You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
Thank you for reporting the issue. Indeed, it seems to be a bug in the Brillouin zone calculation, specifically in cases where the angle between lattice vectors is obtuse. I have just committed some changes in a3aee7f which should make this calculation more robust and fix the problem.
That fix is committed in the master branch, so you would need to compile the latest version from source code. This can be a bit more complicated than the normal install, but instruction on how to do that are here: Compiling from source. Note that the documentation has two versions: 1. stable (currently v0.8.0) and 2. latest (following the master branch).
Alternatively, you can wait for the release of the next version (v0.8.1) which will use the regular install procedure. I'm planning to add a few more bug fixes and release that soon.