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	hartrees
Energy at 0K	-528.717731
Energy at 298.15K
HF Energy	-528.717731
Nuclear repulsion energy	5.740873

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	4441	4319	0.33
2	Σ	91	88	0.07
3	Π	751i	731i	0.08
3	Π	751i	731i	0.08

Atom	x (Å)	y (Å)	z (Å)
Ar1	0.000	0.000	0.382
H2	0.000	0.000	-3.056
H3	0.000	0.000	-3.813

	Ar1	H2	H3
Ar1		3.4381	4.1946
H2	3.4381		0.7564
H3	4.1946	0.7564

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/cc-pVDZ

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	0.003
2	H	-0.002
3	H	-0.001

	x	y	z	Total
	0.000	0.000	0.043	0.043
CHELPG
AIM
ESP

<r²>	34.813
(<r²>)^1/2	5.900

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

using model chemistry: TPSSh/cc-pVDZ

States and conformations

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