207	-0.472
F3	-1.207	-0.472

	P1	F2	F3
P1		1.5919	1.5919
F2	1.5919		2.4140
F3	1.5919	2.4140

Number	Element	Mulliken
1	P	0.510
2	F	-0.255
3	F	-0.255

All results from a given calculation for PF₂ (Phosphorus difluoride)

using model chemistry: mPW1PW91/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>	49.058
(<r²>)^1/2	7.004

All results from a given calculation for PF2 (Phosphorus difluoride)

using model chemistry: mPW1PW91/cc-pVTZ

States and conformations

All results from a given calculation for PF₂ (Phosphorus difluoride)