Structural Insights into Proton Conduction in Gallic Acid–Isoniazid Cocrystals
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https://figshare.com/articles/dataset/Structural_Insights_into_Proton_Conduction_in_Gallic_Acid_Isoniazid_Cocrystals/2326594
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资源简介：
Hydrated cocrystal of gallic acid–isoniazid
displays a single
crystal-to-single crystal transformation upon dehydration, resulting
in a difference of three orders of magnitude in proton conduction.
The conduction pathway is shown to follow the Grotthus mechanism,
supported by theoretical (DFT) calculations.
创建时间：
2016-02-18
