Discover pierre-24/cp2k-basis Open Source project

Stars
3
Rank 3,963,521 (Top 79 %)
Language
Python
Created about 2 years ago
Updated 4 months ago

pierre-24

There are no reviews yet. Be the first to send feedback to the community and the maintainers!

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.

pytimefliplib

Python library to deal with TimeFlip v3 and v4

Python

pyiso4

Implementation of the ISO 4 standard for journal titles abbreviations in Python.

Python

nbc-compiler

A small fork of the NBC compiler, just to allow the compilation on latest linux versions

CLAP

Command-line arguments parsing (CLAP) library.

pygments-ocl

OCL (object constraint language) pygments parser

Python

ec-interface

Code to create EC interface calculations with VASP and extract data

Python

qcip_tools

Quantum Chemistry In Python (QCIP) tools package.

Python

pics.pierrebeaujean.net

My Own Gallery (generator)

Python

libcint-meson

libcint Meson wraps

Meson

modeliser-une-epidemie

Ensemble des images et illustrations réalisées pour mon tutoriel "modéliser une épidémie" publié sur Zeste de Savoir

Python

timeflip-tt

A lightweight custom time tracker based on TimeFlip

Python

nxt-interpreter

Minimal(ist) NXT interpreter [WIP]

C++

just-psf

Just get me a topology, for god’s sake!

Python

pierre-24/cp2k-basis

pierre-24

Reviews

Repository Details

More Repositories