A pH predictive model based on acid–base equilibria and ion equilibria was proposed to calculate the pH value of the overhead condensing system of crude distillation unit. The pH model could be used to predict the ap...A pH predictive model based on acid–base equilibria and ion equilibria was proposed to calculate the pH value of the overhead condensing system of crude distillation unit. The pH model could be used to predict the appropriate amounts of neutralizers by measuring the Cl-ion concentration of the overhead knockout drum. The pH values of various neutralized streams were estimated by this model. The results showed that the predicted pH values were in good agreement with the experimental ones. The trend of the corrosion inhibition efficiency decreases in the following order: ethylenediamine > N,Ndimethylethanolamine> triethylamine > 3-methoxypropylamine > morpholine. The difficulty in the accurate control of corrosion was solved, and a good instruction was provided for mitigating corrosion in refinery.展开更多
Correlations between raw water characteristics and pH after enhanced coagulation to maximize dissolved organic matter（DOM） removal using four typical coagulants（FeCl3,Al2（SO4）3,polyaluminum chloride（PACl） and h...Correlations between raw water characteristics and pH after enhanced coagulation to maximize dissolved organic matter（DOM） removal using four typical coagulants（FeCl3,Al2（SO4）3,polyaluminum chloride（PACl） and high performance polyaluminum chloride（HPAC）） without pH control were investigated.These correlations were analyzed on the basis of the raw water quality and the chemical and physical fractionations of DOM of thirteen Chinese source waters over three seasons.It was found that the final pH after enhanced coagulation for each of the four coagulants was in？uenced by the content of removable DOM（i.e.hydrophobic and higher apparent molecular weight（AMW） DOM）,the alkalinity and the initial pH of raw water.A set of feed-forward semi-empirical models relating the final pH after enhanced coagulation for each of the four coagulants with the raw water characteristics were developed and optimized based on correlation analysis.The established models were preliminarily validated for prediction purposes,and it was found that the deviation between the predicted data and actual data was low.This result demonstrated the potential for the application of these models in practical operation of drinking water treatment plants.展开更多
Smart material can be defined as a material that can dock or convert energy between physical domains or as a material that can generate a response, in their characteristics, properties or geometries, when submitted to...Smart material can be defined as a material that can dock or convert energy between physical domains or as a material that can generate a response, in their characteristics, properties or geometries, when submitted to an external stimulus, for example, to heat, water presence, light, etc. In this paper, the second definition will be approached. Hydrogels are crosslinked materials that can absorb a big amount of water. They generally can be considered as smart materials once they exhibit sensibility to external stimuli like to pH variation, as will be approached in this paper. Thus, chitosan/polyvinylpyrrolidone hydrogels of three different ratios between these two polymers (1:1, 7:3 and 3:7) were synthesized and putted in aqueous solution with different pHs. The pH was adjusted adding drops of NaOH and HCl, slowly. After the collection of results and in order to understand the phenomena in a visual way, models of the molecules were also elaborated using the Avogadro software. Therefore, it was possible to realize that the greater the ratio of chitosan in the hydrogel, the greater its sensitivity to pH. Such characteristic is associated with the amino (-NH2) groups in it structure, which are capable of protonating and deprotonating (depending of the pH), generating charges under the chemical structure of the material, which will expand its volume in order to minimize the repulsion between charges. In addition, it was also noted that the hydrogel expansion is inversely proportional to the pH increase. By practical tests, it was possible to conclude that chitosan/PVP hydrogel with ratio 7:3 is the most interesting once it presented a greater quantity of chitosan in its composition, what implied in more rigidity than the others and greater ease of handling, resulting in more reliable results. This hydrogel also showed higher sensitivity to pH.展开更多
