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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-cofecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1157.4075745; Eh
	9-Nov-2018	/noDisp/complexes sin-cotame4piram	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-329.6986095; Eh
	9-Nov-2018	/noDisp/complexes sin-corhh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-604.8781155; Eh
	9-Nov-2018	/noDisp/complexes sin-comosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1377.7155427; Eh
	9-Nov-2018	/noDisp/complexes sin-cnznch3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-359.9108083; Eh
	9-Nov-2018	/noDisp/complexes sin-coznch3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-380.1009044; Eh
	9-Nov-2018	/noDisp/complexes sin-cnticl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1531.9675692; Eh
	9-Nov-2018	/noDisp/complexes sin-cocro3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-426.0122072; Eh
	9-Nov-2018	/noDisp/complexes sin-cooso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-428.7258179; Eh
	12-Feb-2019	sa-CuRh-0011	García Muelas, Rodrigo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-181.51395888; eV

Results 23651-23660 of 103928 (Search time: 0.012 seconds).