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150 followers · 499 following

Achievements

Achievement: Pair Extraordinairex2Achievement: QuickdrawAchievement: YOLOAchievement: StarstruckAchievement: Pull Sharkx4Achievement: Public SponsorAchievement: Arctic Code Vault Contributor

Achievements

Achievement: Pair Extraordinairex2Achievement: QuickdrawAchievement: YOLOAchievement: StarstruckAchievement: Pull Sharkx4Achievement: Public SponsorAchievement: Arctic Code Vault Contributor

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@MineralsCloud

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singularitti/README.md

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  1. MineralsCloud/qha MineralsCloud/qha Public

    A Python package for calculating thermodynamic properties under quasi-harmonic approximation, using data from ab-initio calculations

    Python 27 14

  2. vscode-julia-formatter vscode-julia-formatter Public archive

    [DEPRECATED] A formatter for the Julia language powered by JuliaFormatter.jl

    TypeScript 38 7

  3. MineralsCloud/Express.jl MineralsCloud/Express.jl Public

    Express: a high-level, extensible workflow framework for accelerating ab initio calculations for the materials science community

    Julia 25 1

  4. MineralsCloud/QuantumESPRESSOBase.jl MineralsCloud/QuantumESPRESSOBase.jl Public

    Provides basic data structures and helpful functions for manipulating structures, generating input files, pre-running error checks, etc.

    Julia 14

  5. MineralsCloud/elastic-stability-conditions MineralsCloud/elastic-stability-conditions Public

    A Python package that can verify the necessary and sufficient elastic stability conditions in various crystal systems

    Python 8 1

  6. IterUtils.jl IterUtils.jl Public

    Some useful tools I used for iteration stuff during development

    Julia