Does the presence of lignin affect the pyrolytic decomposition of cellulose? A condensed phase computational investigation

Author:

Padmanathan Arul Mozhi Devan1ORCID,Vaidya Rahul1,Mushrif Samir H.1ORCID

Affiliation:

1. Department of Chemical and Materials Engineering, University of Alberta, 9211-116 Street Northwest, Edmonton, Alberta T6G 1H9, Canada

Abstract

Finite temperature condensed phase effects offer new perspectives on cellulose activation. Barriers decreases mildly, rapidly, and remains constant in pure cellobiose, LCC, and lignin condensed phases, respectively.

Funder

Alliance de recherche numérique du Canada

Canada First Research Excellence Fund

Natural Sciences and Engineering Research Council of Canada

University of Alberta

Publisher

Royal Society of Chemistry (RSC)

Subject

Energy Engineering and Power Technology,Fuel Technology,Renewable Energy, Sustainability and the Environment

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