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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 fenilno2ircoph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1340.28379949; Eh
	9-Nov-2018	/noDisp/complexes sin-nhcrush4	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1916.4124448; Eh
	9-Nov-2018	/noDisp/complexes sin-nhcmosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1490.6589264; Eh
	9-Nov-2018	/noDisp/complexes sin-ohcunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-442.6987931; Eh
	9-Nov-2018	/noDisp/complexes sin-nhcznch3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-493.0684959; Eh
	9-Nov-2018	/noDisp/complexes sin-ohptf5singlete	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-694.4954429; Eh
	9-Nov-2018	/vacuum/complexes fenilno2k	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-464.466271016; Eh
	9-Nov-2018	/noDisp/complexes sin-nh3ZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2405.0924133; Eh
	9-Nov-2018	/noDisp/complexes sin-nh3cunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-423.0870997; Eh
	9-Nov-2018	/noDisp/complexes sin-nh3pdhph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-871.2192452; Eh

Results 22121-22130 of 103529 (Search time: 0.013 seconds).