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Volumn 606, Issue 17-18, 2012, Pages 1400-1404

A systematic DFT study of hydrogen diffusion on transition metal surfaces

Author keywords

Density functional theory calculations; H diffusion; Transition metal surfaces

Indexed keywords

ACTIVATION BARRIERS; CLOSED PACKED STRUCTURES; DENSITY FUNCTIONAL THEORY CALCULATIONS; DFT STUDY; H DIFFUSION; HYDROGEN ATOMS; HYDROGEN DIFFUSION; MINIMUM ENERGY PATHS; NUDGED ELASTIC BAND; TRANSITION METAL SURFACES; TUNNELING EFFECTS;

EID: 84862684458     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2012.04.028     Document Type: Article
Times cited : (117)

References (47)
  • 44
    • 84862693855 scopus 로고    scopus 로고
    • Center for Atomic-scale Materials Design, Technical University of Denmark, Kongens Lyngby
    • Dacapo pseudopotential code. URL http://www.fysik.dtu.dk/campos., Center for Atomic-scale Materials Design, Technical University of Denmark, Kongens Lyngby.
    • Dacapo Pseudopotential Code


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.