MIT

Capturing aromaticity in automatic mechanism generation software

Submitted on

Wed, 2019-06-05 12:05

Title

Capturing aromaticity in automatic mechanism generation software

Publication Type

Journal Article

Year of Publication

2019

Authors

Journal

Proceedings of the Combustion Institute

Volume

37

Pagination

575 – 581

Keywords

Aromaticity, Automatic mechanism generation, Chemical kinetics, Clar structures, Polycyclic aromatic hydrocarbons

DOI

http://dx.doi.org/https://doi.org/10.1016/j.proci.2018.06.006

URL

http://www.sciencedirect.com/science/article/pii/S1540748918301883