14729 2 45731 document 14729 argyrodite_MD.tar.gz application/gzip 0d9d4ad253b4fa18e769b6fe759b8716 MD5 44607324775 2021-03-09 04:36:10 https://researchdata.bath.ac.uk/814/2/argyrodite_MD.tar.gz 814 2 2 application/gzip other Full DFT dataset for the calculations described in "Mechanistic Origin of Lithium Diffusion in Anion-Disordered Li6PS5X Argyrodites" https://doi.org/10.1021/acs.chemmater.0c03738 Full details are given in the uploaded README.md file. The data is stored as a gzipped tar file. en public cc_by

argyrodite_MD.tar.gz

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