Published March 3, 2021
| Version v1.0.1
Dataset
Open
Supporting data for "Efficient calculation of carrier scattering rates from first principles"
Creators
- 1. Lawrence Berkeley National Laboratory
Description
Supporting data for "Efficient calculation of carrier scattering rates from first principles". The dataset includes:
- Temperature and carrier concentration dependent electronic mobility and Seebeck coefficient calculated using AMSET, constant relaxation time (CRT) approximation, and the scaled relaxation time (SRT) approximation.
- `vasprun.xml` files for all materials.
Calculations were performed using the AMSET package, available at: https://github.com/hackingmaterials/amset
Files
amset-supporting-data-v1.0.1.zip
Files
(44.6 MB)
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md5:b10a81acfd593028e2ab392bf0c8de67
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