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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-Oct-2022	/sm silver_acetate	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-749.614004004; Eh
	5-Oct-2022	/sm MPAA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP	-436.255010436; Eh
	5-Oct-2022	/sm HOAc	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP	-228.644532976; Eh
	5-Oct-2022	/sm ACN	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RMN15	DEF2SVP	-132.469959393; Eh
	5-Oct-2022	/template-1/ts1/c4 ts1c4_FBIAIN_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RMN15	3-21G GEN	-2781.39483894; Eh
	5-Oct-2022	/template-1/ts1/c6 ts1c6_FBIAIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RMN15	3-21G GEN	-2781.40479464; Eh
	5-Oct-2022	/template-1/ts1/c4 ts1c4_BFINIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RMN15	3-21G GEN	-2781.39556363; Eh
	5-Oct-2022	/template-1/ts1/c7 ts1c6_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RMN15	3-21G GEN	-2781.39301891; Eh
	5-Oct-2022	/template-1/ts1/c3 ts1c3_FBININ_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RMN15	3-21G GEN	-2781.39426403; Eh
	5-Oct-2022	/template-1/ts1/c4 ts1c4_FFINIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN DEF2TZVPP	-2784.4777618; Eh

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