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Recent advances in molecular dynamics simulation of the N-A-S-H geopolymer system: modeling, structural analysis, and dynamics

Ling-Yu Xu, Yazan Alrefaei, Yanshuai Wang, Jian‐Guo Dai

2021Construction and Building Materials100 citationsDOI

Topics & Concepts

GeopolymerMolecular dynamicsMaterials scienceHydrateMolecular modelSodium silicateAmorphous solidAluminateNanotechnologyComputational chemistryChemistryMetallurgyComposite materialOrganic chemistryCompressive strengthCementConcrete and Cement Materials ResearchBuilding materials and conservationCO2 Sequestration and Geologic Interactions
Recent advances in molecular dynamics simulation of the N-A-S-H geopolymer system: modeling, structural analysis, and dynamics | Litcius