메뉴 건너뛰기




Volumn 133, Issue 22, 2010, Pages

Low O2 dissociation barrier on Pt(111) due to adsorbate-adsorbate interactions

Author keywords

[No Author keywords available]

Indexed keywords

ADSORBATE-ADSORBATE INTERACTION; CATALYTIC PROCESS; DENSITY FUNCTIONAL THEORY CALCULATIONS; DISSOCIATION BARRIER; FINAL STATE; INTERATOMIC POTENTIAL; MEAN-FIELD KINETICS; NEAREST-NEIGHBOR INTERACTIONS; PT(111); SATURATION COVERAGE; SUPER CELL;

EID: 78650388375     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3512618     Document Type: Article
Times cited : (46)

References (38)
  • 5
    • 0001178061 scopus 로고
    • 10.1016/0039-6028(80)90278-2
    • J. L. Gland, Surf. Sci. 93, 487 (1980). 10.1016/0039-6028(80)90278-2
    • (1980) Surf. Sci. , vol.93 , pp. 487
    • Gland, J.L.1
  • 19
    • 33744538097 scopus 로고
    • 10.1103/PhysRevB.5.4709
    • D. A. Shirley, Phys. Rev. B 5, 4709 (1972). 10.1103/PhysRevB.5.4709
    • (1972) Phys. Rev. B , vol.5 , pp. 4709
    • Shirley, D.A.1
  • 23
    • 78650337999 scopus 로고    scopus 로고
    • GPAW project., https://wiki.fysik.dtu.dk/gpaw, 2009.
    • (2009) GPAW Project
  • 24
    • 25744460922 scopus 로고
    • 10.1103/PhysRevB.50.17953
    • P. E. Blchl, Phys. Rev. B 50, 17953 (1994). 10.1103/PhysRevB.50.17953
    • (1994) Phys. Rev. B , vol.50 , pp. 17953
    • Blchl, P.E.1
  • 25
  • 28
    • 34547780026 scopus 로고    scopus 로고
    • 10.1103/PhysRevLett.99.066101
    • X.-G. Wang and G. B. Fisher, Phys. Rev. Lett. 99, 066101 (2007). 10.1103/PhysRevLett.99.066101
    • (2007) Phys. Rev. Lett. , vol.99 , pp. 066101
    • Wang, X.-G.1    Fisher, G.B.2
  • 30
    • 0028410457 scopus 로고
    • 2 molecules per Pt atom rather than O atoms per Pt atom; the latter units have been adopted consistently throughout the present work. 10.1016/0039-6028(94)91489-3
    • 2 molecules per Pt atom rather than O atoms per Pt atom; the latter units have been adopted consistently throughout the present work. 10.1016/0039-6028(94)91489-3
    • (1994) Surf. Sci. , vol.307 , pp. 761
    • Cudok, A.1    Froitzheim, H.2    Hess, G.3
  • 31
    • 78650318814 scopus 로고    scopus 로고
    • a range we considered yields the highest (lowest) barrier
    • a range we considered yields the highest (lowest) barrier.
  • 32
    • 34547842572 scopus 로고    scopus 로고
    • 10.1063/1.2748379
    • C. Sendner and A. Gro, J. Chem. Phys. 127, 014704 (2007). 10.1063/1.2748379
    • (2007) J. Chem. Phys. , vol.127 , pp. 014704
    • Sendner, C.1    Gro, A.2
  • 37
    • 60849113132 scopus 로고    scopus 로고
    • 10.1016/j.susc.2009.01.021
    • S. D. Miller and J. R. Kitchin, Surf. Sci. 603, 794 (2009). 10.1016/j.susc.2009.01.021
    • (2009) Surf. Sci. , vol.603 , pp. 794
    • Miller, S.D.1    Kitchin, J.R.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.