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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	7-May-2024	c3ab-co3b	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1742.73557633; Eh
	7-May-2024	c5ab-co3c	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1742.73806225; Eh
	7-May-2024	c3ab-co3a	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1742.73556608; Eh
	8-Apr-2024	/figureS3 12TS2ZnoHTMP	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1530.68714237; Eh
	8-Apr-2024	/figure_1 1TS2LiE	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1463.46273420; Eh
	8-Apr-2024	/figure_1 1TS1E	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1618.19878585; Eh
	21-Apr-2024	TS6-3CO	von Wolff, Niklas	Gaussian; 16; AM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP DEF2SVP/W06	-2094.16564779; Eh
	21-Apr-2024	TS5-2	von Wolff, Niklas	Gaussian; 16; AM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP DEF2SVP/W06	-1980.92503082; Eh
	21-Apr-2024	TS1-5	von Wolff, Niklas	Gaussian; 16; AM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP DEF2SVP/W06	-1980.94326867; Eh
	28-Feb-2024	TS2	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1198.52223612; Eh

Results 1411-1420 of 1450 (Search time: 0.003 seconds).