Giovanni Pizzi
Giovanni Pizzi
Hi, at the moment even if the splitting is not done automatically, I would like to stop as an error if the line is too long, and switching this on...
I see your point, but at the moment the indentation is wrong and until this issue is fixed we get a "wrong" output... a person can easily split and run...
Never mind, I think I found a way to do this directly in my repo: https://github.com/giovannipizzi/wannier90/commit/01d1231e64f6d80a51054bc003fd0cac5fb9d98a
Maybe @yusukenomura can give some insight - possibly there is not fundamental problem?
I agree. Should we remove the section with the graph with the relations between the various modules in the docs (that is probably also a bit outdated) and just point...
I let @mostofi and @jryates comment, but (if confirmed, but I think you're right) I think that indeed having a sensible default for conv_tol and conv_window could be a good...
This is currently not implemented in the code. I think there is a modified version here: https://archive.materialscloud.org/record/2020.167 - it would be great if someone would be willing to convert those...
Some thoughts have been collected (quite some time ago, actually) on this [wiki page](https://github.com/wannier-developers/wannier90/wiki/LibraryIdeas).
Indeed, the plan for the new version is to avoid going through files. Briefly, the library mode was initially written as a convenience functionality, with a fixed API. As the...
While this is important, we're moving it to v3.1 while we are feature-freezing the code for 3.0