Title of article
Electronic structure of TiO 110/surface as a function of surface 2 ligand configuration
Author/Authors
Shigenobu Kimura، نويسنده , , Masaru Tsukada، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1998
Pages
6
From page
587
To page
592
Abstract
Electronic structure of TiO2 110. surface is studied by a first-principles molecular dynamics calculation with the
Vanderbilt pseudopotential. Three types of the surface are concerned: stoichiometric surface, defect 1=1.surface, and
Ti2O3 added row surface. STM simulation as well as electronic band structures are presented. The simulated STM images
show that
Keywords
Titanium oxide , First-principles calculation , GGA , STM simulation
Journal title
Applied Surface Science
Serial Year
1998
Journal title
Applied Surface Science
Record number
992668
Link To Document