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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-Oct-2022	/template-1/ts1/c3 ts1c3_15crest	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-2781.40006975; Eh
	5-Oct-2022	/template-1/ts1/c3 ts1c3_10crest	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-2781.39866070; Eh
	5-Oct-2022	/template-1/ts1/c2 ts1c2_FBONIN_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RMN15	3-21G GEN DEF2TZVPP	-2784.4799596; Eh
	5-Oct-2022	/template-1/ts1/c3 ts1c3_FFIAIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN DEF2TZVPP	-2784.4768127; Eh
	5-Oct-2022	/template-1/ts2 ts2_FFIAIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	GEN	-3126.53680312; Eh
	5-Oct-2022	/template-1/ts2 ts2_FBIAIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RMN15	GEN	-3126.54014682; Eh
	5-Oct-2022	/template-1/ts3-a ts3a_BFINIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RMN15	GEN	-3126.54095681; Eh
	5-Oct-2022	/template-1/ts2 ts2_BFINIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RMN15	GEN	-3126.53050049; Eh
	5-Oct-2022	/template-1/ts3 ts3_FFIAIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RMN15	GEN	-3126.54324668; Eh
	5-Oct-2022	/template-1/ts3 ts3_FBIAIA_t1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RMN15	GEN	-3126.54222318; Eh

Results 241-250 of 278 (Search time: 0.002 seconds).