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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/noDisp/complexes sin-hcunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-367.4443313; Eh
	9-Nov-2018	/noDisp/complexes sin-icro3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-324.2773549; Eh
	9-Nov-2018	/vacuum/complexes xeyh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-435.140605202; Eh
	9-Nov-2018	/noDisp/complexes sin-iznch3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-278.5380559; Eh
	9-Nov-2018	/noDisp/complexes sin-hoso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-316.5916465; Eh
	9-Nov-2018	/vacuum/complexes xesnme3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-138.410425920; Eh
	30-Sep-2021	/Water/TS_water ch3ph2-br-ts_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G GENECP*	-395.763049028; Eh
	9-Nov-2018	/noDisp/complexes sin-h2ofecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1120.5493793; Eh
	9-Nov-2018	/noDisp/complexes sin-fenilptf5singlete	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-850.3456813; Eh
	9-Nov-2018	/noDisp/complexes sin-fenilnbnh24	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-512.5573921; Eh

Results 5331-5340 of 12842 (Search time: 0.01 seconds).