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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Apr-2026	13-Bis-C-I1-Ms	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-26620.7199403; Eh
	23-Apr-2026	12-TpBr3MAC	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-24288.9866004; Eh
	23-Apr-2026	31-TpBrCF3_2CuNCMe	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-10767.2382075; Eh
	23-Apr-2026	34-IPr-TS_1-2	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization TS	B3LYP	SDD 6-31G(D,P) GEN	-11927.4447790; Eh
	23-Apr-2026	33-IPr-I1	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	B3LYP	SDD 6-31G(D,P) GEN	-11927.4516703; Eh
	23-Apr-2026	32-IPr	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P) GEN	-1160.17522623; Eh
	23-Apr-2026	01-TpMsCuMAC	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-2198.93422764; Eh
	23-Apr-2026	42-CuMAC	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	SDD 6-31G(D,P) GEN	-449.155000602; Eh
	23-Apr-2026	48-CuMAC2	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-701.099027858; Eh
	23-Apr-2026	55-TpMe2Cu	Sciortino, Giuseppe	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	B3LYP	SDD 6-31G(D,P) GEN	-1135.79570230; Eh

Results 11431-11440 of 12948 (Search time: 0.008 seconds).