Franco Dison S P, Georgin Jordana, Allasia Daniel, Meili Lucas, López-Maldonado Eduardo Alberto, Khan Afzal Husain, Hasan Mohd Abul, Husain Arshad
Department of Civil and Environmental, Universidad de la Costa, CUC, Calle 58 # 55-66, Barranquilla, Atlántico, Colombia.
Department of Civil and Environmental, Federal University of Santa Maria, Santa Maria, 97105-900, Brazil.
Sci Rep. 2024 Aug 5;14(1):18101. doi: 10.1038/s41598-024-68977-5.
In this study, PROP adsorption was investigated using activated carbon derived from Bactris Guineensis residues and physical statistical modeling. The characterization results indicate high specific surface areas (624.72 and 1125.43 m g) and pore diameters (2.703 and 2.321 nm) for the peel and stone-activated carbon, respectively. Adsorption equilibrium was investigated at different temperatures (298 to 328 K), and it was found that the adsorption capacity increased with temperature, reaching maximum values of 168.7 and 112.94 mg g for the peel and stone-activated carbon, respectively. The application of physical statistical modeling indicates that a monolayer model with one energy site is adequate for describing both systems, with an R above 0.986 and a low BIC of 20.021. According to the steric parameters, the density of molecules per site tends to increase by 116.9% for the stone and 61.6% for the peel. In addition, the model indicates that the number of molecules decreases with increasing temperature from 1.36 to 0.81 and from 1.03 to 0.82. These results indicate that temperature controls the number of receptor sites and the orientation in which propranolol is adsorbed at the surface. The adsorption energies were similar for both systems (approximately 10 kJ mol), which indicates that the adsorption occurred due to physical interactions. Finally, the application of thermodynamic potential functions indicates that the maximum entropy is reached at concentrations of half-saturation (C 3.85 and 4.6 mg L), which corresponds to 1.60 × 10 and 1.86 × 10 kJ mol K for the stone and peel, respectively. After this point, the number of available sites tends to decrease, which indicates the stabilization of the system. The Gibbs energy tended to decrease with increasing concentration at equilibrium, reaching minimum values of - 1.73 × 10 and - 1.99 × 10 kJ mol, respectively. Overall, the results obtained here further elucidate how the adsorption of propranolol occurs for different activated carbons from the same source.
在本研究中,使用源自几内亚棕榈残渣的活性炭和物理统计模型对普萘洛尔吸附进行了研究。表征结果表明,果皮活性炭和果核活性炭的比表面积分别为624.72和1125.43 m²/g,孔径分别为2.703和2.321 nm。在不同温度(298至328 K)下研究了吸附平衡,发现吸附容量随温度升高而增加,果皮活性炭和果核活性炭的最大吸附容量分别达到168.7和112.94 mg/g。物理统计模型的应用表明,具有一个能量位点的单层模型足以描述这两个系统,相关系数R大于0.986,贝叶斯信息准则值较低,为20.021。根据空间参数,果核每位点的分子密度倾向于增加116.9%,果皮每位点的分子密度倾向于增加61.6%。此外,该模型表明,分子数量随温度升高而减少,从1.36降至0.81,从1.03降至0.82。这些结果表明,温度控制着受体位点的数量以及普萘洛尔在表面的吸附取向。两个系统的吸附能相似(约10 kJ/mol),这表明吸附是由于物理相互作用发生的。最后,热力学势函数的应用表明,在半饱和浓度(果皮为3.85 mg/L,果核为4.6 mg/L)下达到最大熵,分别对应果核和果皮1.60×10⁻⁵和1.86×10⁻⁵kJ/mol·K。在此之后,可用位点数量趋于减少,这表明系统趋于稳定。平衡时吉布斯自由能随浓度增加而降低,分别达到最小值-1.73×10⁻⁵和-1.99×10⁻⁵kJ/mol。总体而言,此处获得的结果进一步阐明了同一来源的不同活性炭对普萘洛尔的吸附情况。