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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
3-Oct-2019	/OPTFREQ TS_A5A6	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-4655.28782023; Eh
3-Oct-2019	/OPTFREQ TS_A4A5P	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-4655.25495329; Eh
3-Oct-2019	/OPTFREQ TS_B3A4	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-4655.23443593; Eh
3-Oct-2019	/OPTFREQ TS_A4A5	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-4655.26587507; Eh
3-Oct-2019	/OPTFREQ TS_A3A4	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-4655.27451617; Eh
3-Oct-2019	/OPTFREQ TS_C3A9	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-3240.54298486; Eh
3-Oct-2019	/OPTFREQ TS_A7A8	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-4655.28590413; Eh
3-Oct-2019	/OPTFREQ TS_A1A2	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	cc-pVDZ	-2368.75661508; Eh
3-Oct-2019	/OPTFREQ TS_C2C3P	Artigas, Albert	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	UB3LYP	-	-3240.49682731; Eh
5-Jul-2022	2b_TS_HAT	Besalú-Sala, Pau	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UM06L	DEF2SVP	-2470.66278445; Eh

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