Miki Bonacci's repositories
tutorials-aiida-yambo
Jupyter notebooks examples for aiida-yambo plugin
aiida-ase
AiiDA plugin for ASE
aiida-atomistic
AiiDA plugin which contains data and methods for atomistic simulations.
aiida-core
The official repository for the AiiDA code
aiida-muon
aiida workchain for finding candidate implantation site(s) for the muon and contact hyperfine contribution to the local field.
aiida-project
AiiDA project manager
aiida-quantumespresso
The official AiiDA plugin for Quantum ESPRESSO
aiida-registry
Find plugins for AiiDA
aiida-vibroscopy
Automated all-functionals infrared and Raman spectra, and phonons.
aiida-wannier90-workflows
A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code
aiida-yambo
Aiida Plugin and related Yambo development
aiida-yambo-wannier90
Plugin to combine Wannier90 interpolations with GW corrections computed by Yambo
aiida-yambo_examples
Jupyter notebook examples on how to run aiida-yambo plugin and related workflows
aiidalab-qe
AiiDAlab App for Quantum ESPRESSO
compile_yambo_everywhere
Collection of configuration scripts, tricks and other stuff on how to compile and set up a running yambo on different machines.
compile_yambo_lumi_C
how to compile yambo on lumi-C
Euphonic
Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intensities from force constants.
GW100
GW100 data repository and post processing tools
koopmans
Implementation of Koopmans-compliant functionals in Quantum ESPRESSO
muesr
A python package containing tools and functions to evaluate local fields at the muon site for muon spin rotation and relaxation spectroscopy
patchwork
All the Git-it Workshop completers!
quantum-mobile
A Virtual Machine for computational materials science
tools-phonon-dispersion
Visualize interactively phonon dispersions and their eigenvectors
wannier90
Official repository of the Wannier90 code
yambopy
Python scripts to manage and postprocess quantum espresso and yambo calculation.