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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-Sep-2021	/Water/adducts_water/add_ch3cl ch3cl-cl_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-960.559625821; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3nch33_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-214.312576730; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3och2ch3_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-194.405019910; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3nh2_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-95.8921626875; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3oh_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-115.764318299; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3sch2ch3_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-517.387909229; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3sch3_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-478.062354602; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3och3_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-155.075557896; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3nhcho_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-209.282527408; Eh
	30-Sep-2021	/Water/ch3-EG_LG_water ch3ph2_6311+Gd	Morán, Lucía	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-311+G(D)	-382.492539116; Eh

Results 3501-3510 of 12842 (Search time: 0.005 seconds).