Dataset for "Nonequilibrium Photocarrier and Phonon Dynamics from First Principles: a Unified Treatment of Carrier-Carrier, Carrier-Phonon, and Phonon-Phonon Scattering"

Dataset relative to the publication "Nonequilibrium photocarrier and phonon dynamics from first principles: a unified treatment of carrier-carrier, carrier-phonon, and phonon-phonon scattering" Stefano Mocatti, Giovanni Marini, Giulio Volpato, Pierluigi Cudazzo and Matteo Calandra npj Computational Materials 12, 260 (2026) DOI: 10.1038/s41524-026-02104-y The dataset contains the following folders Conv: Convergence tests for scattering integral, linear absorption and phonon frequencies renormalisation Espresso: All inputs for Quantum ESPRESSO calculations, including pseudopotentials Figures: All the data and script to reproduce the figures reported in the manuscript Fign: Simulation data referred to the nth figure of the manuscript The dataset contains also the preprint version of the manuscript (preprint.pdf) and the supporting information file (SI.pdf)