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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/VI_prima VI_prima	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1473.32548338; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/VI VI	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1886.79322670; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/II_NO2_Cpstar II_NO2_Cpstar_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1408.5367725; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/VI_prima VI_prima_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1473.6270403; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/VI VI_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1887.1400507; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S34 S34_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1314.6061746; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S3 S3_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1007.413957; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/VI/NBO VI_NBO	García, Cristina	-	Single point Structure	-	-	-
	21-Jun-2019	/B2O4(C2H4)2 Cat	Mateo, Anna	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	LanL2DZ; 6-311G**	-631.524752920; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/KIE_110/2_110 2_110	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-734.344017649; Eh

Results 34801-34810 of 103542 (Search time: 0.021 seconds).