Published March 3, 2021 | Version v1.0.2
Dataset Open

Supporting data for "Efficient calculation of carrier scattering rates from first principles"

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-v1.0.2.zip

Files (44.5 MB)

Name Size Download all
md5:d5df6c8772c27dfe80a0a9c395d4dcba
44.5 MB Preview Download