Authors: Bernal-Uruchurtu, MI Martins-Costa, MTC Millot, C Ruiz-Lopez, MF

Citation: Mi. Bernal-uruchurtu et al., Improving description of hydrogen bonds at the semiempirical level: Water-water interactions as test case, J COMPUT CH, 21(7), 2000, pp. 572-581

Authors: Saint-Martin, H Hernandez-Cobos, J Bernal-Uruchurtu, MI Ortega-Blake, I Berendsen, HJC

Citation: H. Saint-martin et al., A mobile charge densities in harmonic oscillators (MCDHO) molecular model for numerical simulations: The water-water interaction, J CHEM PHYS, 113(24), 2000, pp. 10899-10912

Authors: Bernal-Uruchurtu, MI Ruiz-Lopez, MF

Citation: Mi. Bernal-uruchurtu et Mf. Ruiz-lopez, Basic ideas for the correction of semiempirical methods describing H-bonded systems, CHEM P LETT, 330(1-2), 2000, pp. 118-124

Authors: Bernal-Uruchurtu, MI Ortega-Blake, I

Citation: Mi. Bernal-uruchurtu et I. Ortega-blake, On the molecular basis of water hydrolysis. A detailed ab initio study, J PHYS CH A, 103(7), 1999, pp. 884-892