Andrew S. Rosen
Andrew S. Rosen
Just to clarify for my own notes too: This is really only relevant if `LAPSH = True`.
(Note: I've edited my comment now that I understand what is going on.) Regarding this PR and #2021 by @mdforti, I believe VASP might have changed how the EIGENVAL file...
Zeo++ and its related tools have moved around a bit over time. The current version of Zeo++ can be found [here](http://www.zeoplusplus.org/download.html) and Voro++ [here](https://github.com/chr1shr/voro.git). However, I'm pretty sure that Zeo++...
@mkhorton -- looks like I closed this one in https://github.com/materialsproject/pymatgen/pull/2400.
Hi @bocklund, I think this can be resolved by using the `Structure.add_site_property()` function, which is the preferred method of adding magnetic moments (and other site properties, like selective dynamics). I...
I think this is a reasonable point. I would like to see the ability to do as you suggested because it is, arguably, the most intuitive route. I won't be...
@mkhorton -- I think this can be closed, but it's worth considering if a separate issue should be opened to address the pain point that @bocklund brought up.
I can confirm this is no longer an issue.
Oh, had no idea! I ended up hacking it by just adding it to the pre-rocket. Thanks! If this isn't in the docs, it should be added then.
We probably don't want to add pytest as a requirement and should fix the source of the issue instead. @janosh, this seems related to a change you recently made, right?