Y 95 Yuryeva, E. I. Xalfa Discrete Variational Analysis and Resonance Study of the Dissociation of Water Molecules on the Surface of TiO and TiO2 Oxides / E. I. Yuryeva, N. A. Zhuravlev, R. N. Pletnev // Bulletin of the Russian Academy of Sciences: Physics. - 2007. - Vol. 71, № 5. - P. 735-737 : il. - Bibliogr. : p. 737 (5 ref.) Рубрики: ХИМИЧЕСКИЕ НАУКИ Кл.слова (ненормированные): ЯМР -- ЯДЕРНЫЙ МАГНИТНЫЙ РЕЗОНАНС -- ОКСИД ТИТАНА Аннотация: The disordered state of hydrogen in titanium oxyhydrate has been investigated by 1H nuclear magnetic resonance. The protonation of TiO and TiO2 oxides has been simulated by the Xα discrete variational method. It is established that an increase in the number of protons decreases the stability of coordination polyhedra of titanium atoms, while an increase in the O–H bond length enhances the ability of water molecules to dissociate \\\\Expert2\\nbo\\Bulletin of the Russian Academy of Sciences Physics\\2007, V. 71, N 5, P. 735-737.pdf |