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Volumn 83, Issue 5, 2009, Pages 1075-1084

The cooperativity of C-H-F blue-shifting hydrogen bonds. Static and dynamic calculations on CF3H dimer, trimer and tetramer

Author keywords

Conventional and improper hydrogen bonds; Cooperative effects; Density functional calculations; Molecular dynamics

Indexed keywords


EID: 67649644488     PISSN: 01375083     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article
Times cited : (5)

References (41)
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    • Oxford University Press, New York
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    • (1997) Hydrogen Bonding
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    • 33746247655 scopus 로고    scopus 로고
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    • Ludwig R.,Angew. Chem. Int. Ed., 40, 1809 (2001).
    • (2001) Chem. Int. Ed , vol.40 , pp. 1809
    • Ludwig1
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  • 33
    • 67649671861 scopus 로고    scopus 로고
    • CPMD 3.4; Hutter J., Ballone P., Bernasconi M., Focher P., Fois E., Goedecker S., Marx D., Parrinello M. and Tuckerman M.; MPI filer Festkoerperforschung, Stuttgart and IBM Zurich Research Laboratory.
    • CPMD 3.4; Hutter J., Ballone P., Bernasconi M., Focher P., Fois E., Goedecker S., Marx D., Parrinello M. and Tuckerman M.; MPI filer Festkoerperforschung, Stuttgart and IBM Zurich Research Laboratory.
  • 38
    • 67649653853 scopus 로고    scopus 로고
    • Nos6 S., J. Chem. Phys., 81, 511 (1984).
    • Nos6 S., J. Chem. Phys., 81, 511 (1984).


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.