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Volumn 134, Issue 2, 2011, Pages

Addition of one and two units of C2H to styrene: A theoretical study of the C10H9 and C12H9 systems and implications toward growth of polycyclic aromatic hydrocarbons at low temperatures

Author keywords

[No Author keywords available]

Indexed keywords

1-HEXENE; AB INITIO; AROMATIC RINGS; BRANCHING RATIO; DOMINANT PRODUCT; ETHYNYL; ETHYNYL RADICALS; EXOTHERMICITY; INTERSTELLAR MEDIUMS; LOW TEMPERATURE GROWTH; LOW TEMPERATURES; NAPHTHALENE DERIVATIVES; PRODUCT BRANCHING RATIOS; REACTION CHANNELS; RING CLOSURES; RRKM CALCULATIONS; SIDE CHAINS; SINGLE-COLLISION; THEORETICAL STUDY; TITAN'S ATMOSPHERE; TRANSITION STATE; VERY LOW TEMPERATURES;

EID: 78751537909     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3526957     Document Type: Article
Times cited : (19)

References (56)
  • 39
    • 78751540761 scopus 로고    scopus 로고
    • designed by H. J. Werner and P. J. Knowles, version, 6, R. D. Amos, A. Bernhardsson, A. Berning et al
    • MOLPRO, a package of ab initio designed by H. J. Werner and P. J. Knowles, version 2002.6, R. D. Amos, A. Bernhardsson, A. Berning et al.
    • (2002) MOLPRO, A Package of Ab Initio
  • 40
    • 78751486270 scopus 로고    scopus 로고
    • See supplementary material at http://dx.doi.org/10.1063/1.3526957 for optimized Cartesian coordinates, energetic, and molecular parameters, including rotational constants and vibrational frequencies, of various structures (Table S1) and RRKM calculated rate constants of various unimolecular reactions (Table S2).
  • 53
    • 78751484820 scopus 로고    scopus 로고
    • Registry Numbers: 90766-20-4 and 13633-26-6
    • Atomax Chemicals Product List; http://www.atomaxchem.com, Registry Numbers: 90766-20-4 and 13633-26-6.
    • Atomax Chemicals Product List


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.