This study investigated the effects of pH on the transport of Pb 2＋ , Mn 2＋ , Zn 2＋ and Ni 2＋ through lateritic soil columns. Model results by fitting the symmetric breakthrough curves （BTCs） of bromide （Br ） ...This study investigated the effects of pH on the transport of Pb 2＋ , Mn 2＋ , Zn 2＋ and Ni 2＋ through lateritic soil columns. Model results by fitting the symmetric breakthrough curves （BTCs） of bromide （Br ） with CXTFIT model suggested that physical non-equilibrium processes were absent in the columns. The heavy metal BTCs were, however, asymmetrical and exhibited a tailing phenomenon, indicating the presence of chemical non-equilibrium processes in the columns. The retardation factors of Pb 2＋ were the largest of the four metal ions at both pH 4.0 （33.3） and pH 5.0 （35.4）. The use of Langmuir isotherm parameters from batch studies with HYDRUS-1D did not predict the BTCs well. Rather the two-site model （TSM） described the heavy metal BTCs better than the equilibrium linear/nonlinear Langmuir model. The fraction of instantaneous sorption sites （ f ） of all four metal ions on the lateritic soil was consistently about 30%–44% of the total sorption sites.展开更多
针对石灰石-石膏湿法烟气脱硫系统(wet flue gas desulfurization, WFGD)工作过程中浆液pH难以精准测量、不利于WFGD作业的问题,建立一种基于双向门控循环单元的脱硫系统pH预测模型。首先,对原始数据进行清洗和归一化处理;其次,基于最...针对石灰石-石膏湿法烟气脱硫系统(wet flue gas desulfurization, WFGD)工作过程中浆液pH难以精准测量、不利于WFGD作业的问题,建立一种基于双向门控循环单元的脱硫系统pH预测模型。首先,对原始数据进行清洗和归一化处理;其次,基于最大信息系数分析得出13个特征值为输入变量,pH为输出变量,并建立浆液pH模型;最后,运行模型,并对结果进行评价。研究结果显示,与长短期记忆和门控循环相比,所选用的数学模型的平均绝对误差分别下降了11.95%、24.92%,均方根误差分别下降了10.64%、19.49%,决定系数分别提高了1.79%、3.08%。表明基于双向门控循环单元的pH预测模型具有较高的精确度和稳定性,具有工程应用价值,为现有脱硫塔pH预测模型提供了工程参考。展开更多
Modeling HIV/AIDS progression is critical for understanding disease dynamics and improving patient care. This study compares the Exponential and Weibull survival models, focusing on their ability to capture state-spec...Modeling HIV/AIDS progression is critical for understanding disease dynamics and improving patient care. This study compares the Exponential and Weibull survival models, focusing on their ability to capture state-specific failure rates in HIV/AIDS progression. While the Exponential model offers simplicity with a constant hazard rate, it often fails to accommodate the complexities of dynamic disease progression. In contrast, the Weibull model provides flexibility by allowing hazard rates to vary over time. Both models are evaluated within the frameworks of the Cox Proportional Hazards (Cox PH) and Accelerated Failure Time (AFT) models, incorporating critical covariates such as age, gender, CD4 count, and ART status. Statistical evaluation metrics, including Akaike Information Criterion (AIC), Bayesian Information Criterion (BIC), log-likelihood, and Pseudo-R2, were employed to assess model performance across diverse patient subgroups. Results indicate that the Weibull model consistently outperforms the Exponential model in dynamic scenarios, such as younger patients and those with co-infections, while maintaining robustness in stable contexts. This study highlights the trade-off between flexibility and simplicity in survival modeling, advocating for tailored model selection to balance interpretability and predictive accuracy. These findings provide valuable insights for optimizing HIV/AIDS management strategies and advancing survival analysis methodologies.展开更多
A theoretical model for the non steady-state response of a pH-based potentiometric biosensor immobilizing organophosphorus hydrolase (OPH) is discussed. The model is based on a system of five coupled nonlinear reactio...A theoretical model for the non steady-state response of a pH-based potentiometric biosensor immobilizing organophosphorus hydrolase (OPH) is discussed. The model is based on a system of five coupled nonlinear reaction-diffusion equations under non steady-state conditions for enzyme reactions occurring in potentiometric biosensor that describes the concentration of substrate and hydrolysis products within the membrane. New approximate analytical expressions for the concentration of the substrate (organophosphorus pesticides (OPs)) and products are derived for all values of Thiele modulus and buffer concentration using new approach of homotopy perturbation method. The analytical results are also compared with numerical ones and a good agreement is obtained. The obtained results are valid for the whole solution domain.展开更多
