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Volumn 119, Issue 1-3, 1997, Pages 449-458

Periodic ab initio study of the oxidizing sites in Ti-containing zeolites

Author keywords

Ab initio; Chabazite; Hartree Fock; Periodic; Titanium; Zeolites

Indexed keywords


EID: 0030918834     PISSN: 13811169     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1381-1169(96)00508-0     Document Type: Article
Times cited : (22)

References (38)
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    • R. Millini, G. Perego and K. Seiti, in: J. Weikamp, H.G. Karge, H. Pfeifer and W. Hölderich (Eds.), Studies in Surface Science and Catalysis, Vol. 84 (Elsevier, Amsterdam, 1994) p. 2123.
    • (1994) Studies in Surface Science and Catalysis , vol.84 , pp. 2123
    • Millini, R.1    Perego, G.2    Seiti, K.3
  • 20
    • 0003400762 scopus 로고
    • Springer, Berlin
    • C. Pisani, R. Dovesi and C. Roetti, in: Lecture Notes in Chemistry Series (Springer, Berlin, 1988) p. 48; R. Dovesi, V.R. Saunders, C. Roetti, M. Causà, N.M. Harrison, R. Orlando and E. Aprà, CRYSTAL95 user documentation, Università di Torino, Torino (1995).
    • (1988) Lecture Notes in Chemistry Series , pp. 48
    • Pisani, C.1    Dovesi, R.2    Roetti, C.3
  • 23
    • 2442617487 scopus 로고
    • J.S. Binkley, J.A. Pople and W.J. Hehre, J. Am. Chem. Soc. 102 (1980) 939; M.S. Gordon, J.S. Binkley, J.A. Pople, W.J. Pietro and W.J. Hehre, J. Am. Chem. Soc. 104 (1982) 2797.
    • (1980) J. Am. Chem. Soc. , vol.102 , pp. 939
    • Binkley, J.S.1    Pople, J.A.2    Hehre, W.J.3
  • 25
    • 0342454821 scopus 로고    scopus 로고
    • private communication
    • V.R. Saunders, private communication.
    • Saunders, V.R.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.