Published January 24, 2022
| Version v1.0.0
Software
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Calculation of the electron-phonon coupling parameter and heat capacities from DFT results
- 1. Fritz-Haber-Institut der Max-Planck-Gesellschaft
- 2. Helmholtz-Zentrum Dresden-Rossendorf
Description
Calculation of the electron-phonon coupling parameter and heat capacities (i.e. all material-specific quantities required for a two-temperature model) from density functional theory results (electron and phonon densities of states, Eliashberg function).
Files
DanielaZahn/TTM_inputs_from_DFT_results-v1.0.0.zip
Files
(824.5 kB)
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Additional details
Related works
- Is supplement to
- https://github.com/DanielaZahn/TTM_inputs_from_DFT_results/tree/v1.0.0 (URL)