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Volumn 43, Issue 22, 2004, Pages 2918-2921

Ethylene epoxidation on Ag: Identification of the crucial surface intermediate by experimental and theoretical investigation of its electronic structure

Author keywords

Density functional calculations; Ethylene oxide; Heterogeneous catalysis; Silver; X ray photoelectron spectroscopy

Indexed keywords

ADSORBENTS; ELECTRONIC STRUCTURE; PROBABILITY DENSITY FUNCTION; SILVER; X RAY PHOTOELECTRON SPECTROSCOPY;

EID: 3042703519     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/anie.200353584     Document Type: Article
Times cited : (91)

References (14)
  • 12
    • 0000058492 scopus 로고
    • Sometimes final-state effects are important. These effects can be included by using, for example, Slater-Janak transition-state theory (J. F. Janak, Phys. Rev. B 1978, 18, 7165). We have not included these effects in our calculations, that is, we have assumed that screening contributions form the valence electrons in response to created holes as well as electron self-interactions are identical for excitations from both C 1s states.
    • (1978) Phys. Rev. B , vol.18 , pp. 7165
    • Janak, J.F.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.