vgmduarte's Stars
gschleder/MLtutorial
Machine Learning introductory tutorial
google/jax
Composable transformations of Python+NumPy programs: differentiate, vectorize, JIT to GPU/TPU, and more
romerogroup/pyprocar
A Python library for electronic structure pre/post-processing
theochem/tinydft
A minimalistic atomic Density Functional Theory (DFT) code
pyscf/pyscf
Python module for quantum chemistry
ricardoribeiro-2020/berry
Calculates Berry connections and other properties from DFT packages
xtreamsrl/jupytemplate
Templates for jupyter notebooks
vinhphunguyen/how-to-write-a-paper
How to write a high quality scientific article using LaTeX. Source code included.
mwouts/jupytext
Jupyter Notebooks as Markdown Documents, Julia, Python or R scripts
kwant-project/kwant
Mirror of the Kwant project https://gitlab.kwant-project.org/kwant/kwant
dean0x7d/pybinding
Scientific Python package for tight-binding calculations in solid state physics
uwescience/shablona
A template for small scientific python projects
kedro-org/kedro
Kedro is a toolbox for production-ready data science. It uses software engineering best practices to help you create data engineering and data science pipelines that are reproducible, maintainable, and modular.
drivendataorg/cookiecutter-data-science
A logical, reasonably standardized, but flexible project structure for doing and sharing data science work.
jupyter/jupyter
Jupyter metapackage for installation, docs and chat
bast/somepackage
Show how to structure a Python project.
wannier-developers/wannier-tutorials
A repository hosting materials used during Wannier-related tutorials and schools
achael/eht-imaging
Imaging, analysis, and simulation software for radio interferometry
fangohr/introduction-to-python-for-computational-science-and-engineering
Book: Introduction to Python for Computational Science and Engineering