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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Sep-2022	/pNMe2_Bpin/pMe_PhI Cu_Phen_pNMe2Ph_pMePhI	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1417.08469528; Eh
	23-Sep-2022	/pNO2Ph_Bpin/pNMe2_PhI/large_basis_sets OATS	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-311+G* GEN*	-1867.01522828; Eh
	23-Sep-2022	/pOMePh_Bpin/PhI Cu_Phen_F_pOMePhBpin	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1469.15838159; Eh
	23-Sep-2022	/pNMe2_Bpin/pOMe_PhI/large_basis_sets OATS	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1776.9946089; Eh
	23-Sep-2022	/pOMePh_Bpin/PhI Cu_Phen_pOMePh_PhI	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1358.31388571; Eh
	23-Sep-2022	/pOMePh_Bpin/PhI Cu_Phen_pOMePh	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1115.22083881; Eh
	23-Sep-2022	/pNO2Ph_Bpin/PhI/large_basis_sets Cu_Phen_F_pNO2PhBpin	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1559.5385564; Eh
	23-Sep-2022	/pNO2Ph_Bpin/pNMe2_PhI Cu_Phen_pNO2PhpNMe2Ph_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1582.38742257; Eh
	23-Sep-2022	/pNMe2_Bpin/pOMe_PhI Cu_Phen_pNMe2Ph-pOMePh_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1492.40471610; Eh
	23-Sep-2022	/pNMe2_Bpin/pOMe_PhI Cu_Phen_pNMe2Ph_pOMePhI	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1492.29109897; Eh

Results 24531-24540 of 100263 (Search time: 0.015 seconds).