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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 stame4piram	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-615.001751778; Eh
	9-Nov-2018	/vacuum/complexes cocuch3_2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-350.604311275; Eh
	9-Nov-2018	/vacuum/complexes cnzrome3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-485.515001766; Eh
	9-Nov-2018	/vacuum/complexes cosnme3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-236.195368544; Eh
	9-Nov-2018	/vacuum/complexes cnptph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-555.504692253; Eh
	9-Nov-2018	/vacuum/complexes cnagnhc	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-466.109750844; Eh
	9-Nov-2018	/vacuum/complexes sticl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1837.48974089; Eh
	9-Nov-2018	/vacuum/complexes cncrh2o5triplete	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-561.841455856; Eh
	9-Nov-2018	/vacuum/complexes cocrh2o5triplete	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-581.983141660; Eh
	9-Nov-2018	/vacuum/complexes clyh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-880.365060950; Eh

Results 25381-25390 of 103529 (Search time: 0.015 seconds).