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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-May-2024	subs1-Z	Solé Daura, Albert	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	GEN	-795.901524355; Eh
	23-Apr-2026	25-Bis-C-I1-Br3-b	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-48578.0160323; Eh
	23-Apr-2026	24-Bis-C-I3-Br3	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-48710.7963267; Eh
	23-Apr-2026	47-TpBrCF32	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	B3LYP	6-31G(D,P) GEN	-10437.1388207; Eh
	23-Apr-2026	49-TpMsCu	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-1946.98627665; Eh
	23-Apr-2026	46-TpiPr2	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P) GEN	-1410.31360167; Eh
	23-Apr-2026	45-TpMe2	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P) GEN	-938.474220590; Eh
	23-Apr-2026	58-TpiPr2Cu	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	SDD 6-31G(D,P) GEN	-1607.64244494; Eh
	23-Apr-2026	62-TpBrCF32Cu	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-10634.4322514; Eh
	23-Jul-2026	17-TS_c4A-c5A	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	AsymmetricI	6-31G GENECP*	-1952.97526888; Eh

Results 11321-11330 of 12948 (Search time: 0.009 seconds).