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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Jul-2026	/Auₓ-chiral_inducers_complexes/Au-cystine/Au-cystine_S-Au conf6b-Au-cysteine_S-Au	Morales-Vidal, Jordi	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	b3lyp	GEN	-1578.58945838; Eh
	23-Jul-2026	13-TS_c2A-c3A	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-1952.95504907; Eh
	23-Jul-2026	07-TS_c7A-c8A	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-1668.71551926; 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	12-c2A	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricI	6-31G GENECP*	-1952.98157738; Eh
	23-Jul-2026	06-c7A	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricI	6-31G GENECP*	-1668.75097403; Eh
	23-Jul-2026	09-c0	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricIEFPCM	6-31G GENECP*	-1296.10639667; Eh
	23-Jul-2026	08-c8a	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	AsymmetricIEFPCM	6-31G GENECP*	-1668.76741502; Eh
	23-Jul-2026	10-prod-4	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricIEFPCM	6-31G GEN*	-952.421634218; Eh
	23-Jul-2026	04-TS_c0-c1	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	-	6-31G GENECP*	-1296.09601693; Eh

Results 103721-103730 of 104079 (Search time: 0.064 seconds).