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sci-physics/gpaw

GPAW is a density-functional theory (DFT) Python code based on the projector-augmented wave (PAW) method and the atomic simulation environment (ASE)

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  • gpaw-21.6.0
    ~amd64
    +setups +fftw mpi scalapack vdwxc elpa python_targets_python3_8 python_targets_python3_9

    View      Download      Browse     License: GPL-3   
    Overlay: phackerlay