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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-ch3-fecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1084.3338208; Eh
	9-Nov-2018	/water//water complexes aq-ch3-rhh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-532.3624775; Eh
	9-Nov-2018	/water//water complexes aq-ch3-conh35	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-468.4217424; Eh
	9-Nov-2018	/water//water complexes aq-ch3-cunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-406.8700685; Eh
	9-Nov-2018	/water//water complexes aq-ch3-fecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1544.9062935; Eh
	9-Nov-2018	/water//water complexes aq-ch3-cro3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-352.8085911; Eh
	9-Nov-2018	/water//water complexes aq-ch3-k	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-68.231539; Eh
	9-Nov-2018	/water//water complexes aq-brZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2362.1805313; Eh
	9-Nov-2018	/water//water complexes aq-ch3-auph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-518.8749408; Eh
	9-Nov-2018	/vacuum/complexes imidazolmosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1490.68787894; Eh

Results 14281-14290 of 104583 (Search time: 0.01 seconds).