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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/AgCl AgCl_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-606.0414726; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSS33_Vprima TSS33_Vprima	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1099.02451641; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/KIE_110/I_Cp_star_110 I_Cp_star_110_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1462.4768865; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSS33_Vprima TSS33_Vprima_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1099.2582336; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/II_CF3_Cpstar II_CF3_Cpstar	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1540.72597331; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/1_NO2 1_NO2	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) GENECP	-680.345805757; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/III_F_Cpstar III_F_Cpstar	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1302.98124593; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/IV IV	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1512.52926001; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/II_Me_Cpstar II_Me_Cpstar_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1243.3679806; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/IV IV_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1512.8095556; Eh

Results 371-380 of 398 (Search time: 0.002 seconds).