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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Aug-2024	obn_rad_MeButa	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	6-31G(D)	-385.438273659; Eh
	28-Aug-2024	SP_obn_an_m1	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-311+G(D,P)	-501.5071087; Eh
	28-Aug-2024	SP_fl_cat_PMMA	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-311+G(D,P)	-771.193868; Eh
	28-Aug-2024	UVrefdiarcn_rad_cam	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UCAM-B3LYP; TD-FC	6-311+G(D,P)	-823.0897583; Eh
	28-Aug-2024	SP_ar2dmnomeobn_MeButa	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-311+G(D,P)	-1136.3447494; Eh
	28-Aug-2024	SP_ar2dmn2_cat_PMMA	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-311+G(D,P)	-770.0098743; Eh
	28-Aug-2024	ar2dmnome_cat_MeButa	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31G(D)	-750.366029075; Eh
	28-Aug-2024	ar2dmn2_rad_MeButa	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	6-31G(D)	-769.955572220; Eh
	28-Aug-2024	ar2dmnomemln_PMMA	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31G(D)	-1014.24987001; Eh
	28-Aug-2024	SP_ar2dmn2mln	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-311+G(D,P)	-1033.9737334; Eh

Results 91211-91220 of 91738 (Search time: 0.041 seconds).