Home Forums density functional theory XC-functional Functional Jacob’s lader

Viewing 1 post (of 1 total)
  • Author
    Posts
  • #14076
    Jules
    Participant

    According to the perspective “In pursuit of the divine functional”, the Jacob’s ladder in the context of XC functionals is a route of improvement starting from the LDA on the first rung and ending with the divine functional on the fifth rung. Each rung higher than the LDA adds features to the previous rung in a similar was as that GGA adds the feature of assessing density gradients to the use of local gradients in LDA.

Viewing 1 post (of 1 total)
  • You must be logged in to reply to this topic.
Scroll to Top