DFT files for LuX3 nanotubes

DFT files for Fig.6 of the manuscript "Narrow Diameter Tubular 1D van der Waals Heterostructures", by E. Pach, M. Kierkowicz, M. Kurttepeli, C. Frontera, C. Borghesi, G. Giorgi, R. Rurali, S. Bals, G. van Tendeloo, G. Tobías-Rossell, and B. Ballesteros.INPUTSinputs: the input files for VASP (*)geom_opt: the optmized geometries to useOUTPUTSband_dat: the band structure diagramsband_gap: summary of the bandgap valuestdos_dat: density of states(*) The POTCAR proprietary files, necessary to run VASP, are not included. They are distributed with the VASP license and cannot be shared.