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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	/water//water complexes aq-ch3-pdph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-511.1178691; Eh
	9-Nov-2018	/water//water complexes aq-closo3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-776.3361555; Eh
	9-Nov-2018	/water//water complexes aq-cnk	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-121.2473166; Eh
	9-Nov-2018	/water//water complexes aq-clircoph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1364.3728751; Eh
	9-Nov-2018	/water//water complexes aq-clniph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-974.4865197; Eh
	9-Nov-2018	/vacuum/complexes imidazolpdhph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1040.91233562; Eh
	9-Nov-2018	/water//water complexes aq-cnpdhph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-907.7314643; Eh
	9-Nov-2018	/water//water complexes aq-ch3-oso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-356.0662619; Eh
	9-Nov-2018	/vacuum/complexes imidazoloso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-541.840506547; Eh
	9-Nov-2018	/water//water complexes aq-cnalcl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g*	-1716.2931933; Eh

Results 11411-11420 of 12354 (Search time: 0.008 seconds).