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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-Mar-2021	/SILVER 33pin-Ag	Maza Quiroga, Ricardo José	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-2820.0362567; Eh
	10-Mar-2021	/SILVER 1apin-Ag	Maza Quiroga, Ricardo José	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-1998.8175489; Eh
	20-Nov-2020	O2	Besora, Maria	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G(D,P) GENECP	-150.316691773; Eh
	21-Oct-2020	TS2-3a	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GENECP	-
	21-Oct-2020	TS3a	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GENECP	-
	20-Nov-2020	GD3bjFe4O_7_20	Besora, Maria	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	LANL2DZ 6-31G(D,P) GENECP	-7000.47775661; Eh
	10-Mar-2021	/PALLADIUM 33pin-Pd	Maza Quiroga, Ricardo José	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-2816.01592941; Eh
	10-Mar-2021	/SILVER/TS 2a2pin-Ag-TS	Maza Quiroga, Ricardo José	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-2523.87545251; Eh
	10-Mar-2021	/SILVER/TS 1apin-Ag-TS	Maza Quiroga, Ricardo José	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-2113.27363144; Eh
	10-Mar-2021	/LITHIUM 2cpindan-Li	Maza Quiroga, Ricardo José	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	6-31G(D,P)	-1208.6144886; Eh

Results 481-490 of 2546 (Search time: 0.0 seconds).