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	hartrees
Energy at 0K	-3305.019141
Energy at 298.15K
HF Energy	-3305.019141
Nuclear repulsion energy	520.937437

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'	380	365	0.00	24.71	0.05	0.10
2	A₂"	141	135	12.47	0.00	0.75	0.86
3	E'	469	451	90.00	3.16	0.75	0.86
3	E'	469	451	90.00	3.16	0.75	0.86
4	E'	124	119	7.63	1.81	0.75	0.86
4	E'	124	119	7.64	1.81	0.75	0.86

Atom	x (Å)	y (Å)
Ga1	0.000	0.000
Cl2	0.000	2.114
Cl3	1.831	-1.057
Cl4	-1.831	-1.057

	Ga1	Cl2	Cl3	Cl4
Ga1		2.1145	2.1145	2.1145
Cl2	2.1145		3.6624	3.6624
Cl3	2.1145	3.6624		3.6624
Cl4	2.1145	3.6624	3.6624

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	Ga1	Cl3	120.000		Cl2	Ga1	Cl4	120.000
Cl3	Ga1	Cl4	120.000

All results from a given calculation for GaCl₃ (Gallium trichloride)

using model chemistry: PBE1PBE/aug-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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Number	Element	Mulliken
1	Ga	0.273
2	Cl	-0.091
3	Cl	-0.091
4	Cl	-0.091

<r²>	262.259
(<r²>)^1/2	16.194

All results from a given calculation for GaCl3 (Gallium trichloride)

using model chemistry: PBE1PBE/aug-cc-pVTZ

States and conformations

All results from a given calculation for GaCl₃ (Gallium trichloride)