dalton-installation
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  • Supported platforms and compilers
  • Basic installation
  • Installation instructions for system administrators
  • Linking to math libraries
  • Scratch directory
  • Basis set directory
  • Testing the installation
  • Expert options
  • How you can contribute to this documentation
dalton-installation
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  • Dalton/LSDalton 2020.1 Installation Guide
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Dalton/LSDalton 2020.1 Installation GuideΒΆ

  • 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
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