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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/vacuum/complexes heincl2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-924.965883654; Eh
	9-Nov-2018	/vacuum/complexes hecucn	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-293.099913289; Eh
	9-Nov-2018	/vacuum/complexes ocro3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-387.933165282; Eh
	9-Nov-2018	/vacuum/complexes piridinanipf33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2342.32151886; Eh
	9-Nov-2018	/vacuum/complexes piridinafecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1753.12101109; Eh
	9-Nov-2018	/vacuum/complexes ph3cuch3_2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-580.426429807; Eh
	9-Nov-2018	/vacuum/complexes scnfecl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1995.85290586; Eh
	9-Nov-2018	/vacuum/complexes scnaucl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2007.59888975; Eh
	9-Nov-2018	/vacuum/complexes ph3zncl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1951.15229020; Eh
	9-Nov-2018	/vacuum/complexes scngacl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1874.00893425; Eh

Results 23801-23810 of 103928 (Search time: 0.012 seconds).