Article
Chemistry, Physical
Zhengrun Chen, Hongru Zhang, Huiyuan Li, Ying Xu, Yuanyuan Shen, Zhaoyou Zhu, Jun Gao, Yixin Ma, Yinglong Wang
Summary: The study explored the feasibility of ionic liquids as green solvents extractants, examining the extraction efficiency through calculation models and experimental data analysis, and discussed the rationality of selecting solvents from a molecular level.
GREEN ENERGY & ENVIRONMENT
(2021)
Article
Engineering, Chemical
Lianzheng Zhang, Jie Wang, Lin Yang, Dongmei Xu, Yixin Ma, Jun Gao, Yinglong Wang
Summary: Based on the COSMO-SAC model, 1-ethyl-3-methylimidazolium acetate and 1-ethyl-3-methylimidazolium p-toluenesulfonate were selected as entrainers to investigate the separation of isopropyl alcohol and isopropyl acetate azeotrope. Experimental measurements showed that the use of ILs enhanced the relative volatility of the azeotrope and eliminated the azeotropic point. The thermodynamic correlation of the systems containing ILs was explored using the NRTL model, which demonstrated its extensive applicability.
CHINESE JOURNAL OF CHEMICAL ENGINEERING
(2022)
Article
Engineering, Chemical
Gangqiang Yu, Zhong Wei, Kai Chen, Ruili Guo, Zhigang Lei
Summary: This review introduces predictive thermodynamic models for ILs, focusing on UNIFAC- and COSMO-based models and various applications. The review provides a theoretical perspective on the structure-property relationships from a multi-scale viewpoint.
Article
Chemistry, Physical
Miguel Ayuso, Sara Mateo, Alejandro Belinchon, Pablo Navarro, Jose Palomar, Julian Garcia, Francisco Rodriguez
Summary: Obtaining aromatic hydrocarbons from refinery streams is a major concern in the petrochemical industry. Organic solvents and ionic liquids are commonly used for liquid-liquid extraction, but their limitations hinder industrial implementation. Cyclic carbonates have emerged as a potential solution due to their CO2 fixation capabilities and desirable properties. However, experimental data is limited and predictive models are used. This study experimentally determined the extractive properties of five cyclic carbonates and used predictive models to simulate the aromatic extraction process.
JOURNAL OF MOLECULAR LIQUIDS
(2023)
Article
Thermodynamics
Huiyuan Li, Yanli Zhang, Yuanyuan Shen, Zhengrun Chen, Zhaoyuan Ma, Zhaoyou Zhu, Yinglong Wang
Summary: This study focused on using ionic liquids to separate n-heptane and DMC, determining activity coefficients, calculating separation and distribution coefficients, analyzing the extraction mechanism, and measuring experimental data. The research laid a foundation for the large-scale application of green solvents and provided theoretical guidance for the computer-aided selection of solvents with good separation effects.
FLUID PHASE EQUILIBRIA
(2022)
Article
Engineering, Chemical
Ying-Chieh Hung, Chieh-Ming Hsieh, Hiroshi Machida, Shiang-Tai Lin, Yusuke Shimoyama
Summary: This study investigates the phase behavior of phase separation solvents before and after CO2 absorption using a predictive model. The results reveal that the hydrophilicity of amines affects the molecular interactions and miscibility of the solvents. The study suggests that amines with balanced interactions with water and glycol ether are potential candidates for CO2 capture phase separation solvents.
JOURNAL OF THE TAIWAN INSTITUTE OF CHEMICAL ENGINEERS
(2022)
Article
Engineering, Chemical
Yasen Dai, Zhengrun Chen, Xingyi Liu, Jiafu Xing, Yuyang Jiao, Dingchao Fan, Zhaoyou Zhu, Peizhe Cui, Yanyue Lu, Yinglong Wang
Summary: The study investigates the interaction between different ionic liquids and methyl tert butyl ether/methanol, confirming the key role of anions in the extraction process. Molecular dynamics simulations are shown to predict extraction performance accurately, even without phase equilibrium data. Furthermore, ionic liquid liquid-liquid extraction proves to be a cost-saving alternative in comparison to conventional solvents.
SEPARATION AND PURIFICATION TECHNOLOGY
(2021)
Article
Engineering, Chemical
Ying-Chieh Hung, Chieh-Ming Hsieh, Hiroshi Machida, Shiang-Tai Lin, Yusuke Shimoyama
Summary: A predictive approach based on COSMO-SAC has been developed to simulate the CO2 capture process using phase separation solvents, successfully describing the behavior of phase separation and CO2 solubility.
