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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/AgOAc AgOAc_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-374.2797006; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S10 S10_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1688.8158234; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/S11 S11_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-984.1721373; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSVI_VII TSVI_VII	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-1886.78329591; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSVI_VII/NBO TSVI_VII_NBO	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1886.7832959; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSVIprima_S34 TSVIprima_S34_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1473.6166707; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSS12_S13 TSS12-S13_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-984.1092907; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSS12_S13 TSS12-S13	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-983.875003644; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/AgCl AgCl	García, Cristina	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) LANL2DZ GENECP	-606.003493478; Eh
	23-Mar-2020	/Paper/Outputs_Inputs_CGET/TSVI_VII TSVI_VII_spbs	García, Cristina	Gaussian; 09	Single point Structure	RwB97XD	GENECP	-1887.1306866; Eh

Results 361-370 of 398 (Search time: 0.001 seconds).