Si 2 BN QuantumDots as Efficient Detectors of Carbamazepine in Aqueous Environment: First principles study
Research Square
2023
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Example: if you select the 1-year option for an article published in 2019 and a metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019. If you select the 3-year option for the same article published in 2019 and the metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019, 2018 and 2017.
Citation Benchmarking is provided by Scopus and SciVal and is different from the metrics context provided by PlumX Metrics.
Article Description
Pharmaceuticals and personal care products (PPCPs) excreted into the environment have dangerous consequences on environmental impacts and public health. Therefore, it is crucial to find efficient methods for the treatment of these pollutants. Currently, a wide range of physical, biological, and chemical processes are being explored for the removal of such contaminants. Here we consider the capability of the ultrathin Si2BN quantum dots to adsorb and eliminate Carbamazepine. Based on first-principles calculations, we studied the electronic structure and the adsorption energy of Carbamazepine (CBZ) by a stable Si2BN nanoflakes. We estimated the adsorption energies on two different sites of Si2BN monolayer. The calculated positive values (~0.83eV) of adsorption energy implies that the considered Si2BN nanoflakes are able to adsorb Carbamazepine through all the proposed adsorption sites.
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