Movies from molecular dynamics simulations of the Kirchner group.

 

    • 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)