Previous Article Next Article Table of Contents Journal of Physical Chemistry A, Vol.118, No.28, 5355-5357, 2014 DOI10.1021/jp505594b Export Citation Comparison of ReaxFF, DFTB, and DFT for Phenolic Pyrolysis. 1. Molecular Dynamics Simulations (Vol 117, pg 11115, 2013) Qi TT, Bauschlicher CW, Lawson JW, Desai TG, Reed EJ, Lenfant A Please enable JavaScript to view the comments powered by Disqus.