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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	19-Nov-2023	/TBHP/12-hydride-shift TSHbp-Hb	Mu, Manting	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) 6-31+G(D,P) GEN	-1392.15597639; Eh
	19-Nov-2023	/TBHP/proton-shuttle-intra TSpHOTf-enolOTf	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) 6-31+G(D,P) GEN	-2353.59829367; Eh
	19-Nov-2023	/H2O2/12-hydride-shift TSI-H’SS	Mu, Manting	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) 6-31+G(D,P) GEN	-1234.92231918; Eh
	19-Nov-2023	/H2O2/12-hydride-shift TSH’-HSR	Mu, Manting	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) 6-31+G(D,P) GEN	-1234.92222419; Eh
	19-Nov-2023	/H2O2/12-hydride-shift TSH’-HRR	Mu, Manting	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) 6-31+G(D,P) GEN	-1234.92324914; Eh
	8-Apr-2024	/figure_1 1TS2EnoTMPH	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1735.61320720; Eh
	8-Apr-2024	/figureS1 1TS1Z	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1618.19565468; Eh
	8-Apr-2024	/figureS2 12TS1E	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1515.73525617; Eh
	8-Apr-2024	/figure_1 1TS1LiE	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1463.46570269; Eh
	8-Apr-2024	/figureS1 1I2Z	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1618.19565468; Eh

Results 41-50 of 60 (Search time: 0.002 seconds).