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Ph.D. in quantum chemistry (October 2021, university of Namur) and Bachelor in C.S. (June 2020). Currently, postdoctoral researcher on the ECOBAT project.
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University of Namur
- Namur, Belgium
- https://pierrebeaujean.net
- @PierreBeaujean
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AM-Nihoul-website
AM-Nihoul-website PublicCode source du site web de l'association Anne-Marie Nihoul
Python
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cp2k-basis
cp2k-basis PublicA 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.
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ec-interface
ec-interface PublicCode to create EC interface calculations with VASP and extract data
Python 3
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