Data to accompany the article "Lattice dynamics of the tin sulphides SnS2, SnS and Sn2S3: vibrational spectra and thermal transport"


Skelton, J., Jackson, A., 2017. Data to accompany the article "Lattice dynamics of the tin sulphides SnS2, SnS and Sn2S3: vibrational spectra and thermal transport". University of Bath. https://doi.org/10.15125/BATH-00357.


Dataset abstract

This repository contains key raw data from the calculations performed in the manuscript, including the optimised structures, data from the lattice-dynamics calculations, the simulated spectra and the thermal-conductivity tensors.

Title: Data to accompany the article "Lattice dynamics of the tin sulphides SnS2, SnS and Sn2S3: vibrational spectra and thermal transport"
Subjects: Energy > Solar Technology
Tools, technologies and methods > Analytical Science
Tools, technologies and methods > High Performance Computing
Tools, technologies and methods > Scattering & Spectroscopy
Departments: Faculty of Science > Chemistry
DOI: https://doi.org/10.15125/BATH-00357
URI: https://researchdata.bath.ac.uk/id/eprint/357
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