santoshkumarradha / pyquestaal Star 3 Code Issues Pull requests Python class to interface with QUESTAAL Quantum codes which is a suite of electronic structure programs. python dft physics electronic-structure gw ase condensed-matter-physics pymatgen qsgw questaal atomic-simulation-environment Updated Jul 5, 2022 Python
santoshkumarradha / questaal-reader Star 1 Code Issues Pull requests Prase and read QUESTAAL quantum calculation's output python dft ab-initio electronic-structure gw qsgw questaal quantum-codes questaal-reader Updated Feb 21, 2024 Python
Electronic-Structure-Group / v2o5-quasiparticle-exciton Star 1 Code Issues Pull requests Data repository for the research paper 'Quasiparticle band structure and excitonic optical response in V2O5 bulk and monolayer'. dft physics band-structure quantum-chemistry optics materials-science exciton questaal v2o5 quasiparticle Updated Mar 15, 2024