LARGE HOLE POLARONS IN -DOPED 2 CRYSTALS.

Autor: STASHANS, ARVIDS, BRAVO, YESSICA
Předmět:
Zdroj: Modern Physics Letters B; 06/20/2013, Vol. 27 Issue 15, p-1, 8p, 4 Diagrams, 2 Graphs
Abstrakt: First-principles calculations based on the density functional theory (DFT) within the generalized gradient approximation (GGA) have been used to study -doped 2, rutile and anatase, crystals. Local defect microstructure, electronic and electrical properties have been obtained and discussed in the present work. Large radius hole polaron state found here points out to the possibility of p-type electrical conductivity in -doped titania. [ABSTRACT FROM AUTHOR]
Databáze: Complementary Index