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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-Sep-2021	RhIII-H	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-995.268319213; Eh
	30-Sep-2021	RhI-HCp-1e	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-995.382494033; Eh
	30-Sep-2021	RhIII-H-1e_EMIM	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-1339.91557929; Eh
	30-Sep-2021	RhIII-H_EMIM	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-1339.81031406; Eh
	30-Sep-2021	adduct_RhIII-H-1e_H5O2_EMIM	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-1493.17816227; Eh
	30-Sep-2021	RhIII-H-1e	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-995.366686041; Eh
	30-Sep-2021	RhI-HCp	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-995.280038639; Eh
	30-Sep-2021	adduct_RhIII-H-1e_H5O2	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	LANL2DZ 6-31G(D,P) GENECP	-1148.63495270; Eh
	30-Sep-2021	RhI-HCp_EMIM	Solé-Daura, Albert	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	LANL2DZ 6-31G(D,P) GENECP	-1339.82312061; Eh
	20-Jul-2022	/Bach_iPr_system Bach_iPr_trans_lactone	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	GENECP	-4320.15938303; Eh

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