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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	8-Nov-2018	/water/complexes aq-nhcircoph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1130.2322245; Eh
	8-Nov-2018	/water/complexes aq-nhcpdhph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1040.9684231; Eh
	8-Nov-2018	/water/complexes aq-nhcniph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-740.3358612; Eh
	8-Nov-2018	/water/complexes aq-nhcmno3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-556.0225381; Eh
	8-Nov-2018	/water/complexes aq-nhcmosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1490.7626738; Eh
	8-Nov-2018	/water/complexes aq-nhcnbnh24	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-507.0432442; Eh
	8-Nov-2018	/water/complexes aq-nhcoso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-542.1888478; Eh
	8-Nov-2018	/water/complexes aq-nhck	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-254.4787265; Eh
	9-Nov-2018	/vacuum/complexes nh2ticl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1495.12821572; Eh
	8-Nov-2018	/water/complexes aq-nhcZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2574.8408481; Eh

Results 2681-2690 of 12842 (Search time: 0.004 seconds).