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strucscan: A lightweight Python-based framework for high-throughput material simulation
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published Published 4 months ago
NuclearToolkit.jl: A Julia package for nuclear structure calculations
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published Published over 1 year ago
optimade-python-tools: a Python library for serving and consuming materials data via OPTIMADE APIs
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published Published over 1 year ago
J2suscep: Calculation of magnetic exchange coupling and temperature dependence of magnetic susceptibility
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FHI-vibes: Ab Initio Vibrational Simulations
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matador: a Python library for analysing, curating and performing high-throughput density-functional theory calculations
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published Published over 4 years ago
sumo: Command-line tools for plotting and analysis of periodic *ab initio* calculations
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published Published almost 5 years ago