The effects of calcium content on molecular structure and mechanical properties of sodium aluminosilicate hydrate (NASH) gels by molecular dynamics simulation
Rui Wang, Jingsong Wang
Topics & Concepts
Molecular dynamicsSodium aluminosilicateMean squared displacementMaterials scienceCalciumElastic modulusBond lengthSodiumCalcium aluminosilicateRadial distribution functionHydrateAluminosilicateThermodynamicsChemistryMoleculeComposite materialComputational chemistryOrganic chemistryMetallurgyCatalysisPhysicsMethane Hydrates and Related PhenomenaAerogels and thermal insulationHydrogels: synthesis, properties, applications