Dalton/LSDalton 2020.1 Installation Guide

• Supported platforms and compilers
• Basic installation
  • General
  • Basics
  • Typical examples
  • What to do if CMake is not available or too old?
• Installation instructions for system administrators
• Linking to math libraries
  • General
  • Intel/MKL
  • Cray
  • Explicitly specifying BLAS and LAPACK libraries
  • Builtin BLAS and LAPACK implementation
  • LSDalton using ScaLAPACK/Intel/MKL
• Scratch directory
• Basis set directory
• Testing the installation
  • Environment variables for testing
  • Running the test set
• Expert options
  • Compiling in verbose mode
  • How can I change optimization flags?
• How you can contribute to this documentation
  • How to modify the webpages
  • How to locally test changes