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Flow mechanism and back gap windage loss of a sCO2 radial inflow turbine with impeller scallops 带扇贝叶轮的 sCO2 径向流入涡轮机的流动机制和背隙风蚀损失
IF 3.4 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2024-11-08 DOI: 10.1016/j.supflu.2024.106453
Zhuobin Zhao , Jianxin Liao , Qinghua Deng , Jun Li , Zhenping Feng
The Internal flow mechanisms and windage loss in impeller back gap of a supercritical carbon dioxide (sCO2) radial inflow turbine with scallops are comprehensively investigated in this paper. The study emphasizes the effects of scallop depth and leakage outlet pressure. The results indicate that scallop structures lead to a degradation in overall turbine performance. Under design conditions, a turbine with a scallop depth ratio of 0.5 exhibits a 3.7 % reduction in efficiency and a 3.4 % decrease in total power compared to no scallop configuration. Furthermore, as scallop depth increases, the skin friction coefficient decreases in the disk gap while it increases for the seal in the impeller back gap. Increasing leakage outlet pressure reduces the leakage flow rate and skin friction coefficient. Fitted models for skin friction coefficient are proposed respectively. The conclusions providing valuable insights for designing and optimizing sCO2 radial inflow turbines with scallops.
本文全面研究了带扇贝的超临界二氧化碳(sCO2)径流式水轮机叶轮背隙的内部流动机制和风蚀损失。研究强调了扇贝深度和泄漏出口压力的影响。结果表明,扇贝结构会导致涡轮机整体性能下降。在设计条件下,与无扇贝结构相比,扇贝深度比为 0.5 的涡轮机效率降低了 3.7%,总功率降低了 3.4%。此外,随着扇贝深度的增加,圆盘间隙的表皮摩擦系数降低,而叶轮后间隙密封的表皮摩擦系数增加。增加泄漏出口压力会降低泄漏流速和表皮摩擦系数。分别提出了表皮摩擦系数的拟合模型。结论为设计和优化带扇贝的 sCO2 径向流入水轮机提供了有价值的见解。
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引用次数: 0
Supercritical CO2 assisted bioMOF drug encapsulation and functionalization for delivery with a synergetic therapeutic value 超临界二氧化碳辅助生物MOF药物封装和功能化,实现具有协同治疗价值的递送
IF 3.4 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2024-11-05 DOI: 10.1016/j.supflu.2024.106452
Albert Rosado , Luis García-Fernández , María Rosa Aguilar , Rosa Ana Ramírez , Ana M. López-Periago , José A. Ayllón , Concepción Domingo
Despite the impressive characteristics of biological metal organic frameworks (bioMOFs) for their use as drug delivery systems (DDs), there are still some parameters related to their structural stability and processing routes that have decelerated their realistic application in this field. Both drawbacks are unraveled in this work for the microporous bioMOF CaSyr-1 by using supercritical CO2 (scCO2) to load the bioMOF with the anti-tubercular isoniazid (INH) drug, and functionalize its external surface with a hydrophobic protective layer of stearate (S). The hydrophobicized CaSyr-1(INH)/S vehicle is further coated with a neutral surfactant (PS60) to enhance the wettability of the system. In vitro tests, related to drug carrier biocompatibility and drug release in body simulated fluids, are performed to demonstrate potential prospective of the designed DDs in pharmacy. The synthetized product displayed total biocompatibility even at high concentrations, and the particle size and dissolution rate showed to be adequate for pulmonary administration.
尽管生物金属有机框架(bioMOFs)在用作给药系统(DDs)方面具有令人印象深刻的特性,但仍有一些与结构稳定性和加工路线相关的参数阻碍了它们在这一领域的实际应用。本研究利用超临界二氧化碳(scCO2)将抗结核异烟肼(INH)药物装入微孔生物MOF CaSyr-1,并在其外表面添加疏水性硬脂酸盐(S)保护层,从而解决了这两个问题。疏水性 CaSyr-1(INH)/S 载体上还涂有中性表面活性剂(PS60),以增强系统的润湿性。为了证明所设计的 DDs 在制药领域的潜在前景,我们进行了与药物载体生物相容性和药物在模拟体液中的释放有关的体外测试。合成的产品即使在高浓度下也能显示出完全的生物相容性,其粒度和溶解速率也足以满足肺部给药的需要。
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引用次数: 0
Supercritical CO2 green solvent extraction of Nepeta crispa: Evaluation of process optimization, chemical analysis, and biological activity 超临界二氧化碳绿色溶剂萃取脆山羊:工艺优化、化学分析和生物活性评估
IF 3.4 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2024-11-04 DOI: 10.1016/j.supflu.2024.106451
