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University of Namur
- Namur, Belgium
- https://pierrebeaujean.net
- @PierreBeaujean
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cp2k-basis Public
A library to parse CP2K basis sets and GTH pseudopotentials, which also comes with a webserver to find out and select a basis set and its matching pseudopotential for your CP2K calculations.
Python
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514 contributions in the last year
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Contributed to
pierre-24/cp2k-basis,
pierre-24/AM-Nihoul-website,
pierre-24/toymc
and 17 other
repositories