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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 ch3cf3-och2ch3-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-532.188274618; Eh
	30-Sep-2021	/DCM/TS_DCM ch3sch3-och2ch3-ts_6311+Gd_ch2lc2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-632.606666462; Eh
	30-Sep-2021	/DCM/TS_DCM ch3i-och2ch3-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G GENECP*	-205.886842697; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-sch3-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-820.691249039; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-sh-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-781.374496321; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-sch2ch3-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-860.018649045; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-br-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G GENECP*	-395.761014924; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-oTs-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-1277.51306906; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-ooh-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-533.536826920; Eh
	30-Sep-2021	/DCM/TS_DCM ch3ph2-oh-ts_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G(D)	-458.371190752; Eh

Results 7861-7870 of 15308 (Search time: 0.042 seconds).