M. Lamsabhi, M. Yáñez, O. Mó, C. Trujillo, F. Blanco, I. Alkorta, J. Elguero and T. Torres
TDDFT study of the UV-vis spectra of subporphyrins and subphthalocyanines
Int. J. Mass Spect., 306, 27, 2011
DOI:10.1016/j.ijms.2011.05.018
C. Trujillo, A. M. Lamsabhi, O. Mó, J-Y. Salpin and M. Yáñez,
Unimolecular reactivity upon collision of Uracil-Ca2+complexes in the gas phase: Comparison with Uracil-M+(M = H, alkali metals) and Uracil-M2+(M = Cu, Pb)
J. Phys. Chem. A, 115, 12124, 2011
C. Trujillo, G. Sánchez-Sanz , I. Alkorta and J. Elguero.
Simultaneous Interactions of Anions and Cations with Cyclohexane and Adamantane: Aliphatic Cyclic Hydrocarbons as Charge Insulators.
Comput. Theor. Chem., 967, 147, 2011
DOI: 10.1016/j.comptc.2011.04.008
I. Alkorta, C. Trujillo, J. Elguero and M. Solimannejad
A theoretical study of the hydrogen bonding properties of H2B=NH2: Some considerations on the basis set superposition error issue