All Stories

  1. Ion association and hydrogen bonding in potassium dihydrogen phosphate solutions: Insights from molecular dynamics simulations
  2. Understanding why constant energy or constant temperature may affect nucleation behavior in MD simulations: A study of gas hydrate nucleation
  3. The nucleation of gas hydrates near silica surfaces
  4. Anisotropy in the crystal growth of hexagonal ice, Ih
  5. Coupling of translational and rotational motion in chiral liquids in electromagnetic and circularly polarised electric fields
  6. Transport coefficients of the TIP4P-2005 water model
  7. Isoconfigurational molecular dynamics study of the kinetics of ice crystal growth
  8. Hydroxyl radicals in ice: insights into local structure and dynamics
  9. Crystal growth investigations of ice/water interfaces from molecular dynamics simulations: Profile functions and average properties
  10. Crystal growth simulations of methane hydrates in the presence of silica surfaces
  11. Exploring nucleation of H2S hydrates
  12. Observation of two-step nucleation in methane hydrates