Saeid Matinfard , Hamid Tavakolipour , Gholamhossein Sodeifian , Seyed Ali Sajadian , Ramezan Kalvandi
This research investigates the extraction of compounds from Nepeta crispa (N. crispa), utilizing supercritical carbon dioxide green solvent, for the first time. Using RSM, the study examines the impact of pressure (15–25 MPa), temperature (313–333 K), and co-solvent (0.5–3.5%) on the extraction yield. The antioxidant activity of the essential oil is assessed through Ferric Reducing Antioxidant Power (FRAP) assay, while its antibacterial properties are evaluated against four bacterial strains. The SCFE method achieved a maximum yield of 1.812 % at optimum conditions (P= 25 MPa, T= 313 K and co-solvent= 3.5%). GC-Mass analysis revealed that the primary constituents of N. crispa essential oil which are 1,8-cineol and 4aα,7α,7aα-nepetalactone in both extraction methods. The antioxidant and antibacterial results of N. crispa showed the superiority of SC-CO2 over hydrodistillation method. These observed antioxidant and antibacterial attributes highlight the plant’s potential suitability for applications within the food and pharmaceutical industries.
本研究首次利用超临界二氧化碳绿色溶剂从酥树蕨(Nepeta crispa)中提取化合物。该研究利用 RSM 分析了压力(15-25 兆帕)、温度(313-333 K)和助溶剂(0.5-3.5%)对萃取率的影响。通过铁还原抗氧化力(FRAP)测定法评估了精油的抗氧化活性,同时评估了精油对四种细菌菌株的抗菌特性。在最佳条件下(P= 25 兆帕、T= 313 K 和助溶剂= 3.5%),SCFE 法的最高产率为 1.812%。气相色谱-质谱分析表明,两种萃取方法中,酥树精油的主要成分都是 1,8-松油醇和 4aα,7α,7aα-epetalactone。N. crispa 的抗氧化和抗菌结果表明 SC-CO2 萃取法优于水蒸馏法。这些观察到的抗氧化和抗菌特性凸显了该植物在食品和制药行业应用的潜在适宜性。
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引用次数: 0
An experimental methodology to validate the use of hydroethanolic mixtures as suspending medium / modifier for the supercritical CO2 extraction of suspensions 验证水乙醇混合物作为悬浮介质/改性剂用于超临界二氧化碳萃取悬浮液的实验方法
IF 3.4 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2024-10-28 DOI: 10.1016/j.supflu.2024.106423
Marco Antonio Mamani , José Manuel del Valle , Paulo Aravena , Roberto Canales
We developed a methodology to study the extraction of high-value solutes directly from suspensions of finely disrupted substrates. For that, we modelled the high-pressure phase equilibrium for the ternary (CO2 + ethanol + water) system using experimental literature data. Different compositions of hydroethanolic mixture and CO2 were loaded into an extraction vessel set at 30–35 MPa and 40–50 °C during static extraction, and a gaseous mixture with the composition of the CO2-rich gaseous phase in the extraction vessel was continuously fed during dynamic extraction. Losses of the fed hydroethanolic mixture occurred mainly during dynamic extraction (10–30 wt%) and were properly distributed to account for actual flows and compositions of experimental streams. Mostly, equilibrium conditions were reached following about 1 h of the 2-h dynamic extraction, and good reproducibility was achieved. In conclusion, equilibrium is reached in which two phases coexist in equilibrium within the extraction vessel: a water-rich liquid phase and a CO2-rich gaseous phase.
我们开发了一种方法来研究直接从细微破碎基质悬浮液中萃取高价值溶质的过程。为此,我们利用实验文献数据模拟了三元(二氧化碳+乙醇+水)体系的高压相平衡。在静态萃取过程中,将不同成分的水乙醇混合物和二氧化碳装入萃取容器中,萃取容器的压力设定在 30-35 兆帕,温度设定在 40-50 °C;在动态萃取过程中,持续注入与萃取容器中富含二氧化碳的气相成分相同的气体混合物。进料氢乙醇混合物的损耗主要发生在动态萃取过程中(10-30 wt%),并根据实验流的实际流量和成分进行了适当分配。大多数情况下,在 2 小时的动态萃取过程中,经过约 1 小时就达到了平衡条件,并实现了良好的重现性。总之,萃取容器内的两相(富含水的液相和富含二氧化碳的气相)达到平衡共存。
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引用次数: 0
Use of deuterated water to prove its role as hydrogen donor during the hydrothermal upgrading of oil shale at supercritical conditions 利用氘水证明其在超临界条件下油页岩热液提质过程中的供氢作用
IF 3.9 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2023-10-29 DOI: 10.1016/j.supflu.2023.106092
Richard Djimasbe , Mikhail A. Varfolomeev , Nailya M. Khasanova , Ameen A. Al-Muntaser , Rustam R. Davletshin , Muneer A. Suwaid , Gazinur Z. Mingazov

