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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	8-Aug-2022	nob-TS-UR	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2719.51035783; Eh
	8-Aug-2022	val-TS-US	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2221.17048505; Eh
	8-Aug-2022	nob-pd-dmso	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2284.83253921; Eh
	8-Aug-2022	val-TS-DS	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2221.16706162; Eh
	8-Aug-2022	val-TS-DR	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2221.17913741; Eh
	8-Aug-2022	nob-TS-DR	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2719.54781813; Eh
	8-Aug-2022	val-TS-UR	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Minimum	RM06	LANL2DZ 6-31+G(D,P) 6-31G(D,P) GEN	-2221.15874570; Eh
	18-Oct-2022	/M06_calculations IM7	Xu, Jihong	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	GENECP	-3474.08612313; Eh
	18-Oct-2022	/M06_calculations IM5	Xu, Jihong	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	GENECP	-2438.32230635; Eh
	18-Oct-2022	/M06_calculations IM6	Xu, Jihong	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	GENECP	-2438.34248638; Eh

Results 421-430 of 540 (Search time: 0.001 seconds).