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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Jul-2026	33-TS_c3N-c4N-para-mesitylene	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	-	6-31G GENECP*	-1999.32328820; 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	40-Mes-Cs2CO3-PhOMe-HO13-TS-f	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-1387.95035908; Eh
	23-Jul-2026	46-TS_c3N-c4N-5D	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-1649.40274983; Eh
	23-Jul-2026	39-Mes-CsOCPhCH2	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricIEFPCM	6-31G GENECP*	-753.806554160; Eh
	23-Jul-2026	44-Mes-CsOCPhCD2	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-753.806554160; Eh
	23-Jul-2026	38-Mes-CSHCO3	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricIEFPCM	6-31G GENECP*	-634.121511199; Eh
	23-Jul-2026	43-Mes-CSHCO3-D	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-634.121511198; Eh
	23-Jul-2026	41-PhMeO-f-CD3	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Minimum	AsymmetricIEFPCM; m06	6-31G GEN*	-384.616318520; Eh
	23-Jul-2026	38-c9N	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	AsymmetricI	6-31G GENECP*	-1649.41220442; Eh

Results 103791-103800 of 103806 (Search time: 0.064 seconds).