This file is automatically generated. It contains the descriptions of each uploaded file as provided by the user.

  • vasp_structure.zip: Atomic structures of hydrogen-doped SmNiO3 in VASP structural format (*.vasp)
  • vasp_input.zip: VASP input files (INCAR and KPOINTS)
  • vasp_output.zip: Calculated total energy (eV)
  • vasp_hse_wan.zip: VASP input/output files for HSE calculation for 4H structure with Wannier interpolation by using Wannier90 code
  • README.txt: Read me