Dielctric functions calculated within LDA+U RPA framework using GPAW code
Description of this data
LDA+U approach allows to estimate dielectric functions of d-metals with high precision. The python script (*.py file) provides an example of calculation. Calculated dielectric functions are also uploaded as *.dat files. The *.cif files are the crystallographic data obtained from COD required to reproduce the calculations.
Experiment data files
Cite this dataset
Avakyan, Leon (2020), “Dielctric functions calculated within LDA+U RPA framework using GPAW code”, Mendeley Data, v1 http://dx.doi.org/10.17632/5cw4fcc296.1
The files associated with this dataset are licensed under a Creative Commons Attribution 4.0 International licence.