Data, Python Script and Results for Calculation of Dielectric Functions of Plasmonic Nanoparticles of Noble Metals, Magnesium and Their Alloys

Published: 19 July 2020| Version 2 | DOI: 10.17632/5cw4fcc296.2
Leon Avakyan,
Veniamin Durimanov,
Daniil Nemesh,
Василий Срабионян,
Jürgen Ihlemann,
Lusegen Bugaev


- *.cif -- files describing crystal structure of compounds. Originally downloaded from [Crystallography Open Database](; - *.xyz -- sample atomic structures of random AuxAg1-x alloy; - *.py -- python script for calculation of dielectric function. Requires ASE and GPAW libraries; - df_*.dat -- resulted dielectric functions calculated using LDA+U approach. - other *.dat -- reference dielectric functions data. Originally downloaded from [Refractive Index Database](