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Volumn 46, Issue 26, 2007, Pages 4894-4897

F centers versus dimer vacancies on ZnO surfaces: Characterization by STM and STS calculations

Author keywords

Density functional calculations; Scanning probe microscopy; Surface chemistry; Surface defects; Zinc oxide

Indexed keywords

ATOMIC DEFECT;

EID: 34447294559     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/anie.200604399     Document Type: Article
Times cited : (46)

References (37)
  • 18
    • 11144295608 scopus 로고    scopus 로고
    • Angew. Chem. Int. Ed. 2004, 43, 6641;
    • (2004) Chem. Int. Ed , vol.43 , pp. 6641
    • Angew1
  • 25
    • 34447331247 scopus 로고    scopus 로고
    • Ab Initio Molecular Dynamics: Theory and Implementation: D. Marx, J. Hutter in Modern Methods and Algorithms of Quantum Chemistry (Ed.: J. Grotendorst), NIC, FZ Jülich, 2000, see http:// www.theochem.rub.de/go/cprev.html.
    • b) "Ab Initio Molecular Dynamics: Theory and Implementation": D. Marx, J. Hutter in Modern Methods and Algorithms of Quantum Chemistry (Ed.: J. Grotendorst), NIC, FZ Jülich, 2000, see http:// www.theochem.rub.de/go/cprev.html.
  • 28
    • 34447342499 scopus 로고    scopus 로고
    • In the STM/STS calculations, the ultrasoft pseudopotentials were replaced by norm-conserving ones, and the plane-wave cut-off energy was increased to 120 Ry in order to obtain smooth wave function tails in the vacuum region
    • In the STM/STS calculations, the ultrasoft pseudopotentials were replaced by norm-conserving ones, and the plane-wave cut-off energy was increased to 120 Ry in order to obtain smooth wave function tails in the vacuum region.
  • 34
  • 36
    • 18844410328 scopus 로고    scopus 로고
    • Angew. Chem. Int. Ed. 2005, 44, 2790.
    • (2005) Chem. Int. Ed , vol.44 , pp. 2790
    • Angew1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.