Insights into the co-pyrolysis interaction of cellulose and Zhundong coal via ReaxFF molecular dynamics simulation
Xulinjia Liu, Zimeng Liu, Bang Wu, Бо Лю, Xin Guo
Topics & Concepts
ReaxFFPyrolysisMolecular dynamicsCelluloseCoalChemical engineeringChemistryMaterials scienceOrganic chemistryComputational chemistryEngineeringInteratomic potentialThermochemical Biomass Conversion ProcessesLignin and Wood Chemistryactivated carbon and charcoal