Welcome to H-wave documentations!

Contents

• 1. What is H-wave?
  • 1.1. Introduction
  • 1.2. License
  • 1.3. Contributors
  • 1.4. Copyright
  • 1.5. Operating environment
  • 1.6. Reference
• 2. Basic usage
• 3. Coordinate-space UHF (UHFr)
  • 3.1. Tutorial
    • 3.1.1. Create a parameter file
    • 3.1.2. Create definition files for Hamiltonian
    • 3.1.3. Specify output components
    • 3.1.4. Run
  • 3.2. File specifications
    • 3.2.1. Parameter file
    • 3.2.2. Input files for UHFr
    • 3.2.3. Output files for UHFr
• 4. Wave-number space UHF (UHFk)
  • 4.1. Tutorial
    • 4.1.1. Create a parameter file
    • 4.1.2. Create interaction definition files
    • 4.1.3. Run
    • 4.1.4. Calculate density of state (hwave_dos)
  • 4.2. File specifications
    • 4.2.1. Parameter files
    • 4.2.2. Input files for UHFk
    • 4.2.3. Output files of UHFk
• 5. Random Phase Approximation (RPA)
  • 5.1. Tutorial
    • 5.1.1. Create a parameter file
    • 5.1.2. Create interaction definition files
    • 5.1.3. Run
  • 5.2. File specifications
    • 5.2.1. Parameter files
    • 5.2.2. Input files for RPA
    • 5.2.3. Output files of RPA
• 6. Algorithms
  • 6.1. Unrestricted Hartree-Fock method
    • 6.1.1. Overview
    • 6.1.2. Extension to wave-number space
  • 6.2. Random Phase Approximation
• 7. Acknowledgments
• 8. Appendix
  • 8.1. Generation of interaction files using StdFace library
    • 8.1.1. Compile StdFace library
    • 8.1.2. Run StdFace library
  • 8.2. List of error messages