TY - GEN A1 - George, Janine A1 - Naik, Aakash Ashok T1 - DFT raw data for "Investigations on electron beam irradiated rare-earth doped SrF2 for application as low fading dosimeter material: Evidence for and DFT simulation of a radiation-induced phase" N2 - DFT raw data for the publication https://doi.org/10.1039/D2TC01773C It includes all predicted structures, the structure optimizations and the phonon computations in VASP format. Phonon computations were performed with the finite displacement method. KW - DFT KW - Phonons KW - Structure prediction PY - 2022 DO - https://doi.org/10.5281/zenodo.5942729 PB - Zenodo CY - Geneva AN - OPUS4-55417 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER -