Tutorials

Tutorials to help user in the understanding of the use of AiiDA and the tools delivered within the aiida-siesta package.

• 2020, ICN2, Barcelona, Spain
  • Installation
  • Setting up the AiiDA profile
  • Computer and code setup
  • Creating a pseudo family
  • Submit a single siesta calculation
  • Protocols
  • Using jupyter in the Quantum Mobile VM
  • Run a convergence workflow
  • Create a WorkChain
  • Setting up the hpcq