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Journal Abstract Search

1164 related items for PubMed ID: 21813953

  • 1. Charge compensation in trivalent cation doped bulk rutile TiO2.
    Iwaszuk A, Nolan M.
    J Phys Condens Matter; 2011 Aug 24; 23(33):334207. PubMed ID: 21813953
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  • 7. Hole localization in Al doped silica: A DFT + U description.
    Nolan M, Watson GW.
    J Chem Phys; 2006 Oct 14; 125(14):144701. PubMed ID: 17042625
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  • 8. Theoretical study of the structure and optical properties of carbon-doped rutile and anatase titanium oxides.
    Kamisaka H, Adachi T, Yamashita K.
    J Chem Phys; 2005 Aug 22; 123(8):084704. PubMed ID: 16164318
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  • 9. O2 evolution on a clean partially reduced rutile TiO2(110) surface and on the same surface precovered with Au1 and Au2: the importance of spin conservation.
    Chrétien S, Metiu H.
    J Chem Phys; 2008 Aug 21; 129(7):074705. PubMed ID: 19044790
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  • 10. Spectroscopic properties of doped and defective semiconducting oxides from hybrid density functional calculations.
    Di Valentin C, Pacchioni G.
    Acc Chem Res; 2014 Nov 18; 47(11):3233-41. PubMed ID: 24828320
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  • 11. Modeling localized photoinduced electrons in rutile-TiO2 using periodic DFT+U methodology.
    Jedidi A, Markovits A, Minot C, Bouzriba S, Abderraba M.
    Langmuir; 2010 Nov 02; 26(21):16232-8. PubMed ID: 20572639
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  • 12. DFT+U study of defects in bulk rutile TiO(2).
    Stausholm-Møller J, Kristoffersen HH, Hinnemann B, Madsen GK, Hammer B.
    J Chem Phys; 2010 Oct 14; 133(14):144708. PubMed ID: 20950031
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  • 14. A DFT + U study of (Rh, Nb)-codoped rutile TiO2.
    Ghuman KK, Singh CV.
    J Phys Condens Matter; 2013 Feb 27; 25(8):085501. PubMed ID: 23343885
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  • 19. Electronic and structural properties of highly aluminum ion doped TiO(2) nanoparticles: a combined experimental and theoretical study.
    de los Santos DM, Aguilar T, Sánchez-Coronilla A, Navas J, Cruz Hernández N, Alcántara R, Fernández-Lorenzo C, Martín-Calleja J.
    Chemphyschem; 2014 Aug 04; 15(11):2267-80. PubMed ID: 24840394
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