CCCBDB Elelctron affinities page 2

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composite	G2	0.759
	G3B3	0.853
	G4	0.862
	CBS-Q	0.813

		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	aug-cc-pVDZ	aug-cc-pVTZ	daug-cc-pVTZ
hartree fock	HF	-10.092	0.615	0.484	0.643	0.551	0.551	0.719	0.666	0.666	0.545		0.652		0.658	0.737	0.723	0.723
density functional	LSDA	-8.707	8.329	1.026	1.202	1.116	1.116	1.284	1.216	1.216	1.096			1.165	1.208	1.290
	BLYP	-9.136	0.659	0.540	0.683	0.617	0.617	0.834	0.730	0.730	0.602				0.732
	B1B95	-8.868		0.483	0.591	0.602	0.500				0.492			0.600	0.691	0.788
	B3LYP	-9.049		0.675	0.833	0.755	0.755	0.943	0.862	0.862	0.739		0.884	0.806	0.859	0.955	0.935
	B3LYPultrafine																0.935
	B3PW91	-9.131	0.838	0.699	0.848	0.757	0.757	0.913	0.856	0.856	0.735				0.846
	mPW1PW91	-9.198	0.838	0.697	0.837	0.743	0.743	0.905	0.843	0.843	0.723				0.834
	M06-2X			0.480		0.602
	PBEPBE	-9.200	0.823	0.691	0.816	0.736	0.736	0.925	0.838	0.838	0.713				0.836
	PBE1PBE					0.745
	HSEh1PBE		0.829			0.739		0.907							0.834
	TPSSh					0.677		0.820			0.646				0.751
	wB97X-D			0.523		0.590		0.773		0.701			0.698	0.773	0.703		0.768
	B97D3		0.583			0.435		0.640		0.531		0.616	0.535		0.543		0.639
		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	aug-cc-pVDZ	aug-cc-pVTZ	daug-cc-pVTZ
Moller Plesset perturbation	MP2	-10.157	0.578	0.490	0.613	0.565	0.565	0.744	0.653	0.653	0.573		0.664	0.617		0.776
	MP2=FULL	-10.153	0.580	0.493	0.614	0.569	0.569	0.747	0.663	0.663	0.582
	MP3					0.568
	MP3=FULL					0.574		0.751
	MP4		0.579			0.565				0.655
	B2PLYP					0.621									0.728
Configuration interaction	CID		0.593			0.567
Configuration interaction	CISD		0.588			0.567
		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	aug-cc-pVDZ	aug-cc-pVTZ	daug-cc-pVTZ
Quadratic configuration interaction	QCISD		0.586		0.620	0.570	0.570	0.749	0.661	0.661	0.582			0.623	0.686
Quadratic configuration interaction	QCISD(T)					0.568
Coupled Cluster	CCD		0.592		0.626	0.570	0.570	0.748	0.660	0.660	0.580			0.623	0.683
	CCSD					0.571
	CCSD(T)													0.622	0.687	0.788	0.772
		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	aug-cc-pVDZ	aug-cc-pVTZ	daug-cc-pVTZ

		CEP-31G	CEP-31G*	CEP-121G	CEP-121G*	LANL2DZ	SDD	cc-pVTZ-PP	aug-cc-pVTZ-PP	Def2TZVPP
hartree fock	HF	0.809		0.862		0.634	0.169			0.645
density functional	B3LYP	0.901		0.955		0.734	0.499			0.854
density functional	PBEPBE									0.832
Moller Plesset perturbation	MP2	0.789		0.847		0.592	0.143			0.675

	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 NaBr (Sodium Bromide)