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Miki Bonacci's Projects

aiida-atomistic icon aiida-atomistic

AiiDA plugin which contains data and methods for atomistic simulations.

aiida-muon icon aiida-muon

aiida workchain for finding candidate implantation site(s) for the muon and contact hyperfine contribution to the local field.

aiida-wannier90-workflows icon aiida-wannier90-workflows

A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code

compile_yambo_everywhere icon compile_yambo_everywhere

Collection of configuration scripts, tricks and other stuff on how to compile and set up a running yambo on different machines.

euphonic icon euphonic

Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intensities from force constants.

gw100 icon gw100

GW100 data repository and post processing tools

koopmans icon koopmans

Implementation of Koopmans-compliant functionals in Quantum ESPRESSO

muesr icon muesr

A python package containing tools and functions to evaluate local fields at the muon site for muon spin rotation and relaxation spectroscopy

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