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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-May-2024	CuHIN_am_H2O	Pisanu, Federico	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G(D,P) SDD GEN	-1738.57510149; Eh
	15-Jul-2024	/Geom_Opt_SI_Additional ²TS_s7	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	UB3LYP	6-31G SDD GENECP*	-1673.69621704; Eh
	15-Jul-2024	/Geom_Opt I•ᐧᐧᐧTHF	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G SDD GENECP*	-243.876161655; Eh
	15-Jul-2024	/Geom_Opt THF•ᐧᐧᐧHBr	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G GEN*	-2803.83003302; Eh
	15-Jul-2024	/Geom_Opt THF•ᐧᐧᐧHCl	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G GEN*	-692.621138450; Eh
	15-Jul-2024	/Geom_Opt Br•ᐧᐧᐧTHF	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G GEN*	-2803.85151975; Eh
	15-Jul-2024	/Geom_Opt Br•	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	6-31G GEN*	-2571.36311099; Eh
	15-Jul-2024	/Geom_Opt I•	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	SDD GENECP	-11.3971560513; Eh
	2-May-2024	Ir-B-triplet	Solé Daura, Albert	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	LANL2DZ GEN	-1541.24801913; Eh
	2-May-2024	Ir-A-triplet	Solé Daura, Albert	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	LANL2DZ GEN	-1634.02832890; Eh

Results 11331-11340 of 12842 (Search time: 0.009 seconds).