基金supported by the PetroChina Company Limited (20151191)
文摘A pH predictive model based on acid–base equilibria and ion equilibria was proposed to calculate the pH value of the overhead condensing system of crude distillation unit. The pH model could be used to predict the appropriate amounts of neutralizers by measuring the Cl-ion concentration of the overhead knockout drum. The pH values of various neutralized streams were estimated by this model. The results showed that the predicted pH values were in good agreement with the experimental ones. The trend of the corrosion inhibition efficiency decreases in the following order: ethylenediamine > N,Ndimethylethanolamine> triethylamine > 3-methoxypropylamine > morpholine. The difficulty in the accurate control of corrosion was solved, and a good instruction was provided for mitigating corrosion in refinery.
基金supported by the National Natural Science Foundation of China (No. 50921064,51025830)the National Basic Research Program (973) of China(No. 2011CB933700)the Special Co-construction Project of Beijing Municipal Commission of Education
文摘Correlations between raw water characteristics and pH after enhanced coagulation to maximize dissolved organic matter（DOM） removal using four typical coagulants（FeCl3,Al2（SO4）3,polyaluminum chloride（PACl） and high performance polyaluminum chloride（HPAC）） without pH control were investigated.These correlations were analyzed on the basis of the raw water quality and the chemical and physical fractionations of DOM of thirteen Chinese source waters over three seasons.It was found that the final pH after enhanced coagulation for each of the four coagulants was in？uenced by the content of removable DOM（i.e.hydrophobic and higher apparent molecular weight（AMW） DOM）,the alkalinity and the initial pH of raw water.A set of feed-forward semi-empirical models relating the final pH after enhanced coagulation for each of the four coagulants with the raw water characteristics were developed and optimized based on correlation analysis.The established models were preliminarily validated for prediction purposes,and it was found that the deviation between the predicted data and actual data was low.This result demonstrated the potential for the application of these models in practical operation of drinking water treatment plants.
文摘Smart material can be defined as a material that can dock or convert energy between physical domains or as a material that can generate a response, in their characteristics, properties or geometries, when submitted to an external stimulus, for example, to heat, water presence, light, etc. In this paper, the second definition will be approached. Hydrogels are crosslinked materials that can absorb a big amount of water. They generally can be considered as smart materials once they exhibit sensibility to external stimuli like to pH variation, as will be approached in this paper. Thus, chitosan/polyvinylpyrrolidone hydrogels of three different ratios between these two polymers (1:1, 7:3 and 3:7) were synthesized and putted in aqueous solution with different pHs. The pH was adjusted adding drops of NaOH and HCl, slowly. After the collection of results and in order to understand the phenomena in a visual way, models of the molecules were also elaborated using the Avogadro software. Therefore, it was possible to realize that the greater the ratio of chitosan in the hydrogel, the greater its sensitivity to pH. Such characteristic is associated with the amino (-NH2) groups in it structure, which are capable of protonating and deprotonating (depending of the pH), generating charges under the chemical structure of the material, which will expand its volume in order to minimize the repulsion between charges. In addition, it was also noted that the hydrogel expansion is inversely proportional to the pH increase. By practical tests, it was possible to conclude that chitosan/PVP hydrogel with ratio 7:3 is the most interesting once it presented a greater quantity of chitosan in its composition, what implied in more rigidity than the others and greater ease of handling, resulting in more reliable results. This hydrogel also showed higher sensitivity to pH.
