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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Feb-2024	ts-ch3oTf-pdmincomplex_ch2cl2_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G SDD GENECP*	-2051.87775273; Eh
	26-Feb-2024	ts-ch3oTf-aupme3me_ch2cl2_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G SDD GENECP*	-1638.44728601; Eh
	16-Sep-2022	/common/SP PhI-SP	Lopez Resano, Sara	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-311++G* GENECP*	-243.1099112; Eh
	26-Dec-2022	/NLE RSR	Pérez-Soto, Raúl	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31G(D) LANL2DZ GENECP	-3612.72568777; Eh
	26-Dec-2022	/NLE Trimer_RRR	Pérez-Soto, Raúl	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31G(D) LANL2DZ GENECP	-3612.72326428; Eh
	26-Feb-2024	ch3nc5h5-oTf-ts_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-1249.88939015; Eh
	26-Dec-2022	/NLE LCu1WOTf	Pérez-Soto, Raúl	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31G(D) LANL2DZ GENECP	-2307.61968108; Eh
	26-Feb-2024	ts-ch3hcooo-ch3-rhcomplex	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G SDD GENECP*	-1518.01553590; Eh
	26-Feb-2024	ch3hcooo-h2o-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-380.665860759; Eh
	26-Feb-2024	ts-ch3hcooo-ch3-ptmincomplex	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G SDD GENECP*	-1346.07995360; Eh

Results 8341-8350 of 12919 (Search time: 0.007 seconds).