Supplementary material to 'Machine Learning Prediction of Henry Coefficients of Polar and Nonpolar Gases in Covalent Organic Frameworks: Effects of Interlayer Shifts and Functionalization'
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https://darus.uni-stuttgart.de/citation?persistentId=doi:10.18419/DARUS-5781
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资源简介：
<p>Electronic supplementary materials for the publication stated below. Henry coefficients are calculated by Widom insertion (in RASPA 2.0.47). </p>
Contents: <br>
- Henry coefficients (CSV)<br>
- CoRE-COF original, slipped, and functionalized files (CIF)<br>
- RASPA input files.
提供机构：
DaRUS
创建时间：
2026-03-09
