Michele Ceriotti

Results 139 comments of Michele Ceriotti

Yes, I know what's happening. The labels are shown for all atoms in the unit cell, but are not replicated, nor subselected when the environment is highlighted.

This is now fully implemented cf #340 and #341

I'd go for librascal - it's a C++ library with python bindings and it's quite common to call c++ libraries libsomething. On Mon, 14 Jun 2021 at 14:46, Guillaume Fraux...

We have an external user who has been struggling for two days because of this. I'd say we need to act. I suggest s/rasca/librascal and put it on pipy ASAP....

Excellent. Can you do that? I'll then update all branches and side-projects: will be a couple of weeks of pain, but I think it's for the greater good.

Jolly good. On Thu, 9 Dec 2021 at 10:29, Guillaume Fraux ***@***.***> wrote: > Before making a release, I think we should re-license to LGPL-v2 or later ( > #303...

duck typing at its best ^_^ On Mon, 10 May 2021 at 17:48, Max Veit ***@***.***> wrote: > No, I deliberately chose a different name to make the switch to...

Is there a reason why ASE does it like that, or is it just a bug? What would be the rationale for not importing a module automatically? On Tue, 14...

Hi, gcc switched to a new standard - I tried a quick fix for that specific line so please try to pull. if that does not work, try to add...

@gtribello have a look and merge it if you think it is fine! http://anurags92.github.io/sketchmap/index.html?page=tuts&psub=landmarks