The Jayaraman research group is based at University of Colorado, Boulder and headed by Prof. Arthi Jayaraman. Our research interests lie in understanding molecular-level phenomena governing complex biological processes and material science problems using theoretical and simulation techniques.

Current Focus

  • Functionalized Nanoparticles and Polymer Nanocomposites
  • Organic Photovoltaics
  • Biomaterials
These are investigated using computer simulations and theoretical methods, such as:
  • Molecular dynamics simulations
  • Monte Carlo simulations
  • Polymer Reference Interaction Site Model (PRISM) theory
  • Brownian dynamics simulations


We are grateful to the following sources for funding our research:

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