Phelel params.hdf5: Difference between revisions

Revision as of 10:08, 22 January 2025

The phelel_params.hdf5 file is used to calculate electron-phonon interactions via ELPH_RUN = True. It contains information related to the interatomic force constants and the derivative of the Kohn-Sham potential.

To generate the phelel_params.hdf5 file, you can either use the VASP internal driver via ELPH_POT_GENERATE = True or use VASP in combination with phelel.

Revision as of 14:38, 18 December 2024 (view source) Mani (talk \| contribs) (Add categories and related links) ← Older edit		Revision as of 10:08, 22 January 2025 (view source) Mani (talk \| contribs) (Add elphon category) Newer edit →
Line 11:		Line 11:
	[[Electron-phonon potential from supercells]]		[[Electron-phonon potential from supercells]]

	[[Category:Files]][[Category:Input files]][[Category:Output files]]		[[Category:Files]][[Category:Input files]][[Category:Output files]][[Category:Electron-phonon interactions]]