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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	16-Oct-2020	/Rh/TS_IV_Vb MM3-10-transcyclopropanation-CHD-TSopt	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RB3LYP	LANL2DZ 6-31G(D,P) GENECP	-2905.18381971; Eh
	16-Oct-2020	/Rh/TS_VI_VII MM4-4-RhCope-E2Styryl-TSopt	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RB3LYP	LANL2DZ 6-31G(D,P) GENECP	-2905.20674028; Eh
	16-Oct-2020	/Rh/Rh Rh2TFA4	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB3LYP	LANL2DZ 6-31G(D,P) GENECP	-2323.96839904; Eh
	16-Oct-2020	/Rh/IV__cis MM3-7-ciscyclopropanation-CHD-TSopt-LESS	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-
	16-Oct-2020	/Rh/Vb MM3-11-transcyclopropanation-CHD-TSopt-LESS	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-
	16-Oct-2020	/Rh/VII MM3-33-cisdistal-to-CHDprod-MORE	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-
	16-Oct-2020	/Rh/IV_cis MM3-18-cis-distal-TS-MORE	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-
	16-Oct-2020	/Rh/FreeCopes/TS_3a__3a MM2-10-cisdivinyl-to-CHDprod-min-TS-opt	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-
	16-Oct-2020	/Rh/FreeCopes/TS_3x__3x MM2-17-cisCOD-to-CHDCOD-min-TS-opt	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-
	16-Oct-2020	/Rh/FreeCopes/TS_3r__3r MM2-58-CpCycloprop-to-CHD-TS-opt	Armengol i Relats, Helena	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	GENECP	-

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