The usefulness of time-dependent density functional theory to describe the electronic spectra of ti-containing catalysts.
de la Peña O'Shea
Victor A
VA
Instituto de Catálisis y Petroleoquímica, CSIC, Marie Curie, s/n; Cantoblanco, 28049 Madrid, Spain.
Capel-Sanchez
Maricarmen
M
Blanco-Brieva
Gema
G
Campos-Martin
Jose M
JM
Fierro
Jose L G
JL