pierre-24
Ph.D. in quantum chemistry (October 2021, university of Namur) and Bachelor in C.S. (June 2020). Currently, postdoctoral researcher on the ECOBAT project.
University of NamurNamur, Belgium
Pinned Repositories
AM-Nihoul-website
Code source du site web de l'association Anne-Marie Nihoul
CLAP
Command-line arguments parsing (CLAP) library.
cp2k-basis
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.
ec-interface
Code to create EC interface calculations with VASP and extract data
nachos
NACHOS, the nice (Romberg) triangles!
nbc-compiler
A small fork of the NBC compiler, just to allow the compilation on latest linux versions
phonopy-vibspec
Simulate IR and Raman spectra with Phonopy
pyiso4
Implementation of the ISO 4 standard for journal titles abbreviations in Python.
pytimefliplib
Python library to deal with TimeFlip v3 and v4
stdlite
A light-weight sTD-DFT library and runner
pierre-24's Repositories
pierre-24/pytimefliplib
Python library to deal with TimeFlip v3 and v4
pierre-24/pyiso4
Implementation of the ISO 4 standard for journal titles abbreviations in Python.
pierre-24/cp2k-basis
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.
pierre-24/qcip_tools
Quantum Chemistry In Python (QCIP) tools package.
pierre-24/ec-interface
Code to create EC interface calculations with VASP and extract data
pierre-24/just-psf
Just get me a topology, for god’s sake!
pierre-24/modeliser-une-epidemie
Ensemble des images et illustrations réalisées pour mon tutoriel "modéliser une épidémie" publié sur Zeste de Savoir
pierre-24/pics.pierrebeaujean.net
My Own Gallery (generator)
pierre-24/pierrebeaujean.net
Files that generate my resume website
pierre-24/timeflip-tt
A lightweight custom time tracker based on TimeFlip
pierre-24/AM-Nihoul-website
Code source du site web de l'association Anne-Marie Nihoul
pierre-24/nachos
NACHOS, the nice (Romberg) triangles!
pierre-24/phonopy-vibspec
Simulate IR and Raman spectra with Phonopy
pierre-24/stdlite
A light-weight sTD-DFT library and runner
pierre-24/doxide
Modern documentation for modern C++. Configure with YAML, output Markdown, post-process with Material for MkDocs.
pierre-24/easybuild-easyconfigs
A collection of easyconfig files that describe which software to build using which build options with EasyBuild.
pierre-24/enccb_theme
Theme for the EuroCC NCC Belgium website
pierre-24/helmhurts-python
Solving the Helmholtz equation to model the amplitude field of wireless (in Python)
pierre-24/HPC-parallel-introduction
pierre-24/libcint
general GTO integrals for quantum chemistry
pierre-24/libcint-meson
libcint Meson wraps
pierre-24/logical-enough
A small website to test student's knowledge of search expressions.
pierre-24/LUMI-EasyBuild-contrib
A repository for contributed EasyConfig files that LUMI users can install at their own discretion or use as a starting base for their own build recipes.
pierre-24/photobooth
Stocker infos pour envoyer photos plus tard
pierre-24/pybibtex
Provides a Python API to parse BibTeX files
pierre-24/SCHIB209
Un set de codes et autres illustrations pour le cours SCHIB209
pierre-24/scriptgen
Interactive HPC job scheduler submission script wizard
pierre-24/stda
stda program for computing excited states and response functions via simplified TD-DFT methods (sTDA, sTD-DFT, and SF-sTD-DFT)
pierre-24/Unity
Simple Unit Testing for C
pierre-24/vasp-opt-follows
Follows different criterion of an optimization done with VASP