ltalirz / atomistic-software Star 19 Code Issues Pull requests Tracking citations of atomistic simulation engines molecular-dynamics density-functional-theory tight-binding quantum-chemistry atomistic-simulations quantum-monte-carlo electronic-structure force-fields atomistic-simulation-engine Updated Sep 23, 2024 JavaScript
seatonullberg / velvet Star 10 Code Issues Pull requests [WIP] Classical atomistic simulation engine with a focus on user-friendliness and extensibility chemistry simulation physics molecular-dynamics computational-chemistry materials-science atomistic-simulation-engine Updated Aug 8, 2023 Rust