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Volumn 103, Issue 42, 1999, Pages 8483-8490

Theoretical calculation of the interaction of hydrogen with models of coordinatively unsaturated centers on alumina

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0042722667     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp990939a     Document Type: Article
Times cited : (14)

References (47)
  • 13
    • 0004291957 scopus 로고    scopus 로고
    • Baltzer Scientific: Amsterdam, in press
    • (d) A case was reported where the phenomenon consisted of reduction of the support, rather than formation of hydrogen atoms adsorbed on it: Sachtler, W. M. H. Topics in Catalysis; Baltzer Scientific: Amsterdam, 1999, in press.
    • (1999) Topics in Catalysis
    • Sachtler, W.M.H.1
  • 27
    • 0031275978 scopus 로고    scopus 로고
    • (b) Other examples of nonperformance of DFT calculations have been reported: Boronat, M.; Viruela, P.; Corma, A. J. Phys. Chem. 1997, 101, 10069.
    • (1997) J. Phys. Chem. , vol.101 , pp. 10069
    • Boronat, M.1    Viruela, P.2    Corma, A.3
  • 39
    • 0004197465 scopus 로고
    • Minnesota supercomputing Center, Inc.: Minneapolis, MN
    • Xmol, version 1.3.1; Minnesota supercomputing Center, Inc.: Minneapolis, MN, 1993.
    • (1993) Xmol, Version 1.3.1
  • 40
    • 0002151796 scopus 로고
    • MOLDEN. A portable electron density program, QCPE 619
    • Schaftenaar, G. MOLDEN. A Portable Electron Density Program, QCPE 619; QCPE Bull. 1992, 12, 3.
    • (1992) QCPE Bull. , vol.12 , pp. 3
    • Schaftenaar, G.1
  • 46
    • 85034144943 scopus 로고    scopus 로고
    • 1 cal = 4.184 J
    • 1 cal = 4.184 J.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.