Christoph Ortner

How many people use isotopes right now with AtomsBase?

I would like to revive the idea to allow working unitless. I think this is a strange and unnecessary restriction that will put off potential users. Looking through the code,...

I don't think it's really about performance. And I don't think there need to be different interface functions. All it needs is that definitions like ```julia struct Atom{D, L

No. I would not return unitful quantities, that's the entire point. And I am strongly opposed (for now) to introducing new interface functions that do the ustrip thing. The point...

~~I disagree with that.~~ I don't see the problem. If your package requires units then it will simply fail with an error message if a unitless quantity is returned.

I'm sorry but I don't get it. That user should simply use units in their workflow.

In the next 1-2 weeks I will produce an example how to create much more flexible systems using `DecoratedParticles.jl` or some to be developed variant of this package. This will...

@ejmeitz -- please take a look at `DecoratedParticles.jl`, it can easily do what you want. At the moment it is still a little experimental but as soon as there are...

Update on this PR?

Looking at old PRs. Is this to be revived, or should we just have a discussion at the molssi workshop about constructor and updator interfaces?