JOURNAL OF THE TAIWAN INSTITUTE OF CHEMICAL ENGINEERS
(2022)
Article
Thermodynamics
Anne C. Belusso, Silvana Mattedi, Rafael de P Soares, Paula B. Staudt
Summary: Research on ionic liquids has increased significantly in the past decade, but there is still a lack of phase equilibria data for many systems. This study measured the vapor-liquid equilibria for water in four protic ionic liquids using the hygrometric method. The NRTL model parameters were estimated using the VLE data, and the COSMO-SAC model showed semi-quantitative agreement with the experimental values, indicating its potential as an alternative in the absence of experimental information.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2023)
Article
Thermodynamics
Marcela C. Ferreira, Ariel A. C. Toledo Hijo, Fabiane O. Farias, Eduardo A. C. Batista, Guilherme J. Maximo, Antonio J. A. Meirelles
Summary: This study investigates the use of protic FA-based IL as a solvent for deacidification of vegetable oils. The experimental results show that IL has good deacidification efficiency, and the model can well describe the liquid-liquid equilibrium of the system. Therefore, protic FA-based ILs may have potential applicability as alternative solvents for deacidification of crude vegetable oils.
FLUID PHASE EQUILIBRIA
(2022)
Article
Engineering, Chemical
Pablo Navarro, Daniel Moreno, Marcos Larriba, Julian Garcia, Francisco Rodriguez, Roberto I. Canales, Jose Palomar
Summary: There is a lack of knowledge on comprehensive studies of ionic liquids and extraction processes. This study applies the computational COSMO-based/Aspen multiscale methodology to analyze a wide set of 100 common ILs in the aromatic/aliphatic separation field. The analysis reveals the evolution from extractive properties to extractor behavior, the influence of the model's rigor, the role of IL at commercial specifications, and the role of the separation train.
SEPARATION AND PURIFICATION TECHNOLOGY
(2023)
Article
Engineering, Chemical
Di Zhao, Chen Liu, Yonggang Wang, Haiyong Zhang
Summary: In this study, ionic liquids were utilized to separate anthracene and carbazole, resulting in highly efficient solvents with improved purity of the refined compounds. The separation mechanism of anthracene and carbazole was also discussed in detail, showcasing the potential of ILs in chemical industry applications.
SEPARATION AND PURIFICATION TECHNOLOGY
(2022)
Article
Chemistry, Physical
Shisheng Liang, Huiyuan Li, Yanli Zhang, Dingchao Fan, Yangyang Liu, Xianlong Wang, Zhaoyou Zhu, Yinglong Wang, Jianguang Qi
Summary: The application of ionic liquids (ILs) in extracting and separating n-butanol from octane was investigated. Surface charge density distributions, activity coefficients, distribution coefficients, and separation coefficients were calculated to understand the extraction mechanism of ILs. Molecular-scale analysis of intermolecular interactions provided insights into the separation mechanism of ILs.
JOURNAL OF MOLECULAR LIQUIDS
(2022)
Article
Thermodynamics
Ruben Santiago, Ismael Diaz, Maria Gonzalez-Miquel, Pablo Navarro, Jose Palomar
Summary: Biocompatible ionic liquids (bio-ILs) have emerged as a sustainable alternative for greener solvents in the chemical industry, with bio-ILs based on choline showing promising applications in gas absorption and liquid-liquid extraction processes.
FLUID PHASE EQUILIBRIA
(2022)
Article
Engineering, Chemical
Kyrylo Klimenko, Joao Miguel Ines, Jose M. S. S. Esperanca, Joao Aires-de-Sousa, Goncalo V. S. M. Carrera
Summary: The study developed a database for S-infinity by processing activity coefficients at infinite dilution from free available sources. The results show that there is an approximate 80% chance that a selective IL, according to S-infinity, will be selective in liquid-liquid extraction. There is a difference in translation from S-infinity to selectivity which was analyzed with respect to the chemical classes of azeotrope components.
