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pypi.org "DFTK" keyword

View the packages on the pypi.org package registry that are tagged with the "DFTK" keyword.

asedftk 0.2.7
DFTK-based calculator for ASE
15 versions - Latest release: over 4 years ago - 1 dependent repositories - 303 downloads last month - 2 stars on GitHub - 1 maintainer
Related Keywords
density-functional 1 theory 1 DFT 1 computational 1 chemistry 1 quantum 1 materials 1 science 1 electronic 1 structure 1 ab-initio 1 pseudopotential 1 analysis 1 ASE 1 ase 1 atomistic-simulations 1 density-functional-theory 1 dftk 1 electronic-structure 1 julia 1 python 1 simulation 1