Effect of defects on the structure, electronic structure, and dielectric properties of HfO2

Date & Time
16 April 2008 (Wed), 3:30 pm - 5:00 pm
Place
8F larger seminar room, Sengen site
Speaker
Dr. Eric J. Cockayne
Affiliation
Ceramics Division, National Institute of Standards and Technology (NIST), USA
Title
Effect of defects on the structure, electronic structure, and dielectric properties of HfO2
Abstract
This talk details the results of first-principles density functional theory studies of the effect of various defects on the structure, electronic structure, and dielectric properties of HfO2. The defects studied include oxygen vacancies, ionic substitutions, interstitials, and combinations of defects. Most defects cause a larger permittivity due to a variety of factors; the most significant enhancement occurs if the tetragonal or cubic phase of HfO2 is stabilized with respect to the monoclinic phase. The effect of Al substitution on Si-SiO2-HfO2 gate stacks is also investigated, and discussed in terms of a dipole model.
Contact
Dr. Naoto Umezawa (梅澤直人)