Cao Xianbing, Ahammed Sk Mosaraf, Datta Siddhartha, Chowdhury Jahangir, Roy Priti Kumar
School of Mathematics and Statistics, Beijing Technology and Business University, Beijing 100048, China.
Department of Mathematics, Jadavpur University, Kolkata 700032, India.
ACS Omega. 2024 Apr 25;9(18):20502-20511. doi: 10.1021/acsomega.4c01729. eCollection 2024 May 7.
Biodiesel is one of the alternative renewable energy sources that has received a lot of attention since it is clean, green energy. Different sources can be used for the production of biodiesel, but the most appropriate and economical method relies on the transesterification of methanol with the nonedible vegetable oil from the fruit of the plant. Molar ratio, vessel diameter, catalyst concentration, and ultrasound all have a substantial influence on the synthesis of biodiesel by the transesterification process. Among these factors, the diameter of the vessel and the ultrasonic effect through mass transfer limitations have a significant impact on successful reaction completion. In this research work, we have developed a mathematical model to analyze the three-step transesterification process and side saponification reaction in the presence of a potassium hydroxide catalyst. The model considers the influence of mixing intensity variations, including ultrasound, on the mass transfer in different phases. The mass transfer rate is calculated using the modified Dittus-Boelter correlation. An optimal control approach through the minimum principle by Pontryagin is applied to maximize the production of biodiesel at minimal cost. The novelty of this research, which we have derived from our analytical as well as numerical results, considering industrial processes, is that more than 97% biodiesel yield conversion is to be obtained at 50 kHz ultrasound frequency, a 6:1 methanol-to-Jatropha-oil molar ratio, and 1 m of vessel diameter within 50 min using optimal control theory.
生物柴油是一种替代可再生能源,因其清洁、绿色的特点而备受关注。生物柴油的生产可使用不同的原料,但最合适且经济的方法是甲醇与该植物果实中的非食用植物油进行酯交换反应。摩尔比、反应釜直径、催化剂浓度和超声对酯交换法合成生物柴油均有显著影响。在这些因素中,反应釜直径以及通过传质限制产生的超声效应,对反应的成功完成有重大影响。在本研究中,我们建立了一个数学模型,用于分析在氢氧化钾催化剂存在下的三步酯交换过程和副皂化反应。该模型考虑了包括超声在内的混合强度变化对不同相之间传质的影响。传质速率采用修正的迪图斯 - 博尔特关联式计算。应用庞特里亚金最小原理的最优控制方法,以最小成本最大化生物柴油产量。本研究的新颖之处在于,基于我们的分析和数值结果,并考虑工业过程,利用最优控制理论,在50 kHz超声频率、甲醇与麻风树油摩尔比为6:1以及反应釜直径为1 m的条件下,50分钟内生物柴油产率转化率可超过97%。