CCCBDB Elelctron affinities page 2

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composite	G2	1.236
	G3	1.218
	G3B3	1.139
	G4	1.197
	CBS-Q	1.240

		STO-3G	3-21G	3-21G*	6-31G	6-31G*	6-31G**	6-31+G**	6-311G*	6-311G**	6-31G(2df,p)	6-311+G(3df,2p)	TZVP	cc-pVDZ	cc-pVTZ	cc-pVQZ	aug-cc-pVDZ	aug-cc-pVTZ	aug-cc-pVQZ	daug-cc-pVTZ
hartree fock	HF	-5.063	0.774	-0.099	1.219	-0.084	-0.084	0.322	0.144	0.144	-0.337		0.137	-0.170	-0.149	-0.038	0.354	0.155	0.114	0.154
density functional	LSDA	-5.132	4.037	0.471	1.473	0.956	0.956	1.746	1.315	1.315	0.904			0.827	1.283		1.798	1.735
	BLYP	-5.698	0.141	-0.189	0.791	0.278	0.278	1.137	0.669	0.669	0.210			0.134	0.588
	B1B95	-5.207		0.064	1.074	0.415	0.415	1.062	0.694	0.694	0.329			0.314	0.610	0.701	1.111	1.011	0.918
	B3LYP	-5.233	0.557	0.147	1.164	0.546	0.546	1.278	0.880	0.880	0.454		1.004	0.420	0.786	0.959	1.322	1.228	1.204
	B3LYPultrafine					0.547												1.229
	B3PW91	-5.159	0.645	0.221	1.203	0.569	0.569	1.202	0.843	0.843	0.472			0.471	0.765
	mPW1PW91	-5.129	0.669	0.220	1.215	0.551	0.551	1.174	0.818	0.818	0.446			0.454	0.727
	M06-2X			0.248		0.607						1.128
	PBEPBE	-5.591	0.301	-0.045	0.915	0.383	0.383	1.159	0.719	0.719	0.314			0.262	0.643
	PBE1PBE					0.512
	HSEh1PBE		0.618			0.512		1.153							0.696
	TPSSh					0.505		1.147			0.408				0.702
	wB97X-D			0.248		0.583		1.216		0.842			0.968	0.781	0.760			1.142
	B97D3		0.286			0.344		1.093		0.667		0.993	0.804		0.599			1.059		1.086
		STO-3G	3-21G	3-21G*	6-31G	6-31G*	6-31G**	6-31+G**	6-311G*	6-311G**	6-31G(2df,p)	6-311+G(3df,2p)	TZVP	cc-pVDZ	cc-pVTZ	cc-pVQZ	aug-cc-pVDZ	aug-cc-pVTZ	aug-cc-pVQZ	daug-cc-pVTZ
Moller Plesset perturbation	MP2	-6.687	-0.444	-0.820	-0.019	-0.333	-0.333	0.446	-0.084	-0.084	0.021		0.168	-0.384	0.346	0.694	0.768	0.915	0.983
	MP2=FULL		-0.445	-0.822	-0.020	-0.334	-0.334	0.445	-0.081	-0.081	0.018			-0.384	0.343	0.697			0.984
	MP3					-0.080
	MP3=FULL					-0.086		0.592
	MP4		-0.277			-0.207				0.025					0.409
	B2PLYP					0.250									0.590
	B2PLYP=FULLultrafine					0.249								0.148	0.588
Configuration interaction	CID		0.071	-0.442	0.573	-0.106			0.127
Configuration interaction	CISD		0.084	-0.411	0.646	-0.077			0.150
		STO-3G	3-21G	3-21G*	6-31G	6-31G*	6-31G**	6-31+G**	6-311G*	6-311G**	6-31G(2df,p)	6-311+G(3df,2p)	TZVP	cc-pVDZ	cc-pVTZ	cc-pVQZ	aug-cc-pVDZ	aug-cc-pVTZ	aug-cc-pVQZ	daug-cc-pVTZ
Quadratic configuration interaction	QCISD		0.047	-0.359	0.715	0.053	0.053	0.725	0.292	0.292	0.258			0.000	0.529
Quadratic configuration interaction	QCISD(T)					-0.010								-0.082	0.509		1.016	1.059
Coupled Cluster	CCD		-0.021	-0.493	0.486	-0.091	-0.091	0.593	0.155	0.155	0.202			-0.133	0.495		0.901	0.987
	CCSD					0.046
	CCSD(T)													-0.076	0.515		1.016	1.060
		STO-3G	3-21G	3-21G*	6-31G	6-31G*	6-31G**	6-31+G**	6-311G*	6-311G**	6-31G(2df,p)	6-311+G(3df,2p)	TZVP	cc-pVDZ	cc-pVTZ	cc-pVQZ	aug-cc-pVDZ	aug-cc-pVTZ	aug-cc-pVQZ	daug-cc-pVTZ

		CEP-31G	CEP-31G*	CEP-121G	CEP-121G*	LANL2DZ	SDD	cc-pVTZ-PP	aug-cc-pVTZ-PP	Def2TZVPP
hartree fock	HF	1.347	0.102	1.345	0.111	1.120	0.996			-0.138
density functional	B3LYP	1.480	0.872	1.485	0.892	1.246	1.137			0.851
density functional	PBEPBE									0.719
Moller Plesset perturbation	MP2	0.254	0.072	0.276	0.132	0.009	-0.093			0.473

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Calculated Electron Affininty for SO (Sulfur monoxide)