Ab initio study of C4H3 potential energy surface and reaction of ground-state carbon atom with propargyl radical

Journal of Computational Chemistry

Volumn 22, Issue 13, 2001, Pages 1522-1535

  Trung Ngoc, L E ^a,b,c,d   Mebel, Alexander M ^a,b,c,d   Kaiser, Ralf I ^a,b,c,d  

^a INSTITUTE OF ATOMIC AND MOLECULAR SCIENCES   (Taiwan)

^b THE UNIVERSITY OF DANANG   (Viet Nam)

^c NATIONAL TAIWAN UNIVERSITY   (Taiwan)

^d UNIVERSITY OF YORK   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 20644453967     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.1105     Document Type: Article

References (3)

1. Herbst, E.; Lee, H. H.; Howe, D. A.; Millar, T. J. Mon Not R Astron Soc 1994, 268, 335.
2. (a) Kaiser, R. I.; Ochsenfeld, C.; Head-Gordon, M.; Lee, Y. T.; Suits, A. G. Science 1996, 274, 1508;
3. (b) Ochsenfeld, C.; Kaiser, R. I.; Suits, A. G.; Lee, Y. T.; Head-Gordon, M. J Chem Phys 1997, 106, 4141.