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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/water//water complexes aq-cowco5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-747.2715137; Eh
	9-Nov-2018	/vacuum/complexes imidazolwco5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-860.170519118; Eh
	9-Nov-2018	/water//water complexes aq-fenilk	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-259.986326; Eh
	9-Nov-2018	/water//water complexes aq-cooso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-429.1230758; Eh
	9-Nov-2018	/water//water complexes aq-fenilircoph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1135.7769481; Eh
	9-Nov-2018	/water//water complexes aq-fenilfecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1276.0802614; Eh
	9-Nov-2018	/water//water complexes aq-fenilnbnh24	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-512.5875525; Eh
	9-Nov-2018	/water//water complexes aq-conbnh24	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-394.1188248; Eh
	9-Nov-2018	/water//water complexes aq-fcunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-466.8584008; Eh
	9-Nov-2018	/water//water complexes aq-coZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2461.9124119; Eh

Results 14131-14140 of 104583 (Search time: 0.01 seconds).