Supporting data; sulfur vapour modelling

2015-10-23T10:50:02Z (GMT) by Adam Jackson Davide Tiana Aron Walsh
<p>Supporting data for work on thermodynamic equilibrium of sulfur vapours: raw files from density functional theory (DFT) calculations with FHI-aims; structure set from evolutionary search; summary of frequency data by sulfur allotrope and calculation method.</p>