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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/vacuum/complexes salcl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g*	-2021.50717865; Eh
	9-Nov-2018	/noDisp/complexes sin-nhccunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-592.7661091; Eh
	9-Nov-2018	/noDisp/complexes sin-nhcticl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1665.1213975; Eh
	9-Nov-2018	/vacuum/complexes piridinaauph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-727.069273105; Eh
	9-Nov-2018	/noDisp/complexes sin-ohpdph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-546.9667951; Eh
	9-Nov-2018	/vacuum/complexes piridinaconh35	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-676.081657316; Eh
	9-Nov-2018	/noDisp/complexes sin-ohcro3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-388.650568; Eh
	9-Nov-2018	/vacuum/complexes piridinaalcl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g*	-1871.59310753; Eh
	9-Nov-2018	/vacuum/complexes fenilno2mosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1700.82577190; Eh
	9-Nov-2018	/noDisp/complexes sin-ohfecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1120.2493951; Eh

Results 4301-4310 of 12842 (Search time: 0.005 seconds).