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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 sime3nbnh24	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-690.193183668; Eh
	9-Nov-2018	/vacuum/complexes sime3pdph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-880.426726754; Eh
	9-Nov-2018	/vacuum/complexes sime3wco5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1043.28629871; Eh
	9-Nov-2018	/vacuum/complexes smecunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-805.004035969; Eh
	9-Nov-2018	/vacuum/complexes smeconh35	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-866.346398468; Eh
	9-Nov-2018	/vacuum/complexes smemosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1702.80533811; Eh
	9-Nov-2018	/vacuum/complexes smealcl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g*	-2061.49258352; Eh
	9-Nov-2018	/vacuum/complexes sime3ircoph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1313.39468563; Eh
	9-Nov-2018	/vacuum/complexes pme3tame4piram	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-677.564826711; Eh
	9-Nov-2018	/vacuum/complexes sih3-cunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-658.176195022; Eh

Results 24041-24050 of 106051 (Search time: 0.018 seconds).