Closed stepan-tsirkin closed 4 months ago
@MIraola , I guess the basic idea of this PR is implemented in your #70 , but much more elaborated, right?
So we can close this old PR forever now?
Yes, I think that it is implemented in #70, so I think we might close this PR.
The idea is to allow reading of wavefunctuions and returning the arra in
Kpoint.getWF()
without storing it in the class. This way we save memory. We do not loose much speed because in a typical usage the WFs will be read only once anyway. So far implemented only for vasp and QE, but for other codes the old behaviour still works.Any comments?
This is compatible with the following PR of banduppy