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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Sep-2022	/pCF3_Bpin/pNMe2_PhI Cu_Phen_pCF3PhpNMe2Ph_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1714.91954190; Eh
	23-Sep-2022	/pCF3_Bpin/PhI/large_basis_sets Cu_Phen_pCF3Ph_PhI	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1865.613456; Eh
	23-Sep-2022	/pCF3_Bpin/pNMe2_PhI/large_basis_sets pCF3Ph-pNMe2Ph	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-934.6221922; Eh
	23-Sep-2022	/pCF3_Bpin/PhI/large_basis_sets Cu_Phen_pCF3Ph	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1338.0717273; Eh
	23-Sep-2022	/pCF3_Bpin/pNMe2_PhI/large_basis_sets OATS	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1999.5949851; Eh
	23-Sep-2022	/mmMePh_Bpin mmMe-Bpin	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-564.326817595; Eh
	23-Sep-2022	/mmMePh_Bpin mmMePh-Ph	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-541.964274124; 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
	23-Sep-2022	/C6F5_Bpin/mMe_PhI/large_basis_sets Cu_Phen_C6F5mMePh_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-2064.196076; Eh
	23-Sep-2022	/pCF3_Bpin/PhI/large_basis_sets Cu_Phen_pCF3PhPh_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1865.7151679; Eh

Results 24741-24750 of 100175 (Search time: 0.017 seconds).