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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	24-Jun-2019	Aniline	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GEN*	-287.406606469; Eh
	24-Jun-2019	Acetaldehyde	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GEN*	-153.745493102; Eh
	24-Jun-2019	Post_proton_transfer	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-1940.44236538; Eh
	18-Mar-2019	Urea	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G**	-225.176236451; Eh
	18-Mar-2019	Deprotonation_ax_with_formanilide	Artus Suarez, Lluis	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G**	-802.799014198; Eh
	12-Nov-2019	H6PtW6O24(2e_2H)-H2	Lang, Zhongling	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D) 6-31G(D,P) LANL2DZ GEN	-2336.64659385; Eh
	12-Nov-2019	H6PtW6O24(2e_2H)	Lang, Zhongling	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D) 6-31G(D,P) LANL2DZ GEN	-2336.73112094; Eh
	24-Jun-2019	Mo-9a-alt1	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-1940.45178365; Eh
	24-Jun-2019	Mo-9a	Artus Suarez, Lluis	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31+G* GENECP*	-1940.46925366; 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

Results 71-80 of 274 (Search time: 0.001 seconds).