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Volumn 106, Issue 41, 2002, Pages 9512-9519

Controlled alcohol-ketone interconversion by dihydrogen transfer: An ab initio study of the methanol-formaldehyde complex

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEXATION; FORMALDEHYDE; GROUND STATE; HYDROGEN BONDS; KETONES; MOLECULAR STRUCTURE; PURIFICATION;

EID: 0037126413     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp020689p     Document Type: Article
Times cited : (13)

References (69)
  • 47
    • 0001869942 scopus 로고
    • Gaussian basis sets for molecular calculations
    • Schaefer, H. F., Ed.; Plenum Press: New York, London
    • Dunning, T.; Hay, P. Gaussian basis sets for molecular calculations. In Modern theoretical chemistry; Schaefer, H. F., Ed.; Plenum Press: New York, London, 1977; p 1.
    • (1977) Modern Theoretical Chemistry , pp. 1
    • Dunning, T.1    Hay, P.2
  • 56
    • 0006723887 scopus 로고
    • Accurate calculations and calibration
    • Roos, B., Ed.; Springer-Verlag: Berlin
    • Taylor, P. R. Accurate calculations and calibration. In Lecture Notes in Quantum Chemistry; Roos, B., Ed.; Springer-Verlag: Berlin, 1992, Vol. 58.
    • (1992) Lecture Notes in Quantum Chemistry , vol.58
    • Taylor, P.R.1
  • 69
    • 0000580127 scopus 로고
    • Localized atomic and molecular orbitals III
    • Löwdin, P. O., Ed.; Academic Press: New York, London
    • Edmiston, C.; Ruedenberg, K. Localized atomic and molecular orbitals III. In Quantum Theory of atoms, molecules, & Solid State; Löwdin, P. O., Ed.; Academic Press: New York, London, 1966; p 263.
    • (1966) Quantum Theory of Atoms, Molecules, & Solid State , pp. 263
    • Edmiston, C.1    Ruedenberg, K.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.