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
(2021)
Article
Engineering, Chemical
Hui Yang, Dan Wang, Jun Gao, Lianzheng Zhang, Tao Zhang, Dongmei Xu, Yinglong Wang
Summary: To reduce the emission of nitrogen oxides (NOx) produced from the combustion of nitrogen compounds (NCs) in fossil fuels, it is important to decrease the NCs content. In this study, three different anions-based protic ionic liquids (PrILs) were synthesized and used as extractants to extract pyridine. The results indicate that the hydrogen bond formed between pyridine and the three PrILs is the main driving force for the extraction of pyridine from the model mixtures.
CHEMICAL ENGINEERING & TECHNOLOGY
(2023)
Article
Energy & Fuels
Peng Gao, Jun Zhang, Zhiqun Guo, Jun Gao, Dongmei Xu, Yixin Ma, Lianzheng Zhang, Yinglong Wang
Summary: This study used morpholine-based ionic liquids as green extractants for NHNCs. It was found that 1-butyl-1-methyl morpholinium thiocyanate showed the best extraction performance. The mechanism of extraction between the ionic liquid and NHNCs was explored using density functional theory.
Article
Biotechnology & Applied Microbiology
Pingping Zhao, Xiaoxin Wang, Qiang Wang, Lianzheng Zhang, Dongmei Xu, Jun Gao
Summary: A series of ionic liquid (IL) extractants were developed for the removal of sulfides from fuels. The ILs, synthesized with functionalized 1,8-diazabicyclo[5.4.0]undecano-7-ene (DBU) cations and large volume difluoromethane sulfonimide (NTf2) anion, showed good performance in removing benzothiophene (BT), thiophene (TH), and dibenzothiophene (DBT) in model oil.
JOURNAL OF CHEMICAL TECHNOLOGY AND BIOTECHNOLOGY
(2023)
Article
Green & Sustainable Science & Technology
Yixin Ma, Huaqing Qi, Jifu Zhang, Peizhe Cui, Zhaoyou Zhu, Yinglong Wang
Summary: In light of the escalating number of end-of-life tires and their environmental impact, this study proposes a disposal process that utilizes plasma gasification to convert these tires into syngas and generate hydrogen. Comparing the effects of oxygen and air versus steam and air on hydrogen production, it was found that using steam and air as the gasification agent yielded a carbon conversion rate, energy recovery rate, and exergy efficiency of 99.12%, 93.67%, and 80.04% respectively. Moreover, a suitable carbon capture process was explored, with results showing that the monoethanolamine absorption process outperformed Rectisol in terms of CO2 capture rate. However, the monoethanolamine absorption process had a lower exergy efficiency of 40.04% compared to Rectisol. The most efficient process for hydrogen production from end-of-life tires by plasma gasification involved steam and air as the gasification agent and integrated Rectisol for carbon capture, with a total exergy efficiency of 36.45%. This study provides theoretical support for end-of-life tire management and pollution reduction.
JOURNAL OF CLEANER PRODUCTION
(2023)
Article
Green & Sustainable Science & Technology
Zaifeng Xu, Yaru Zhou, Kexin Yin, Jifu Zhang, Zhaoyou Zhu, Yinglong Wang, Peizhe Cui
Summary: This study investigated two food waste treatment processes, plasma gasification hydrogen production and plasma gasification coupled with chemical looping, for converting food waste into high-quality hydrogen energy. The exergy, economic, and environmental benefits of the hydrogen production system were analyzed using Aspen Plus software simulation. Plasma gasification technology exhibits a high production capacity and economic input, while plasma gasification coupled with chemical looping can alleviate electricity consumption and is more environmentally friendly. The proposed novel process promotes food waste resource treatment and energy reuse.
JOURNAL OF CLEANER PRODUCTION
(2023)
Article
Engineering, Chemical
Yixin Ma, Jinfeng Liu, Jun Gao, Dongmei Xu, Lianzheng Zhang, Zhishan Zhang, Yinglong Wang
Summary: The separation of acetone/n-heptane was studied, and it was found that the side-stream extractive distillation process using p-xylene as the entrainer showed the best economic and environmental performance for this separation.
JOURNAL OF THE TAIWAN INSTITUTE OF CHEMICAL ENGINEERS
(2023)
Article
Chemistry, Multidisciplinary
Peizhe Cui, Yaru Zhou, Tingting Song, Zaifeng Xu, Jifu Zhang, Yangyang Liu, Yinglong Wang, HuaQing Qi, Lei Han, Sheng Yang
Summary: This study proposes a low-carbon ammonia synthesis process based on the cold energy utilization of liquified natural gas regasification to reduce the high energy consumption of ammonia synthesis. The process uses the cold energy released from liquified natural gas regasification as the refrigeration source for the air separation unit and carbon capture and storage unit, improving the comprehensive energy utilization efficiency. The total efficiency of the process is 42.69%, with an ammonia production capacity of 35.07 t/h. The proposed process effectively solves the high energy consumption in ammonia synthesis and provides a valuable production route for low-carbon ammonia synthesis.
