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	hartrees
Energy at 0K	-528.688247
Energy at 298.15K	-528.688107
HF Energy	-528.688247
Nuclear repulsion energy	5.751590

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	4493	4323	0.06
2	Σ	69	67	0.05
3	Π	71	68	0.00
3	Π	71	68	0.00

Atom	x (Å)	y (Å)	z (Å)
Ar1	0.000	0.000	0.382
H2	0.000	0.000	-3.068
H3	0.000	0.000	-3.807

	Ar1	H2	H3
Ar1		3.4499	4.1885
H2	3.4499		0.7386
H3	4.1885	0.7386

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Ar1	H2	H3	180.000		Ar1	H3	H2	0.000
H2	Ar1	H3	0.000

All results from a given calculation for H₂Ar (H2 Ar dimer)

using model chemistry: TPSSh/6-31G

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	Ar	0.001
2	H	-0.000
3	H	-0.001

	x	y	z	Total
	0.000	0.000	0.023	0.023
CHELPG
AIM
ESP

<r²>	34.875
(<r²>)^1/2	5.906

All results from a given calculation for H2Ar (H2 Ar dimer)

using model chemistry: TPSSh/6-31G

States and conformations

All results from a given calculation for H₂Ar (H2 Ar dimer)