atomistic mlecular dynamics

Thursday, March 1, 2018 - 9:00am - 9:50am
Claudio Zannoni (Universita Di Bologna)
Predicting realistic morphologies and molecular organizations from chemical structure is far from easy and indeed has only recently proved doable by atomistic molecular dynamics. The issue is further complicated in thin films, where the material is strongly affected by surface interactions, even if obtaining information on alignment and anchoring is essential to optimize the specific interfacial orientations required for different applications (e.g. Field Effect Transistors, or Organic Solar Cells or Nano-Photonic devices).
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