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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Dec-2023	/Propagation TS2_syn	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-3188.18183900; Eh
	23-Dec-2023	/Propagation TS2_anti	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-3188.18277731; Eh
	23-Dec-2023	/Propagation TS3_cis	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-2029.09633421; Eh
	23-Dec-2023	/Propagation TS3_trans	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-2029.09563022; Eh
	23-Dec-2023	/Propagation TS1_3	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-1831.48660760; Eh
	23-Dec-2023	/Propagation TS1_1	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	UwB97XD	DEF2SVP	-1831.47738334; Eh
	23-Dec-2023	/Reactant_Common_Intermediates 2_Pentane_Radical	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-196.903776848; Eh
	23-Dec-2023	/Propagation INT2_1	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1831.50415986; Eh
	23-Dec-2023	/Propagation INT2_3	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1831.52621388; Eh
	23-Dec-2023	/Radical_addition_comparison INT3	Wang-Yeuk, Kong	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1870.83767693; Eh

Results 21-30 of 43 (Search time: 0.001 seconds).