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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-nh3fecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1561.3749088; Eh
	9-Nov-2018	/noDisp/complexes sin-ofecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1579.7437311; Eh
	9-Nov-2018	/noDisp/complexes sin-nchfecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1598.224315; Eh
	8-Nov-2018	/vacuum/complexes bpinfecl3bai	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1758.76798523; Eh
	9-Nov-2018	/water//water complexes aq-h2ofecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1120.6891452; Eh
	9-Nov-2018	/water//water complexes aq-h2ofecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1581.3295279; Eh
	9-Nov-2018	/water//water complexes aq-h2ocunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-443.2566553; Eh
	9-Nov-2018	/water//water complexes aq-h2fecl2sextup	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1045.394891; Eh
	9-Nov-2018	/water//water complexes aq-h2fecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1506.0640119; Eh
	9-Nov-2018	/water//water complexes aq-h2cunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-367.9742575; Eh

Results 71-80 of 371 (Search time: 0.001 seconds).