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Volumn 104, Issue , 2013, Pages 368-376

Theoretical investigations on vibrational spectra of pillar[5]arene- bis(pyridinium) complexes

Author keywords

Bis(pyridinium) guests; Density functional theory; Pillar 5 arene; Vibrational spectra

Indexed keywords

ALKYL CHAIN; BLUE SHIFT; INTERACTION ENERGIES; PILLAR[5]ARENE; PYRIDINIUM; THEORETICAL INVESTIGATIONS;

EID: 84871455431     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2012.11.074     Document Type: Article
Times cited : (13)

References (28)
  • 21
    • 33750559983 scopus 로고    scopus 로고
    • Semiempirical GGA-type density functional constructed with a long-range dispersion correction
    • DOI 10.1002/jcc.20495
    • S. Grimme Semiempirical GGA-type density functional constructed with a long-range dispersion correction J. Comput. Chem. 27 2006 1787 1799 (Pubitemid 44672561)
    • (2006) Journal of Computational Chemistry , vol.27 , Issue.15 , pp. 1787-1799
    • Grimme, S.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.