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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Apr-2026	57-TpMe2Cu-MAC	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-1387.73130425; Eh
	23-Apr-2026	60-TpiPr2Cu-MAC	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	SDD 6-31G(D,P) GEN	-1859.57427477; Eh
	23-Apr-2026	56-TpMe2Cu-NCMe	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-1268.59481805; Eh
	23-Jul-2026	11-TS_c1-c2A	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricI	6-31G GENECP*	-1700.05655318; Eh
	23-Jul-2026	01-CsHCO3-mes	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricIEFPCM	6-31G GENECP*	-284.199362150; Eh
	23-Jul-2026	02-CsI	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Minimum	AsymmetricIEFPCM	GENECP	-31.3047077215; Eh
	23-Jul-2026	04-TS_c0-c1	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	-	6-31G GENECP*	-1296.09601693; Eh
	23-Jul-2026	29-TS_c3N-c4N-ortho	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-1649.40384148; Eh
	23-Jul-2026	36-PhMeO	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricIEFPCM	6-31G GEN*	-384.616318520; Eh
	23-Jul-2026	30-TS_c3N-c4N-para	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	-	6-31G GENECP*	-1649.40157271; Eh

Results 11441-11450 of 12948 (Search time: 0.01 seconds).