@article {12, title = {Ab Initio screening approach for the discovery of lignin polymer breaking pathways}, journal = {J. Phys. Chem. A}, volume = {119}, year = {2015}, pages = {6551}, chapter = {6551}, doi = {https://doi.org/10.1021/acs.jpca.5b03503}, url = {https://pubs.acs.org/doi/abs/10.1021/acs.jpca.5b03503}, author = {Mar, Brendan D and Qi, Helena W and Liu, Fang and Kulik, Heather J} }