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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	15-Jul-2024	/Geom_Opt ¹J	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GENECP*	-1212.51617180; Eh
	15-Jul-2024	/Geom_Opt ¹Ni(COD)₂	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GENECP*	-795.153360852; Eh
	15-Jul-2024	/Geom_Opt ¹A	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GENECP*	-1293.07930904; Eh
	15-Jul-2024	/Geom_Opt K₂HPO₄	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-1842.90766687; Eh
	15-Jul-2024	/Geom_Opt K₃PO₄	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-2442.25638558; Eh
	15-Jul-2024	/Geom_Opt dtbbpy	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-809.985497833; Eh
	15-Jul-2024	/Geom_Opt HI	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GENECP*	-12.0114830414; Eh
	15-Jul-2024	/Geom_Opt KCl	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-1060.19868865; Eh
	15-Jul-2024	/Geom_Opt HBr	Sharma, Akhilesh Kumar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-2572.00655788; Eh
	30-Apr-2024	IPhOTFAradical	Xie, Jiale	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	DEF2TZVP	-1055.5007459; Eh

Results 11221-11230 of 12842 (Search time: 0.009 seconds).