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Volumn 108, Issue 35, 2004, Pages 7272-7280

Vibrational interactions in the amide I subspace of The oligomers and hydration clusters of N-methylacetamide

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO MOLECULAR ORBITAL (MO) CALCULATIONS; CHARGE RESPONSE KERNEL; TRANSITION DIPOLE COUPLING (TDC); VIBRATIONAL FREQUENCIES;

EID: 4444333478     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp048320i     Document Type: Article
Times cited : (57)

References (57)
  • 2
    • 0002663180 scopus 로고
    • Clark, R. J. H., Hester, R. E., Eds.; Advances in Spectroscopy, Wiley: New York
    • Mantsch, H. H.: Casal, H. L.; Jones, R. N. In Spectroscopy of Biological Systems; Clark, R. J. H., Hester, R. E., Eds.; Advances in Spectroscopy, Vol. 13; Wiley: New York, 1986; p 1.
    • (1986) Spectroscopy of Biological Systems , vol.13 , pp. 1
    • Mantsch, H.H.1    Casal, H.L.2    Jones, R.N.3
  • 42
    • 4444372013 scopus 로고    scopus 로고
    • note
    • 1 accompanies a stretching (not shrinking) of the C=O bond.
  • 45
    • 4444309145 scopus 로고    scopus 로고
    • note
    • As shown in the above derivation of the F matrix in the vibrational subspace, the basis coordinates are weighted by the square root of atomic masses. This means that the F matrix elements in the vibrational subspace vary upon isotopic substitution, in contrast to the "force constants" in their usual meaning.
  • 52
    • 0041935455 scopus 로고
    • Doyama, M., Kihara, J., Tanaka, M., Yamamoto, R., Eds.; Elsevier: Amsterdam
    • Torii, H.; Tasumi, M. In Computer Aided Innovation of New Materials II; Doyama, M., Kihara, J., Tanaka, M., Yamamoto, R., Eds.; Elsevier: Amsterdam, 1993; p 1287.
    • (1993) Computer Aided Innovation of New Materials II , pp. 1287
    • Torii, H.1    Tasumi, M.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.