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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-Sep-2025	9-TMA+_opt_dmf	Limburg, Bart; Duran, Jordi; Companyó, Xavier	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31+G(D,P)	-914.752235443; Eh
	10-Sep-2025	8-F_opt_dmf	Limburg, Bart; Duran, Jordi; Companyó, Xavier	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31+G(D,P)	-1021.61223863; Eh
	10-Sep-2025	10_opt_dmf	Limburg, Bart; Duran, Jordi; Companyó, Xavier	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31+G(D,P)	-1622.07286698; Eh
	10-Sep-2025	8+_opt_dmf	Limburg, Bart; Duran, Jordi; Companyó, Xavier	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	6-31+G(D,P)	-921.608870651; Eh
	18-Feb-2026	benzenesulfO_OH	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	DEF2SVP	-780.479514364; Eh
	18-Feb-2026	SIA_S_N3H+	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	DEF2SVP	-1345.90809792; Eh
	18-Feb-2026	SDA_O_H+1	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	DEF2SVP	-1257.24350982; Eh
	18-Feb-2026	CH3SO2O-	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	DEF2SVP	-663.547344234; Eh
	18-Feb-2026	F-	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	DEF2SVP	-99.8365589614; Eh
	10-Sep-2025	TSF_opt_dmf	Limburg, Bart; Duran, Jordi; Companyó, Xavier	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization TS	RB3LYP	6-31+G(D,P)	-1376.62194482; Eh

Results 390321-390330 of 403353 (Search time: 0.193 seconds).