ACS SUSTAINABLE CHEMISTRY & ENGINEERING
(2023)
Article
Energy & Fuels
Peng Gao, Lin Yang, Jixiang Wang, Jun Gao, Dongmei Xu, Linzheng Ma, Lianzheng Zhang, Yinglong Wang
Summary: It is important to develop sustainable denitrogenation technology due to the impact of nitrogen compounds on the quality of fuel oils. To address the issues of incomplete denitrogenation and harsh conditions, an extractive denitrogenation method using eco-friendly piperazine-based ionic liquids (Pi-based ILs) was developed. The study evaluated the performance of the synthesized Pi-based ILs in removing pyrrole from oil and investigated the conformational relationship between denitrogenation performance and ILs structure. The results showed that the eco-friendly [C1Pi][Lac] exhibited the highest removal efficiency of 95.90% under optimal denitrogenation conditions.
Article
Engineering, Chemical
Chao Sun, Jiafu Xing, Yajuan Qu, Yanli Zhang, Peizhe Cui, Yinglong Wang, Jun Gao
Summary: Deep eutectic solvents (DESs) were used to separate the azeotropes of dimethyl carbonate (DMC) and isopropyl alcohol (IPA). Liquid-liquid equilibrium (LLE) data was crucial in designing the separation process, and three appropriate DESs (ChCl-Urea, ChCl-Gly, ChCl-EG) were selected. LLE data of DMC-IPA-(ChCl-Urea), DMC-IPA-(ChCl-EG), and DMC-IPA-(ChCl-Gly) were obtained through experiments, and the binary interaction parameters were determined using the NRTL model. The extraction mechanism of the DESs and the formation mechanism of the combined structures (DES-IPA/DMC) were explored through ESP and AIM analysis.
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
(2023)
Article
Green & Sustainable Science & Technology
Jifu Zhang, Haiyang Cheng, Zaifeng Xu, Yaru Zhou, Kexin Yin, Xianlong Wang, Ying Gao, Chaoyue Sun, Yinglong Wang, Peizhe Cui
Summary: The amount of food waste generated annually has increased due to rapid urbanization, posing serious threats to the environment and human health. A novel combined cooling, heating, power, and dehumidification system based on food waste plasma gasification (PG) is proposed to address this issue. The system demonstrates high electrical, thermal, and exergy efficiencies, as well as effective removal of moisture, humidity, and CO2 from the food waste. It provides a new method for efficient utilization of food waste.
JOURNAL OF CLEANER PRODUCTION
(2023)
Article
Chemistry, Multidisciplinary
Yinglong Wang, Tianxiong Liu, Zihao Dong, Wenguang Zhu, Yusen Chen, Mengjin Zhou, Peizhe Cui, Zhaoyou Zhu
Summary: This study establishes a quantitative structure-property relationship (QSPR) model of ionic liquids (ILs) using molecular descriptors (MD), molecular identifiers (MI), and their combinations. The QSPR model, built by coupling deep neural network (DNN) and random forest (RF), shows the best performance when using MI to represent ILs and DNN. The Shapley additive explanation (SHAP) method is applied to analyze features and obtain valuable molecular structure information for prediction. Different MD and MI contribute differently in the prediction of H2S solubility and can correctly identify the impact of environmental factors (temperature and pressure). Additionally, the influence of different carbon chain lengths on the solubility of H2S is studied by calculating the electrostatic potential (ESP) between H2S and ILs.
ACS SUSTAINABLE CHEMISTRY & ENGINEERING
(2023)
Article
Engineering, Chemical
Tianxiong Liu, Dingchao Fan, Yusen Chen, Yasen Dai, Yuyang Jiao, Peizhe Cui, Yinglong Wang, Zhaoyou Zhu
Summary: In this study, a novel molecular structure encoding method was developed, and a convolutional autoencoder was used for denoising based on the structure of ionic liquids (ILs). Combined with three different machine learning algorithms (multilayer perceptron [MLP], random forest [RF], and support vector machine [SVM]), it showed better prediction performance for CO2 solubility in ILs than conventional cheminformatics descriptors. The SE-MLP model achieved the best performance with an R-2 value of 0.9873 and a mean square error of 0.0007.
