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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	15-Jul-2022	/Water/B3LYP-D3(BJ)_6311+G(d,p) TS2	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RB3LYP	6-311+G(D,P)	-1265.23915135; Eh
	15-Jul-2022	/Water/B3LYP-D3(BJ)_6311+G(d,p) TS3	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RB3LYP	6-311+G(D,P)	-1265.26069254; 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	/Bach_eth_system Bach_eth_cis_TS2	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	GENECP	-4280.76862866; Eh
	20-Jul-2022	/TA_TT_energy_study Bach_iPr_TT_TS1_CBr3_log	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	GENECP	-9500.96821431; Eh
	20-Jul-2022	/TA_TT_energy_study Bach_iPr_TA_TS1_SiH3	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	GENECP	-2039.96069488; Eh
	20-Jul-2022	/TA_TT_energy_study Bach_iPr_TA_TS1_CBr3	Guo, Wentao	Gaussian; 09; AM64L-G09RevD.01	Geometry optimization TS	RB3LYP	GENECP	-9500.95671670; Eh
	20-Jul-2022	/TA_TT_energy_study Bach_iPr_TT_TS1_Cl	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	GENECP	-2208.86302262; Eh
	20-Jul-2022	/TA_TT_energy_study Bach_iPr_TA_TS1_Cl	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	GENECP	-2208.85244919; Eh
	20-Jul-2022	/TA_TT_energy_study Bach_iPr_TA_TS1_Me	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	GENECP	-1788.58315082; Eh

Results 51-60 of 177 (Search time: 0.001 seconds).