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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 bpinrhh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-746.223229572; Eh
	9-Nov-2018	/vacuum/complexes chch2ZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-2426.44986546; Eh
	9-Nov-2018	/noDisp/complexes sin-ncsmno3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-820.9918373; Eh
	9-Nov-2018	/vacuum/complexes fenilclpdph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1162.39645946; Eh
	9-Nov-2018	/vacuum/complexes cchrhh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-568.896718258; Eh
	9-Nov-2018	/vacuum/complexes chch2rhh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-570.157933437; Eh
	9-Nov-2018	/vacuum/complexes fenilclfeco4axial	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1268.64475167; Eh
	9-Nov-2018	/vacuum/complexes fenilclrush4	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2381.52189440; Eh
	9-Nov-2018	/vacuum/complexes chch2oso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-394.039489838; Eh
	9-Nov-2018	/vacuum/complexes chch2fecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	UB3LYP	6-31+g; sdd*	-1122.38309951; Eh

Results 11701-11710 of 12354 (Search time: 0.008 seconds).