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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/S31 S31	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1609.87479717; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/III_CF3_Cpstar III_CF3_Cpstar_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1541.0977001; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S31 S31_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1610.19769; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/3a 3a	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) GENECP	-1196.50698265; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/3a 3a_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1196.7414513; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/II_OMe_Cpstar II_OMe_Cpstar	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1318.27268236; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/2f 2f	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-320.863424213; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S26 S26_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1885.3508277; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/2f 2f_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-320.9339183; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S18 S18	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	GENECP	-

Results 381-390 of 398 (Search time: 0.002 seconds).