Nick Papior

@jonaslb yes, that is true, however, the problem is that the object `Cell` (old `SuperCell`) has many methods allowing to extract information such as `sc.fit` etc. and many functionalities requires...

@juijan thanks for your take on this!

I am beginning to be more keen on using `Lattice`, it is short! :+1:

Ah great with the overloads. Yes! So long as code + doc isn't duplicated, I am fine! Yeah, I also thought about dispatchers... But perhaps let's wait with that.

I guess it could be done. It seems that all necessary ingredients are present. I haven't fully close read the paper. It seems to me that Eq. (1) is the...

Yes. That is H and S matrix elements. Note that in sisl you can use either of the gauges.

@sofiasanz if you feel like it it would be nice if this thread gets updated with information regarding a future Slater-Koster implementation. In example it would be nice to collect...

@sofiasanz Great!! Thanks for putting the effort to add it here! This will be a nice example to take into account when doing the final thing.

Sounds like a good idea. However, it may be a bit excessive with progress bars all the time. I think it would be ideal to have a context manager that...

I'll have a go at this asap