aiidateam/aiida-wannier90

Incorrect projection when radial_nodes is None but diffusivity is not

Closed this issue · 4 comments

zona will take the place of radial, which gives means the wrong projection is used

I fixed the issue, but it still needs testing.

Hi @greschd, just to know about this issue: is this issue now fixed in the code, or not yet?

We are planning a beta release hopefully in 2 weeks, to be ready for the Wannier workshop in late March, so we know if we need to check this or it's already fixed. Thanks!

I kind of forgot what this issue was exactly, but digging through the commit history I think this change fixed it: 0b5d8fe

So it seems this is indeed fixed in the code, but would still be great to test.

We are planning a beta release hopefully in 2 weeks

let's finish things up at the hackathon?