The interactions of bridging oxygen vacancies on the rutile (110) surface (original) (raw)

The interactions of bridging oxygen vacancies on the rutile (110) surface

Danda Acharya

Cristian Ciobanu

William Maddox

Abstract

Using density functional theory calculations at the level of Hubbard-corrected generalized gradient approximation (GGA+ U), we calculate the formation and interaction energies of oxygen vacancies on the (110) surface of rutile for neutral and positively charged slabs for ...

Danda Acharya hasn't uploaded this paper.

Let Danda know you want this paper to be uploaded.

Ask for this paper to be uploaded.