atomsk

Atomsk: A Tool For Manipulating And Converting Atomic Data Files -

Fortran★ 252

ab-initioatomeyeatomic-designatomistic-simulationscheminformaticscifcrystal-builderdislocation

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pyiron

pyiron - an integrated development environment (IDE) for computational materials science.

Jupyter Notebook★ 459

ab-initioasedevelopment-environmentdfthdf5idelammpsmolecular-dynamics

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