Implement LSDA
Closed this issue · 1 comments
aromanro commented
Probably this will not happen soon, but it's reasonably simple to implement.
aromanro commented
At this moment the code is not exposed in the UI and the implementation exists only for the non-uniform grid, but exposing in the UI and adding uniform grid are straightforward, so I'm closing this.
The results are close enough to the NIST values, even closer than I expected (due of the two coupled Schrodinger eqns, as opposed to the only one for LSD).