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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	7-Jul-2020	I4s	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31G SDD GENECP*	-10019.8991070; Eh
	30-May-2021	/benchmarking/M06_6_311+Gdp TS_Nidppf2_BrR_HA_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-10908.6708758; Eh
	30-May-2021	/benchmarking/M06_6_311+Gdp TS_Nidppf2_BrR_HA_trip	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-10908.6524716; Eh
	30-Sep-2021	/Water/adducts_water/add_ch3oTs ch3oTs-sch2ch3_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1412.45282216; Eh
	30-Sep-2021	/Water/adducts_water/add_ch3oTs ch3oTs-sch3_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1373.12680337; Eh
	30-May-2021	/benchmarking/B3LYP_D3BJ_6_311+Gdp dppf	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G(D,P) GENECP	-3259.4997062; Eh
	30-May-2021	/benchmarking/BP86_D3_6_311+Gdp COD	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RBP86	6-311+G(D,P) GENECP	-312.1269391; Eh
	30-May-2021	/benchmarking/BP86_D3_6_311+Gdp NiCODdppf	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RBP86	6-311+G(D,P) GENECP	-5080.4366606; Eh
	30-May-2021	/benchmarking/BP86_D3_6_311+Gdp Nidppf2	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RBP86	6-311+G(D,P) GENECP	-8027.992979; Eh
	30-May-2021	/benchmarking/BP86_D3_6_311+Gdp dppf	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RBP86	6-311+G(D,P) GENECP	-3259.6427815; Eh

Results 4021-4030 of 12842 (Search time: 0.005 seconds).