Article
Thermodynamics
Peizhe Cui, Jifu Zhang, Yangyang Liu, Yaru Zhou, Zhaoyou Zhu, Jun Gao, Yinglong Wang
Summary: Clean-energy vehicles, such as hydrogen fuel cell vehicles and natural gas vehicles, contribute to reducing greenhouse gas emissions and environmental pollution. A life cycle assessment was conducted to compare the environmental performance of hydrogen FCV and NGV under different fuel production methods. The study found that hydrogen FCV had better environmental performance, especially when produced using wind-power-assisted electrolysis. The study also evaluated the environmental impact of the manufacturing process and provided insights for the sustainable development of these vehicles.
Article
Green & Sustainable Science & Technology
Haiyang Cheng, Jianhui Zhong, Yasen Dai, Yuyang Jiao, Zhaoyou Zhu, Peizhe Cui, Jianguang Qi, Yinglong Wang
Summary: This study developed a highly efficient separation of ethyl acetate/ethanol/water azeotrope using extractive distillation with a mixed solvent. The optimal process scheme was obtained through multi-objective optimization, considering both economy and environment. The results showed that the heat pump-assisted extractive distillation process had significant advantages in terms of gas emission reduction and energy consumption. This study is of great significance for the separation of high purity ethyl acetate and the recovery of wastewater.
JOURNAL OF CLEANER PRODUCTION
(2023)
Article
Chemistry, Multidisciplinary
Qinggang Xu, Jiafu Xing, Yuyang Jiao, Zihao Su, Yanli Zhang, Peizhe Cui, Jianguang Qi, Zhaoyou Zhu, Yinglong Wang, Yixin Ma
Summary: We proposed a heuristic predictive model based on TAC and LCA indexes to qualitatively screen the optimal entrainer for the extractive distillation process. It considers various factors such as relative volatility, tray number, hot steam consumption, green sustainability, and toxicity. The model can efficiently separate multi-component azeotropes and provides reference significance for the screening and application of deep eutectic solvents, ionic liquids, and their mixed solvents.
Article
Thermodynamics
J. N. Zappey, E. E. Moore, O. Benes, J. -c. Griveau, R. J. M. Konings
Summary: In this study, the heat properties of technetium metal were measured and analyzed using various thermal measurement methods, including its superconductivity, zero-degree Debye temperature, electronic heat capacity coefficient, and the standard entropy of the superconducting state.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Pengshuai Zhang, Jixiu Deng, Xiaoyu Jiang, Liang Xu, Yu Huang, Han Sun, Mi Gao, Xianghan Wang, Yulong Gao, Kangning Fan, Lu Zhang, Shuoye Yang
Summary: In this study, the solubility of daminozide in twelve neat solvents was determined using the gravimetrical method. Various models were employed to analyze the experimental solubility, and the miscibility of daminozide in the selected solvents was discussed based on Hansen solubility parameters. The results showed that the dissolution mechanism of daminozide in all solvents was entropy-driven.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Jinju Ma, Hao Wu, Dongxu Yi, Wei Liu, Xinding Yao, Tao Li, Baozeng Ren
Summary: In this study, the solubility and compatibility of Agomelatine in different solvents were investigated through experimental and simulation methods. The results showed that Agomelatine forms more stable hydrogen bonds with alcohol solvents compared to other ester solvents. Additionally, the study analyzed the acidity and basicity characteristics of Agomelatine as well as the reasons for differences in solubility.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Angelica V. Sharapova, Marina V. Ol'khovich, Svetlana V. Blokhina
Summary: This study determined the key physico-chemical properties of cardiovascular carvedilol (CVD) in terms of solubility and distribution coefficients in modeling solvents and biphasic systems. The results showed that the solubility of CVD varied significantly depending on the solvent and pH conditions, and the dissolution process deviated from ideality in saturated solutions.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Wenxi Song, Na Wang, Mingzhe Tan, Meng Wang, Xin Huang, Ting Wang, Hongxun Hao
Summary: The solubility and thermodynamic behavior of climbazole in different solvents were investigated in this study. The results showed that solubility is influenced by temperature and solvent properties. Furthermore, the solvent effect was evaluated and the molecular mechanism behind the solubility behavior was revealed using solvation energy relationship models and molecular simulation methods.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Yuqi Su, Weijie Jia, Junshuai Chen, Songtao Cao, Maogang He, Ying Zhang
