Skip to content

Brainstorming #36

@jan-janssen

Description

@jan-janssen
  • Transfer convergence checks from one materials property to another, e.g. the dependence on the energy cutoff and kpoint mesh.
  • Collaboration with experiment
  • Teaching - give students easy access to simulation.
  • Collect expert knowledge for specific calculation e.g. VASP input files.
  • Write a custodian for quantum espresso - maybe analyse a heterogeneous database like Nomad.

Metadata

Metadata

Assignees

No one assigned

    Labels

    No labels
    No labels

    Projects

    No projects

    Milestone

    No milestone

    Relationships

    None yet

    Development

    No branches or pull requests

    Issue actions