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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/noDisp/complexes sin-heaucl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1519.2706162; Eh
	9-Nov-2018	/noDisp/complexes sin-heincl2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-924.9647144; Eh
	9-Nov-2018	/noDisp/complexes sin-iaucl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1527.9918302; Eh
	9-Nov-2018	/noDisp/complexes sin-hehgi2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-179.3706003; Eh
	9-Nov-2018	/noDisp/complexes sin-hincl2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-922.9770654; Eh
	9-Nov-2018	/noDisp/complexes sin-hhgi2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-177.1406033; Eh
	9-Nov-2018	/noDisp/complexes sin-heZrCl5_newfix3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2351.4116654; Eh
	9-Nov-2018	/noDisp/complexes sin-heZrCl5_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2351.396824; Eh
	9-Nov-2018	/noDisp/complexes sin-ihgi2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	sdd	-188.0374488; Eh
	30-Sep-2021	/Water/TS_water ch3seh-seh-ts_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-4844.33672298; Eh

Results 21281-21290 of 103542 (Search time: 0.012 seconds).