Interactions in saccharide/cation/water systems: Insights from density functional theory
نویسندگان
چکیده
منابع مشابه
NH3 sensors based on novel TiO2/MoS2 nanocomposites: Insights from density functional theory calculations
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Density functional theory calculations were performed to investigate the interactions of NH3 molecules with TiO2/MoS2 nanocomposites in order to completely exploit the adsorption properties of these nanocomposites. Given the need to further comprehend the behavior of the NH3 molecules oriented between the TiO2 nanoparticle and MoS2 monolayer, we have geometrically optimized the complex systems ...
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ژورنال
عنوان ژورنال: Food Chemistry
سال: 2020
ISSN: 0308-8146
DOI: 10.1016/j.foodchem.2020.127054