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Thermal Rate Coefficients via Variational Transition State Theory for the Unimolecular Decomposition/Isomerization of 1-Pentyl Radical: Ab Initio and Direct Dynamics Calculations
Jitariu, Luminita C., Jones, Lee D., Robertson, Struan H., Pilling, Michael J., Hillier, Ian H.Volume:
107
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp034843z
Date:
October, 2003
File:
PDF, 258 KB
english, 2003