This paper corroborates the capability of supercritical water to generate active hydrogen that interact with the different fractions involved in unconventional feedstocks such as oil shale during the hydrothermal reactions by using supercritical deuterated water (SCDW). Experiments were conducted in an autoclave reactor at a temperature of 380 ºC and a time of 1–12 h. The products were assessed using various methods. The findings indicate that 15.30% of deuterium (D) was involved in the reaction of synthetic oil production and that oil samples are characterized by the presence of heteroatoms (N and O) most derived from kerogen. It found that the generation of synthetic oil is perturbed by carbonate species and a maximal yield of 16.78% is reached at 6 h. FTIR revealed that during hydrothermal upgrading of oil shale, the conversion of resins consumes more molecules of D than asphaltenes. According to EPR, Fe2+ and Mn2+ particles haven't played much role in the upgrading process.

本文证实了超临界水利用超临界氘水(SCDW)在水热反应过程中产生活性氢的能力,该活性氢与油页岩等非常规原料中的不同馏分相互作用。实验在高压釜反应器中进行,温度为380ºC,时间为1-12小时。使用各种方法对产品进行评估。研究结果表明,15.30%的氘(D)参与了合成石油生产的反应,石油样品的特征是存在主要来源于干酪根的杂原子(N和O)。研究发现,合成油的生成受到碳酸盐物种的干扰,在6h时达到16.78%的最大产率。FTIR表明,在油页岩水热改质过程中,树脂的转化消耗的D分子比沥青质多。根据EPR,Fe2+和Mn2+颗粒在升级过程中没有发挥太大作用。
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引用次数: 0
P-T-x measurement and modelling of (methane + propane + methanol + water + TEG) and (methane + propane + carbon dioxide + methanol + water + TEG) systems (甲烷+丙烷+甲醇+水+ TEG)和(甲烷+丙烷+二氧化碳+甲醇+水+ TEG)系统的P-T-x测量和建模
IF 3.9 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2023-10-05 DOI: 10.1016/j.supflu.2023.106086
Paul Zvawanda , Paramespri Naidoo , Wayne M. Nelson , Kuveneshan Moodley

Phase equilibria data for multicomponent mixtures containing methane, propane, carbon dioxide, methanol, water, 2,2′-(Ethane-1,2-diylbis(oxy))diethanol) or triethylene glycol at high-pressure conditions typical to natural gas treating and transportation systems are not readily available in the literature. These data are essential as they contribute to the information required for the process design, control and monitoring of methanol and/or TEG in gas conditioning systems. In this study, new phase equilibria data were measured and modelled for methane + propane + methanol + water + TEG and methane + propane + carbon dioxide + methanol + water + TEG systems over a temperature range of 283.15–323.15 K and pressures up to 14 MPa. The static synthetic method was utilised for the P-T-x measurements and the data were modelled using the Cubic Plus Association model. The modelling approach included regression of binary interaction parameters for relevant binary pairs.

