Published February 28, 2022 | Version v1
Dataset Open

Charting the Lattice Thermal Conductivities of I-III-VI2 Chalcopyrite Semiconductors

Authors/Creators

  • 1. Departamento de Química Física, Facultad de Química, Universidad de Sevilla, Seville, Spain
  • 2. Department of Chemistry, University of Reading, Whiteknights, Reading RG6 6DX, UK

Description

Dataset of VASP and ShengBTE calculations for the chalcopyrites collection considered in the article.

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md5:1d0174f779eab0bbdedaa422500cefc2
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Related works

Is referenced by
Dataset: 10.1021/acs.chemmater.2c00336 (DOI)