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Volumn 945, Issue 1-3, 2010, Pages 93-96

Odd-even oscillations in structural and optical properties of gold clusters

Author keywords

Au clusters; DFT calculations; Odd even effects; Optical properties; Woodward Fieser rules

Indexed keywords


EID: 77549084307     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2010.01.023     Document Type: Article
Times cited : (36)

References (42)
  • 28
    • 0003448734 scopus 로고
    • McGraw-Hill (For every double bond that extends conjugation, the absorbtion spectra is red-shifted by 30 nm with respect to the base-value of 214 nm for an acyclic diene.)
    • Williams D.H., and Fleming I. Spectroscopic Methods in Organic Chemistry. fifth ed. (1995), McGraw-Hill (For every double bond that extends conjugation, the absorbtion spectra is red-shifted by 30 nm with respect to the base-value of 214 nm for an acyclic diene.)
    • (1995) Spectroscopic Methods in Organic Chemistry. fifth ed.
    • Williams, D.H.1    Fleming, I.2
  • 32
    • 0038626673 scopus 로고    scopus 로고
    • Gaussian Inc., Wallingford, CT
    • Frisch M.J., et al. Gaussian 03 (2003), Gaussian Inc., Wallingford, CT
    • (2003) Gaussian 03
    • Frisch, M.J.1
  • 33
    • 77549086732 scopus 로고    scopus 로고
    • note
    • 19 amorphous (Ref. [8]) thus suggesting that non-local electron interactions are important in Au-clusters for search of minimal energy structures.
  • 34
    • 77549083219 scopus 로고    scopus 로고
    • note
    • As a proof of principles, additional calculations performed on cations and anions of these Au-clusters show the exactly opposite behavior. The charged odd-membered clusters are less polarizable than the even ones.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.