Your friendly organisation about molecular simulations in Julia. We're currently working on setting up this website. You can also check us out on GitHub!
Feel free to have a look at some of our projects:
ACEpotentials.jl: Interatomic potential learning using the Atomic cluster expansion; see also ACEsuit for related packages.
AtomsBase.jl: A Julian abstract interface for atomic structures.
DFTK.jl: A flexible code for density-functional theory simulations
Molly.jl: Molecular simulation in Julia
JuLIP.jl: Julia Library for Interatomic Potentials
Libxc.jl: Julia bindings to the libxc library for exchange-correlation functionals
Get involved in ongoing conversations by joining our #juliamolsim channel on the Julia Slack!