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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	20-Jul-2022	/Bach_iPr_system Bach_iPr_TT_TS1	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Single point Minimum	RB3LYP	GENECP	-4320.07636395; Eh
	20-Jul-2022	/triplet_state Bach_iPr_TT_TS1_triplet	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Single point Structure	UB3LYP	GENECP	-4320.0249288; Eh
	20-Jul-2022	/Rh2(s-TCPTTL)4 rh2stcpttl4_aabb	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	GENECP	-11163.2331822; Eh
	20-Jul-2022	/Bach_iPr_system Bach_iPr_TT_VTS1	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Single point Structure	RB3LYP	6-31G(D) LANL2DZ GENECP	-4320.07666870; Eh
	20-Jul-2022	/fDavies_Ph fDavies_Ph_CT_TS2	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RB3LYP	GENECP	-14577.8788407; Eh
	20-Jul-2022	/fDavies_Ph fDavies_Ph_TT_TS2	Guo, Wentao	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GENECP	-14577.8843920; Eh
	20-Jul-2022	/Bach_eth_system Bach_eth_CT_TS1	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Single point Minimum	RB3LYP	GENECP	-4280.75404494; Eh
	20-Jul-2022	/Davies_Ph Davies_Ph_CA_VTS1	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	GENECP	-4547.70312870; Eh
	20-Jul-2022	/Bach_iPr_system Bach_iPr_SM	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RB3LYP	GENECP	-1760.04747621; Eh
	20-Jul-2022	/Davies_Me Davies_Me_trans_TS2	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	UB3LYP	GEN	-4355.98072568; Eh

Results 181-190 of 256 (Search time: 0.001 seconds).