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pypi.org "gpaw" keyword

atomistics 0.4.0
Interfaces for atomistic simulation codes and workflows
61 versions - Latest release: 14 days ago - 4 dependent packages - 1.43 thousand downloads last month - 10 stars on GitHub - 2 maintainers
rhodent 1.1
Analyzing hot-carrier distributions from TD-DFT simulations
3 versions - Latest release: about 1 year ago - 19 downloads last month - 4 stars on gitlab.com - 2 maintainers
Related Keywords
chemistry 1 physics 1 scientific 1 Hot carriers 1 Time-dependent density functional theory 1 tddft 1 pyiron 1 abinit 1 ase 1 lammps 1 materials-science 1 quantum-espresso 1 siesta 1