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Volumn 401, Issue 1, 1998, Pages 82-95

Embedded cluster study of water adsorption at Cr2O3(0001)

Author keywords

Chemisorption; Chromium oxide; Low index single crystal surfaces; Models of surface chemical reactions; Semi empirical models and model calculations; Single crystal surfaces; Solid gas interfaces; Surface defects; Surface relaxation and reconstruction; Water

Indexed keywords

ADSORPTION; CHEMISORPTION; CRYSTAL DEFECTS; DISSOCIATION; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; PHASE INTERFACES; QUANTUM THEORY; RELAXATION PROCESSES; SINGLE CRYSTALS; SURFACE PHENOMENA; WATER;

EID: 0032025452     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(97)00913-8     Document Type: Article
Times cited : (38)

References (50)
  • 24
    • 0000798783 scopus 로고
    • Hartree-Fock Ab Initio Treatment of Crystalline Systems
    • Springer, Heidelberg
    • C. Pisani, R. Dovesi, C. Roetti, Hartree-Fock Ab Initio Treatment of Crystalline Systems, Lecture Notes in Chemistry, vol. 48, Springer, Heidelberg, 1988.
    • (1988) Lecture Notes in Chemistry , vol.48
    • Pisani, C.1    Dovesi, R.2    Roetti, C.3
  • 26
    • 0002545323 scopus 로고
    • Adsorption on Ordered Surfaces of Ionic Solids and Thin Films
    • Springer, Berlin
    • H.-J. Freund, E. Umbach (Eds.), Adsorption on Ordered Surfaces of Ionic Solids and Thin Films, Springer Series in Surface Science, vol. 3, Springer, Berlin, 1993.
    • (1993) Springer Series in Surface Science , vol.3
    • Freund, H.-J.1    Umbach, E.2
  • 31
    • 0003474595 scopus 로고
    • Methods and Techniques in Computational Chemistry
    • E. Clementi, G. Corongiu (Eds.), STEF, Cagliari
    • K. Jug, T. Bredow, in: E. Clementi, G. Corongiu (Eds.), Methods and Techniques in Computational Chemistry, METECC 95, STEF, Cagliari 1995, pp. 89-139.
    • (1995) METECC 95 , pp. 89-139
    • Jug, K.1    Bredow, T.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.