Molecular dynamics of dissolution of a 36-chain cellulose Iβ microfibril at different temperatures above the critical pressure of water
J. Lange, Frederico W. Tavares, Argimiro R. Secchi, Iuri Soter Viana Segtovich
Topics & Concepts
DissolutionMolecular dynamicsCelluloseMicrofibrilChemistryThermodynamicsWater modelLignocellulosic biomassChemical physicsChemical engineeringMaterials scienceComputational chemistryOrganic chemistryPhysicsEngineeringLignin and Wood ChemistrySubcritical and Supercritical Water ProcessesBiofuel production and bioconversion