Tutorials

• 1) Enumerators
  • 1. Imports
  • 2. Downloading and modifying entries
  • 3. Running enumerators
    • a) Basic enumerators
      • What about open gases, liquids, etc.??
    • b) Minimize enumerators
      • Open entries
  • 4. Running enumerators with the jobflow package
  • 5. Conclusion
• 2) Networks
  • Author: Matthew McDermott (U.C. Berkeley / Lawerence Berkeley National Laboratory)
    • 1. Imports
    • Case Study: YMnO3 assisted metathesis
      • Background
    • 2. Acquiring thermodynamic data from the Materials Project
    • 3. Building the reaction network
    • 4. Identifying reaction pathways using pathfinding and balancing/solving
    • 5. Running networks with jobflow
  • Why use the NetworkFlowMaker?
    • 6. Conclusion