Revisiting the structure, interaction, and dynamical property of ionic liquid from the deep learning force field
Yulong Ling, Kun Li, Mi Wang, Junfeng Lu, Chenlu Wang, Yanlei Wang, Hongyan He
Topics & Concepts
Force field (fiction)Ionic liquidMolecular dynamicsAb initioWork (physics)Potential energyHydrogen bondChemical physicsDensity functional theoryField (mathematics)ChemistryComputational chemistryComputer scienceMaterials scienceMoleculeArtificial intelligencePhysicsAtomic physicsThermodynamicsMathematicsBiochemistryOrganic chemistryCatalysisPure mathematicsIonic liquids properties and applicationsSupercapacitor Materials and FabricationMachine Learning in Materials Science