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feature_plan.md

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Current planned features

  • Dashboard
  • current, pending, completed jobs, cluster status
  • Calculation explorer
  • Look through completed calcs. Explore parameters
  • Calculation report
  • See in a glance lots of data.
  • Calcuation timeline
  • Digest PW.X output into a calculational timeline
  • Cluster management
  • jobscript creation, more dynamic stuff, better management of workflow
  • Data management
  • Structure database
  • Materials project API
  • Calc output database