Strength analysis of noncovalent interactions between lignite and direct liquefaction solvents: A joint study of DFT calculations and swelling ratio determination
Ranran Hou, Yuchi Wei, Zongqing Bai, Zhihao Feng, Zhenxing Guo, Lingxue Kong, Jin Bai, Wen Li
Topics & Concepts
Non-covalent interactionsChemistrySwellingHydrogen bondStackingNaphthaleneDensity functional theoryAromaticityInteraction energyBenzeneIndaneComputational chemistryOrganic chemistryMaterials scienceMoleculeComposite materialThermochemical Biomass Conversion ProcessesLignin and Wood ChemistryCoal Properties and Utilization