Implementation¶

Here we are going to cover the basics of how the different modules of iDEA are implemented.

  • What’s the big iDEA?
  • EXT (Exact)
    • Calculating the ground-state
    • Time-dependence
    • One-electron systems
  • RE (Reverse-Engineering)
    • Ground-state Kohn-Sham potential
    • Time-dependent Kohn-Sham potential
  • LDA (Local Density Approximation)
    • Calculating the ground-state
    • Time-dependence
    • References
  • HF (Hartree–Fock)
    • Calculating the ground state
    • Time-dependence
  • HYB (Hybrid)
    • Calculating the ground state
    • Time-dependence
  • NON (non-interacting)
    • Calculating the ground-state
    • Time-dependence

Logo

  • Using iDEA
  • Examples
  • Theory
  • Implementation
    • What’s the big iDEA?
    • EXT (Exact)
    • RE (Reverse-Engineering)
    • LDA (Local Density Approximation)
    • HF (Hartree–Fock)
    • HYB (Hybrid)
    • NON (non-interacting)
  • Developers
  • API documentation

Quick search

©2010 - 2018, the iDEA contributors. | Powered by Sphinx 1.8.5 & Alabaster 0.7.12 | Page source