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	hartrees
Energy at 0K	-2224.051989
Energy at 298.15K
HF Energy	-2224.051989
Nuclear repulsion energy	294.773258

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'	618	611	0.00	13.29	0.06	0.12
2	A₂"	191	189	51.67	0.00	0.75	0.86
3	E'	702	694	96.84	2.33	0.75	0.86
3	E'	702	694	96.84	2.33	0.75	0.86
4	E'	176	174	27.81	1.25	0.75	0.86
4	E'	176	174	27.81	1.24	0.75	0.86

Atom	x (Å)	y (Å)
Ga1	0.000	0.000
F2	0.000	1.754
F3	1.519	-0.877
F4	-1.519	-0.877

	Ga1	F2	F3	F4
Ga1		1.7544	1.7544	1.7544
F2	1.7544		3.0388	3.0388
F3	1.7544	3.0388		3.0388
F4	1.7544	3.0388	3.0388

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Ga1	F3	120.000		F2	Ga1	F4	120.000
F3	Ga1	F4	120.000

All results from a given calculation for GaF₃ (Gallium trifluoride)

using model chemistry: PBEPBE/TZVP

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	Ga	1.089
2	F	-0.363
3	F	-0.363
4	F	-0.363

<r²>	103.349
(<r²>)^1/2	10.166

All results from a given calculation for GaF3 (Gallium trifluoride)

using model chemistry: PBEPBE/TZVP

States and conformations

All results from a given calculation for GaF₃ (Gallium trifluoride)