Alexander Spears

Results 17 comments of Alexander Spears

Leaving this here for implementation: https://stackoverflow.com/questions/75667638/having-a-slurm-job-check-how-long-until-itself-ends

Alternative idea: We could check how long a simulation has run and if it is terminated, we could make it dump the DiffEq `sol` objects to a jld2 file. This...

Don't merge until dependent PRs are merged. Unit tests checked working on my laptop since CI pulls versions without required functionality.

@wgst update loading and saving friction models

> Make friction tensors Symmetric type, this will simplify representation of data. Since we're using the LAPACK functions to solve the eigenvalue problem in the MDEF integrator, we would have...

@reinimaurer1 has started us off with a centre of mass translation for VelocityBoltzmann: https://github.com/NQCD/NQCDistributions.jl/pull/11

@reinimaurer1 Do I remember correctly that you'd finished implementing an updated Wigner distribution?

@Snowd1n is this related to what you mentioned about RNG yesterday?

I think this would be easy to include in a "formal" way by creating constructors for `DynamicalDistribution`s that take an `AbstractSimulation` subtype as input. That way, we could check `NQCModels.mobileatoms()`...