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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-Sep-2021	/DCM/TS_DCM ch3seh-f-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-2542.05428733; Eh
	30-Sep-2021	/DCM/TS_DCM ch3cf3-seh-ts_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-2779.87889419; Eh
	30-Sep-2021	/DCM/TS_DCM ch3cn-seh-ts_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-2535.01864616; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-br_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G GENECP*	-948.211835295; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-i_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G GENECP*	-946.439408109; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-sch2ch3_6311+Gd_ch2cl2_1	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1412.45166721; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-och2ch3_6311+Gd_ch2cl2_1	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1089.44044753; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-sch3_6311+Gd_ch2cl2-1	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1373.12397466; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-och3_6311+Gd_ch2cl2-1	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1050.11198880; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-Ts_6311+Gd-1_ch2cl2-1	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1829.98534776; Eh

Results 9941-9950 of 12842 (Search time: 0.008 seconds).