2018 AIChE Annual Meeting

(6bt) High-Throughput Catalysts Screening of Layered Double Hydroxides for Oxygen Evolution and Reduction Reactions

Authors

Zhao, Z. - Presenter, Stanford University
Nørskov, J., Stanford University
Bajdich, M., SLAC STANFORD
Kulkarni, A. R., Georgia Institute of Technology
Research Interests:

  1. Computational materials science for catalysts screening
  2. Machine learning algorithm for descriptor screening and designing
  3. Collaboration with experimental groups to provide theoretical evaluations for electrochemical, electro-optical and other functional applications.
  4. DFT functionals and tools development for scientific purposes

    5. Teaching Interests:

    • Fundamentals of Materials Science and Engineering
    • Computational Materials Science
    • Heterogeneous Catalysis
    • Sustainable Energy Technology
    • Electrochemistry