Movies from molecular dynamics simulations of the Kirchner group

Movies from molecular dynamics simulations of the Kirchner group.

Contents

• Simple argon simulation: few interactions, simple dynamics
  Argon (1.6 MB)
• Spontaneous ionic liquid channel formation between TiO2 surfaces
  IL channel between TiO₂ surfaces (45 MB)
• Potential vaporization mechanism of [Emim][EtSO4] (Slab simulation):
  [Emim][EtSO4] (21 MB)
• Radical elimination of the phenol OH-hydrogen atom by a CH₃-radical in [Emim][EtSO4]:
  Phenol+CH₃ (16 MB)
• Electrostatic potential from a metadynamics trajectory plotted on the electron density. Comparison of a molecule in gas phase and in solution:
  electrostatic_potential (21 MB)
• Molecular dynamics simulation of water (128 molecules):
  water (10 MB)
  water (103 MB)
• Synthesis of Te₂Br:
  movie (79 MB)
• Activation of CO₂ in an ionic liquid:
  EmimGly4CO2-2.mp4 (52 MB)
emimgly4co2.mp4 (38 MB)