Molecular dynamics study with COMPASS II forcefield on nucleation and growth mechanism of sodium chloride in supercritical water
Xujun Li, Jingli Sun, Xueying Wei, Linhu Li, Hui Jin, Liejin Guo
Topics & Concepts
NucleationSupercritical fluidMolecular dynamicsChemical physicsSodiumIonic bondingChemical engineeringSalt (chemistry)ChemistryIonChlorideMaterials sciencePhysical chemistryComputational chemistryOrganic chemistryEngineeringSubcritical and Supercritical Water Processesnanoparticles nucleation surface interactionsSpectroscopy and Quantum Chemical Studies