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Browsing by Author Escofet, Imma

Showing results 174 to 193 of 201 < previous next >

Title	Author(s)	Program	Method(s)	Basis Set	Energy
P	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-4347.45168055; Eh
P_Int1	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-4777.10356530; Eh
Q	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-6138.11473404; Eh
Q_Int1	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-6567.76446316; Eh
R	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-8390.90206863; Eh
R_Int1	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-8820.52502340; Eh
S	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-2623.06081889; Eh
S27-Int1	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RB3LYP	6-31G SDD GENECP*	-1254.40405230; Eh
S27-Int2	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RB3LYP	6-31G SDD GENECP*	-1254.41262414; Eh
S27-Int3	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RB3LYP	6-31G SDD GENECP*	-1254.39282795; Eh
S27-TS1-2	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RB3LYP	6-31G SDD GENECP*	-1254.38829242; Eh
S27-TS1-3	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RB3LYP	6-31G SDD GENECP*	-1254.38026719; Eh
T	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RBP86	6-31G SDD GENECP*	-2158.48046945; Eh
TS1a_Int2a	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1214.17912493; Eh
TS2a_Int5a	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1257.29332129; Eh
TS2a_Int5b	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1257.29721106; Eh
TS2a_Int6a	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1257.29458794; Eh
TS2a_Int6b	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1257.29292376; Eh
TSInt2a_Int3a	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1754.51094917; Eh
TSInt2a_Int4a	Escofet, Imma	Gaussian; 09; EM64L-G09RevD.01	RM06	6-31G SDD GENECP*	-1754.51479281; Eh

Showing results 174 to 193 of 201

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Browsing by Author Escofet, Imma