Summary: This paper presents a novel measurement method based on the finite volume method (FVM) for measuring the concentration-dependent mutual diffusion coefficient D(C) in binary solution. The measurement principle was derived by integrating Fick's second law and establishing discretization equation. The method was validated through experiments and a semi-empirical correlation was built to study the temperature and concentration influences on the diffusion coefficient D.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Bo Tang, Xiaoyu Yao, Xueqiang Dong, Bowen Sheng, Yanxing Zhao, Jun Shen, Maoqiong Gong
Summary: In this study, metal-bellows variable volumetry was used to measure the saturated vapor pressures and critical parameters of R1234ze(Z) and R1336mzz(Z). New vapor pressure correlations were formulated based on the obtained data. The low uncertainties of the measured values indicate the reliability and reproducibility of the data. The results provide important thermophysical data for the use and optimization of R1234ze(Z) and R1336mzz(Z) in HTHP systems.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Vivek Pathania, Ankita Garg, Navneet Kaur, Neha
Summary: The interaction between Isoniazid and beta-cyclodextrin in solutions was investigated to understand the molecular interactions between different components. The results showed that the interaction between Isoniazid and beta-cyclodextrin affected the volume and compressibility of the solutions, and the hydration behavior of Isoniazid in the solutions was influenced by the cosolvent.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Mauricio Vega-Teijido, Marc E. Segovia, Martina Kieninger, Oscar N. Ventura
Summary: A composite chemical model, SVECV-f12, has been developed to accurately reproduce barrier heights of hydrocarbon species. The model successfully corrects systematic errors between experimental and theoretical values and is used for predicting formation enthalpies and hydrogenation/isomerization enthalpies.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Kemal Ozcan, Aylin Boztepe, Erdog an Tarcan, Cagatay Tasdemirci
Summary: In this study, the enthalpy of combustion of methane, the main component of natural gas, was measured using a reference gas calorimeter. The experimental results were compared with the values specified in ISO 6976:2016. The average enthalpy of combustion was determined as -55518.2 kJ kg-1 with an error of 0.2%.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Kouki Mekaru, Takuto Miyagi, Ayaka Mishima, Isami Uehara, Ryo Ohmura, Keita Yasuda
Summary: This study investigated the four-phase equilibrium conditions of carbon dioxide + cyclopentane double clathrate hydrate forming systems coexisting with sodium chloride aqueous solution or pure water. The results showed that the double clathrate hydrate is more thermodynamically stable than simple clathrate hydrates under a given sodium chloride concentration.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Yameng Wan, Xiaoqiang Gao, Ruiai Wang, Fanfan Li, Yanxun Li, Haixia He
Summary: This study evaluated the solubility of Iminostilbene (IMB) in twelve organic solvents and found that the solubility increased with temperature and showed a specific order in different solvents. The analysis of molecular interactions and solubility parameters provided insights into the dissolution behavior. The UNIQUAC model was used to fit the solubility data, and the thermodynamic properties of the mixing and dissolution processes were thoroughly evaluated.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Yinan Liu, Mingcheng Li, Chunying Zhu, Xiqun Gao, Youguang Ma
Summary: This study successfully prepared amine-based functionalized deep eutectic solvents and investigated the effects of solvent composition, water content, and temperature on the properties of the solvent through density and viscosity measurements. The results contribute to a better understanding of hydration and intermolecular interactions in deep eutectic solvents.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Correction
Thermodynamics
Deepak Parmar, Kavitha Kumari, Naveen Kumar, Manju Rani, Mustapha Sahal, Sanjeev Maken
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
Article
Thermodynamics
Ruslan N. Nagrimanov, Aliya R. Ibragimova, Boris N. Solomonov
Summary: In this study, the heats of solution of hydrocarbons and alcohols with 2-methyltetrahydrofuran are systematically analyzed. Structure-property relationships are developed to calculate the enthalpy of solvation of aliphatic alcohols in 2-methyltetrahydrofuran. Specific interactions in the alcohol-2-methyltetrahydrofuran systems are determined to better understand intermolecular interactions in 2-methyltetrahydrofuran solutions. This research provides valuable insights into the properties and energies of these interactions, facilitating the transition to more environmentally friendly solvents.
JOURNAL OF CHEMICAL THERMODYNAMICS
(2024)
