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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Dec-2023	/Radical_addition_comparison INT4	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1754.20140093; Eh
	23-Dec-2023	/Reactant_Common_Intermediates SF5_Radical	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-896.585999305; Eh
	23-Dec-2023	/Radical_addition_comparison TS4	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-1870.77622092; Eh
	23-Dec-2023	/Radical_addition_comparison TS5	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-1754.18216446; Eh
	23-Dec-2023	/Outersphere_SET 35_radical_cation	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-934.614950915; Eh
	23-Dec-2023	/Initiation_TS TS_Initiation	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-2291.50651880; Eh
	12-Aug-2023	IM1	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1831.52621388; Eh
	12-Aug-2023	IM2	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1870.83767693; Eh
	12-Aug-2023	IM3	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1754.20140093; Eh
	12-Aug-2023	TS1	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-1831.48660760; Eh

Results 31-40 of 43 (Search time: 0.002 seconds).