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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/metal_frag sin-znch3b3lyp	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-266.7493911; Eh
	9-Nov-2018	/noDisp/complexes sin-sime3rhh2o5_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-901.4558221; Eh
	9-Nov-2018	/vacuum/complexes h2swco5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1033.30820331; Eh
	9-Nov-2018	/vacuum/complexes h2sznch3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-666.200598147; Eh
	9-Nov-2018	/noDisp/complexes sin-xealcl3_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1638.7637139; Eh
	9-Nov-2018	/noDisp/complexes sin-xewco5_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-649.4191548; Eh
	9-Nov-2018	/noDisp/complexes sin-xehgi2_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	sdd	-191.9879769; Eh
	26-Aug-2024	geom7_w7_LLT	García-Padilla, Eduardo	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(D)	-535.0307263; Eh
	9-Nov-2018	/noDisp/metal_frag sin-ircoph32b3lyp	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-903.8292362; Eh
	9-Nov-2018	/noDisp/metal_frag sin-ptf5b3lypIV	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-618.67585; Eh

Results 14731-14740 of 104583 (Search time: 0.011 seconds).