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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/adducts_DCM/add_ch3sch2ch3 ch3sch2ch3-i_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G GENECP*	-528.965096862; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3f ch3f-sch2ch3_6311+Gdsp	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G(D)	-617.377263675; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3f ch3f-nh2_6311+Gdsp	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G(D)	-195.823555827; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-c6h5_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1166.61767904; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-nch33_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1109.39725949; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-c6h5_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1166.61781897; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-cf3_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1272.69496361; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-nh2_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-990.895428997; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3oTs-nhcho_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1104.32300529; Eh
	30-Sep-2021	/DCM/adducts_DCM/add_ch3oTs ch3Ts-cl_6311+Gd_ch2cl2	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-1395.26905281; Eh

Results 9811-9820 of 12842 (Search time: 0.008 seconds).