含有甲烷、丙烷、二氧化碳、甲醇、水、2,2′-(乙烷-1,2-二基双(氧))二乙醇)或三甘醇的多组分混合物在天然气处理和输送系统典型的高压条件下的相平衡数据在文献中并不容易获得。这些数据是必不可少的,因为它们有助于气体调节系统中甲醇和/或TEG的工艺设计、控制和监测所需的信息。在这项研究中,在283.15–323.15 K的温度范围和高达14 MPa的压力下,对甲烷+丙烷+甲醇+水+TEG和甲烷+丙烷-二氧化碳+甲醇+水中+TEG系统的新相平衡数据进行了测量和建模。P-T-x测量采用静态合成方法,数据采用Cubic Plus Association模型建模。建模方法包括对相关二元对的二元相互作用参数进行回归。
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引用次数: 0
Supercritical CO2 sterilization under low temperature and pressure conditions 低温、低压条件下的超临界CO2灭菌
IF 3.9 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2023-10-04 DOI: 10.1016/j.supflu.2023.106084
Victorine Warambourg , Adil Mouahid , Christelle Crampon , Anne Galinier , Magalie Claeys-Bruno , Elisabeth Badens

Sterilization using supercritical carbon dioxide has been proven to be efficient for decades now. The aim of this work was to implement a process of sterilization adapted to thermosensitive polymeric materials and highlight the lowest conditions of pressure and temperature which would enable a bacterial reduction higher than 6-log. Inactivation experiments were performed on spores of Bacillus subtilis over a pressure range lying from 60 to 200 bar, and a temperature varying from 35° to 60°C, with and without additive. Preliminary experiments allowed us to determine a restricted experimental domain used for the design of the experiments, investigating the influence of pressure, temperature, process duration, and additive content on bacterial reduction. It was shown that sterilization conducted at 110 bar, 40 °C, for 20 min with 200 ppm of H2O2, leading to a bacterial reduction of 8.73-log, may be considered as optimal for IMD sterilization.

几十年来,使用超临界二氧化碳进行杀菌已被证明是有效的。这项工作的目的是实施一种适用于热敏聚合物材料的灭菌工艺,并强调最低的压力和温度条件,这将使细菌减少率高于6-log。在60至200巴的压力范围和35°至60°C的温度范围内,在添加和不添加添加剂的情况下,对枯草芽孢杆菌的孢子进行灭活实验。初步实验使我们能够确定用于实验设计的受限实验领域,研究压力、温度、工艺持续时间和添加剂含量对细菌还原的影响。研究表明,在110巴、40°C、200 ppm H2O2下灭菌20分钟,细菌减少8.73-log,可被认为是IMD灭菌的最佳选择。
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引用次数: 0
Supercritical carbon dioxide fluid-assisted green production and dyeing of N,4-dialkyl-substituted 1,8-naphthalimide derivatives 超临界二氧化碳流体辅助下N,4-二烷基取代的1,8-萘酰亚胺衍生物的绿色生产和染色
IF 3.9 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2023-10-04 DOI: 10.1016/j.supflu.2023.106085
Yulan Qian , Ye Yuan , Junyang Zhu , Jinglong Li , Chengqi Jiao , Xiaoqing Xiong

In this study, three N,4-dialkyl-substituted 1,8-naphthalimide fluorescent dyes (NPBA, NPHA, and NPOA) were synthesized in supercritical carbon dioxide (scCO2) by reacting 4-bromo-1,8-naphthalic anhydride with three amines (n-butylamine, n-hexylamine, and n-octylamine). The optimal reaction conditions and highest yields of these dyes were obtained. The yield of NPHA was 92% ± 0.57% using an organic solvent-free synthetic method. The results also indicate that the reaction time was gradually shortened by elongating the alkyl chain in the amines, and the required reaction pressure was 12 MPa or lower. Additionally, the dyeing of polyester fabrics with these three dyes was investigated using scCO2. The optimal dyeing time and temperature for NPBA were 70 min and 150 ℃, but they decreased at 10 gradients with the addition of two carbon atoms to the alkyl chain in the amines. The optimal dyeing pressure increased from 20 MPa to 24 MPa.

