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GRAPHENE VS. ACTIVATED CARBONS IN LIQUID-PHASE ADSORPTION: ANY FUNDAMENTAL IMPROVEMENTS?

机译:石墨烯与液相吸附中的活性炭:任何基本改善?

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Since graphene became an exciting new addition to the wide range of carbon materials, there has been an explosion of research devoted to its virtues as an adsorbent. Its intrinsically high and easily accessible surface area should offer the potential for significant improvements over conventional adsorbents such as activated carbons or high-surface-area graphite. From a fundamental point of view, however, the well known thermodynamic and kinetic factors that govern the uptake of solutes, especially from aqueous solution, are presumably the same, and yet they are not invoked frequently enough. In this study, we analyze the similarities and differences in the reported behavior of these liquid-phase adsorbents. In particular, we perform an arguably critical quantum chemistry analysis of the electronic and geometric effects of graphene’s surface functional groups on its electron density distribution. The impact on the adsorption affinity of the edge atoms is then analyzed and compared with representative experimental results.
机译:由于石墨烯成为广泛的碳材料的令人兴奋的新增功能,因此探讨了作为吸附剂的美德的研究。其本质上高且易于无障碍的表面积应提供对常规吸附剂(如活性碳或高表面积石墨)的显着改善的潜力。然而,从基本的角度来看,众所周知的热力学和动力学因素,用于治理溶质的吸收,尤其是水溶液,可能是相同的,但它们不会经常调用它们。在本研究中,我们分析了这些液相吸附剂的报告行为的相似性和差异。特别是,我们对石墨烯表面官能团对其电子密度分布的电子和几何效果进行可同步的临界量子化学分析。然后分析了对边缘原子的吸附亲和力的影响,并与代表性实验结果进行比较。

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