Molecular dynamics simulations on K2SO4 nucleation in supercritical water
Wanpeng Yang, Donghai Xu, Yunfei Diao, Jun Zhao, Zefeng Jing, Yang Guo
Topics & Concepts
Supercritical fluidNucleationMolecular dynamicsHydrogen bondChemical physicsChemistryDiffusionAtmospheric temperature rangeMoleculeIonBinding energyPhysical chemistryThermodynamicsComputational chemistryAtomic physicsOrganic chemistryPhysicsnanoparticles nucleation surface interactionsPhase Equilibria and ThermodynamicsSpectroscopy and Quantum Chemical Studies