AVS 54th International Symposium
    Renewable Energy Science & Technology Topical Conference Thursday Sessions
       Session EN+SS+TF-ThM

Paper EN+SS+TF-ThM2
N Incorporation and Electronic Structure in High-Quality Epitaxial N-doped TiO2 Anatase Grown by Molecular Beam Epitaxy

Thursday, October 18, 2007, 8:20 am, Room 602/603

Session: Surface Science Challenges for Solar Energy Conversion
Presenter: S.H. Cheung, Pacific Northwest National Laboratory
Authors: S.H. Cheung, Pacific Northwest National Laboratory
P. Nachimuthu, Pacific Northwest National Laboratory
M.H. Engelhard, Pacific Northwest National Laboratory
M.K. Bowman, The University of Alabama
S.A. Chambers, Pacific Northwest National Laboratory
Correspondent: Click to Email

N doping in TiO2 is of potential interest for bandgap reduction and enhanced visible light absorption for water splitting. We have previously investigated high-quality N-doped TiO2 rutile grown homoepitaxially by molecular beam epitaxy (MBE) on TiO2(110) and α-Al2O3(0001).1 To gain broader understanding of N-doped TiO2, we now report a detailed study of N incorporation and the associated electronic structure in high-quality TiO2 anastase grown by MBE on LaAlO3(001). A mixed beam of atomic N and O was prepared in an electron cyclotron resonance plasma source while Ti was supplied from an effusion cell. The much higher thermodynamic stability of Ti-O bonds compared to Ti-N bonds resulted in N incorporation being limited to less than 1 at. %. The high degree of structural quality was evidenced by the observation of finite thickness fringes in the vicinity of the (004) Bragg peak in high-resolution X-ray diffraction. A formal charge of -3 on substitutional N was deduced from high-resolution XPS. Photoconductivity measurement capability is being set up at the time of abstract preparation and experimental results elucidating the role of substitutional N in reducing the bandgap will be presented at the meeting.

1 S.H. Cheung, P. Nachimuthu, A.G. Joly, M.H. Engelhard, M.K. Bowman, S.A. Chambers, Surf. Sci. 601 (2007) 1754.