Pinned Repositories
abinit
The official github mirror of the Abinit repository. We welcome bug fixes and improvements. Note that most of the active developments are hosted on our https://gitlab.abinit.org/ server. Before embarking on making significant changes, please contact the Abinit group.
abipy
Open-source library for analyzing the results produced by ABINIT
abimkdocs_abidev2019
Talk on the new documentation system of Abinit
abinit
ABINIT is an atomic-scale simulation software suite. http://www.abinit.org
abinit-feedstock
A conda-smithy repository for abinit.
df_widgets
Collection of IPython widgets for analysing results stored in pandas DataFrames
nbjsmol
pseudos_ac_she
pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
spack
A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
gmatteo's Repositories
gmatteo/awesome-panel-extensions
The purpose of this repository is to make it as easy as possible to develop and use awesome Panel extensions.
gmatteo/electronic-structure-visualization
Visualizations
gmatteo/test_submodule
Just for testing submodules in Abinit
gmatteo/jupyter-jsmol
gmatteo/abiout
gmatteo/nglview
Jupyter widget to interactively view molecular structures and trajectories
gmatteo/qAgate
gmatteo/HTGW
Package for automatic GW calculations.
gmatteo/emmet
Be a master builder of databases of material properties. Avoid the Kragle.
gmatteo/oncvpsp
Pseudopotential development
gmatteo/abipy_htc_technical_aspects_abidev2019
gmatteo/abimkdocs_abidev2019
Talk on the new documentation system of Abinit
gmatteo/abipy_intro_abidev2019
Introduction to Abipy (talk given at Abidev2019 workshop)
gmatteo/pseudodojo_pqdft_2019
gmatteo/abipy_slides_aps_boston_2019
Automating ABINIT calculations with AbiPy. Boston MA, 3 March 2019
gmatteo/maggma
MongoDB aggregation machine
gmatteo/spack
A flexible package manager designed to support multiple versions, configurations, platforms, and compilers.
gmatteo/betterbib
Update BibTeX file with info from online resources.
gmatteo/netcdf4-python
netcdf4-python: python/numpy interface for NetCDF4
gmatteo/phononwebsite
Visualise lattice vibrations
gmatteo/nbjsmol
gmatteo/mkdocs-material
A Material Design theme for MkDocs
gmatteo/mkdocs
Project documentation with Markdown.
gmatteo/test_binder
gmatteo/df_widgets
Collection of IPython widgets for analysing results stored in pandas DataFrames
gmatteo/cecam_tutorial_2017
gmatteo/jupyterlab
JupyterLab computational environment. This is a very early preview, and is not suitable for general usage yet.
gmatteo/spglib
C library for finding and handling crystal symmetries
gmatteo/seekpath
A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
gmatteo/git-extras
GIT utilities -- repo summary, repl, changelog population, author commit percentages and more