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Volumn 519, Issue 1-2, 1996, Pages 277-280

Influence of rotation between agostic structures on ethene interaction with a zirconocene polymerization site

Author keywords

Agostic interactions; Density functional theory; Olefin polymerization; Zirconocenes

Indexed keywords


EID: 0030602674     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-328X(96)06216-X     Document Type: Article
Times cited : (38)

References (14)
  • 8
    • 0003418997 scopus 로고
    • San Diego: Biosym Technologies, Inc.
    • DMOl User Guide Version 2.3.5. 1993;Biosym Technologies, Inc. San Diego.
    • (1993) DMOl User Guide Version 2.3.5
  • 9
    • 0011313917 scopus 로고    scopus 로고
    • -1.
    • -1.
  • 12
    • 0011274982 scopus 로고    scopus 로고
    • +, all three stationary points were optimized without geometry constraints.
    • +, all three stationary points were optimized without geometry constraints.
  • 13
    • 0011313117 scopus 로고    scopus 로고
    • 3 as reaction coordinate gave essentially the same result.
    • 3 as reaction coordinate gave essentially the same result.
  • 14
    • 0011276790 scopus 로고    scopus 로고
    • β as reaction coordinate.
    • β as reaction coordinate.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.