Leandro Martínez
Leandro Martínez
In version 0.8.23 the `PeriodicySystems` interface accepts any `AbstractVector{
On version 0.8.28 matrices are supported as input coordinates in the `PeriodicSystems` interface. Note that matrices cannot be resized, so the number of particles cannot change when using this. Missing...
Non-periodic systems will be supported in the high-level interface in v0.8.30 by simply not providing a `unitcell`, or setting `unitcell = nothing`. Because of this feature and other code rearrangements,...
That is not trivial, because the construction of the lists must run over particles. One has to check the cell for each particle, and then adding it to a list...
By the way, from what I remember of the presentation of Trixi.jl, the scalability you are getting with it is of another order of what CellListMap can deliver. So I'm...
Do you need periodic boundaries? Most of the complications here are to support triclinic PBCs.
Maybe helpful:  The issue with the scaling here is on the construction of the cell lists. The mapping scales well for systems large enough. However, with many cores, the...
Ah, I see, running over all cells to check which cells have to be updated can be multi-threaded, and then that can be useful. I think something like that can...
Do have already some instructions on how to use it? I'm certainly interested. (does it support already PBCs?)
I don't remember having tried reverse diff. I'll take a look at it asap.