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Molly.jl Public
Molecular simulation in Julia
JuliaMolSim/Molly.jl’s past year of commit activity
Julia 426 56 8 (1 issue needs help) 3 UpdatedMar 17, 2025
DFTK.jl Public
Density-functional toolkit
JuliaMolSim/DFTK.jl’s past year of commit activity
Julia 466MIT 92 84 (7 issues need help) 25 UpdatedMar 16, 2025
Atomistic.jl Public
JuliaMolSim "umbrella" package that re-exports multiple core ecosystem packages.
JuliaMolSim/Atomistic.jl’s past year of commit activity
Julia0MIT0 1 1 UpdatedFeb 18, 2025
AtomsBuilder.jl Public
Convenient building of atomic structures
JuliaMolSim/AtomsBuilder.jl’s past year of commit activity
Julia 6MIT 2 3 0 UpdatedJan 30, 2025
JuliaMolSim.github.io Public
The website of the JuliaMolSim organisation
JuliaMolSim/JuliaMolSim.github.io’s past year of commit activity
JavaScript 5 4 0 0 UpdatedJan 29, 2025
AtomsBase.jl Public
A Julian abstract interface for atomic structures.
JuliaMolSim/AtomsBase.jl’s past year of commit activity
Julia 88MIT 20 30 3 UpdatedJan 26, 2025
NeighbourLists.jl Public
neighbour list for particle simulations based on matscipy
JuliaMolSim/NeighbourLists.jl’s past year of commit activity
Julia 11 3 13 0 UpdatedJan 13, 2025
GeometryOptimization.jl Public
Geometry optimization for molecular simulation
JuliaMolSim/GeometryOptimization.jl’s past year of commit activity
Julia 7MIT0 3 3 UpdatedJan 2, 2025
PseudoPotentialData.jl Public
Use standard solid-state pseudopotentials in Julia
JuliaMolSim/PseudoPotentialData.jl’s past year of commit activity
Julia 1MIT0 0 0 UpdatedDec 30, 2024
PseudoLibrary Public
Repository to host tarballs of standard pseudopotential libraries
JuliaMolSim/PseudoLibrary’s past year of commit activity
Julia 5 4 1 0 UpdatedDec 29, 2024