基金the National Center of Excellence for Environmental and Hazardous Waste Management(NCE-EHWM)the Geology Department of Chulalongkorn University
文摘This study investigated the effects of pH on the transport of Pb 2＋ , Mn 2＋ , Zn 2＋ and Ni 2＋ through lateritic soil columns. Model results by fitting the symmetric breakthrough curves （BTCs） of bromide （Br ） with CXTFIT model suggested that physical non-equilibrium processes were absent in the columns. The heavy metal BTCs were, however, asymmetrical and exhibited a tailing phenomenon, indicating the presence of chemical non-equilibrium processes in the columns. The retardation factors of Pb 2＋ were the largest of the four metal ions at both pH 4.0 （33.3） and pH 5.0 （35.4）. The use of Langmuir isotherm parameters from batch studies with HYDRUS-1D did not predict the BTCs well. Rather the two-site model （TSM） described the heavy metal BTCs better than the equilibrium linear/nonlinear Langmuir model. The fraction of instantaneous sorption sites （ f ） of all four metal ions on the lateritic soil was consistently about 30%–44% of the total sorption sites.
文摘针对石灰石-石膏湿法烟气脱硫系统(wet flue gas desulfurization, WFGD)工作过程中浆液pH难以精准测量、不利于WFGD作业的问题,建立一种基于双向门控循环单元的脱硫系统pH预测模型。首先,对原始数据进行清洗和归一化处理;其次,基于最大信息系数分析得出13个特征值为输入变量,pH为输出变量,并建立浆液pH模型;最后,运行模型,并对结果进行评价。研究结果显示,与长短期记忆和门控循环相比,所选用的数学模型的平均绝对误差分别下降了11.95%、24.92%,均方根误差分别下降了10.64%、19.49%,决定系数分别提高了1.79%、3.08%。表明基于双向门控循环单元的pH预测模型具有较高的精确度和稳定性,具有工程应用价值,为现有脱硫塔pH预测模型提供了工程参考。
文摘Modeling HIV/AIDS progression is critical for understanding disease dynamics and improving patient care. This study compares the Exponential and Weibull survival models, focusing on their ability to capture state-specific failure rates in HIV/AIDS progression. While the Exponential model offers simplicity with a constant hazard rate, it often fails to accommodate the complexities of dynamic disease progression. In contrast, the Weibull model provides flexibility by allowing hazard rates to vary over time. Both models are evaluated within the frameworks of the Cox Proportional Hazards (Cox PH) and Accelerated Failure Time (AFT) models, incorporating critical covariates such as age, gender, CD4 count, and ART status. Statistical evaluation metrics, including Akaike Information Criterion (AIC), Bayesian Information Criterion (BIC), log-likelihood, and Pseudo-R2, were employed to assess model performance across diverse patient subgroups. Results indicate that the Weibull model consistently outperforms the Exponential model in dynamic scenarios, such as younger patients and those with co-infections, while maintaining robustness in stable contexts. This study highlights the trade-off between flexibility and simplicity in survival modeling, advocating for tailored model selection to balance interpretability and predictive accuracy. These findings provide valuable insights for optimizing HIV/AIDS management strategies and advancing survival analysis methodologies.
文摘A theoretical model for the non steady-state response of a pH-based potentiometric biosensor immobilizing organophosphorus hydrolase (OPH) is discussed. The model is based on a system of five coupled nonlinear reaction-diffusion equations under non steady-state conditions for enzyme reactions occurring in potentiometric biosensor that describes the concentration of substrate and hydrolysis products within the membrane. New approximate analytical expressions for the concentration of the substrate (organophosphorus pesticides (OPs)) and products are derived for all values of Thiele modulus and buffer concentration using new approach of homotopy perturbation method. The analytical results are also compared with numerical ones and a good agreement is obtained. The obtained results are valid for the whole solution domain.
