DFT and beyond within the projector-augmented wave method
DescriptionA density-functional theory (DFT) Python code based on the projector-augmented wave (PAW) method and the atomic simulation environment (ASE). It uses real-space uniform grids and multigrid methods, atom-centered basis-functions or plane-waves.
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Install this software package
If the package is available for the distribution you are currently using on your computer then install the software by clicking on…Install gpaw