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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Aug-2020	TS2f	Deng, Chao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RM06	6-31G* 6-31G* LANL2DZ GEN*	-1469.63448955; Eh
	24-Jun-2019	Mo-9a-K	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-2378.07315066; Eh
	24-Jun-2019	Mo-14	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-1941.61641406; Eh
	24-Jun-2019	Mo-ts-6-7-Li	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-2111.18456772; Eh
	24-Jun-2019	Mo-ts-CNH	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-2265.91885135; Eh
	24-Jun-2019	Mo-8	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-2265.93962876; Eh
	24-Jun-2019	Mo-ts-12-13	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization TS	RM06	6-31+G* GENECP*	-2381.61995093; Eh
	24-Jun-2019	Formaldehyde	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GEN*	-114.444173546; Eh
	24-Jun-2019	Methanol	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GEN*	-115.662742120; Eh
	24-Jun-2019	Mo-10	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-2225.51276459; Eh

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