在超临界二氧化碳(scCO2)中,通过4-溴-1,8-萘酸酐与3种胺(正丁胺、正己胺和正辛胺)反应,合成了3种N,4-二烷基取代的1,8-萘酰亚胺荧光染料(NPBA、NPHA和NPOA)。得到了这些染料的最佳反应条件和最高收率。采用有机无溶剂合成法,NPHA的产率为92%±0.57%。结果还表明,通过延长胺中的烷基链,反应时间逐渐缩短,所需反应压力为12 MPa或更低。此外,还研究了这三种染料在scCO2环境下对涤纶织物的染色。NPBA的最佳染色时间和温度分别为70 min和150℃,但随着在胺的烷基链上加入两个碳原子,其染色温度和时间呈10个梯度递减。最佳染色压力由20 MPa提高到24 MPa。
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引用次数: 0
Cocrystal formation of niclosamide and urea in supercritical CO2 and impact of cosolvent 氯硝柳胺与尿素在超临界CO2中的共晶形成及共溶剂的影响
IF 3.9 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2023-10-01 DOI: 10.1016/j.supflu.2023.106029
L. MacEachern , A. Kermanshahi-pour , Mahmoud Mirmehrabi , L. Ajiboye , V. Trivedi , S. Rohani , Q. He

A cocrystal of niclosamide and urea was attempted for the first time using a crystallization in supercritical solvent (CSS). Experiments were conducted at 40 °C or 60 °C between 3.3 and 29.4 MPa in CO2. Cocrystal formation showed a dependence on the state of CO2 with no cocrystal formation below the critical point and consistently showed partial conversion above the critical point. The addition of 0.5 mL (2.7–3.5 mol%) cosolvent was found to have significant impact on cocrystal formation at 40 °C and 20 MPa. Addition of 2-propanol increased cocrystal formation by between 50 % and 60 % compared to neat scCO2, while cyclohexane reduced cocrystal formation by between 20 % and 35 %, and water completely hindered cocrystal formation. The impact of hold time, cosolvent, solubility in relation to ternary phase diagrams, and inter- and intra-molecular hydrogen bonding are discussed.

首次尝试在超临界溶剂(CSS)中结晶氯硝柳胺和尿素。实验在40°C或60°C、3.3至29.4MPa的CO2中进行。共晶形成显示出对CO2状态的依赖性,在临界点以下没有共晶形成,并且在临界点以上始终显示出部分转化。发现添加0.5 mL(2.7–3.5 mol%)共溶剂对40°C和20 MPa下的共晶形成有显著影响。与纯scCO2相比,2-丙醇的加入使共晶的形成增加了50%至60%,而环己烷使共晶形成减少了20%至35%,并且水完全阻碍了共晶形成。讨论了保持时间、助溶剂、溶解度与三元相图以及分子间和分子内氢键的关系。
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引用次数: 0
Lentil protein concentrate + pectin gels dried with SC-CO2: Influence of protein-polysaccharide interactions on the characteristics of aerogels 用SC-CO2干燥的扁豆浓缩蛋白+果胶凝胶:蛋白质-多糖相互作用对气凝胶特性的影响
IF 3.9 3区 工程技术 Q2 CHEMISTRY, PHYSICAL Pub Date : 2023-10-01 DOI: 10.1016/j.supflu.2023.106006
Srujana Mekala, Marleny D.A. Saldaña

This study investigated the interactions of lentil protein concentrate (LPC) and pectin hydrogels and their influence on the physico-chemical characteristics of aerogels. First, emulsion gels were formed using high-intensity ultrasound (HIUS) and the impact of HIUS nominal power, and concentrations of LPC and pectin on the gelation were evaluated. Then, the emulsion gels were dried using supercritical CO2 (SC-CO2) and the density, surface area, crystallinity index, microstructure and oil and water absorption capacities of the aerogels formed were evaluated. Overall, there was no significant effect of HIUS power on the viscoelastic behavior of the emulsion gels. The emulsion gels exhibited shear-thinning behavior and had thermo-reversible property. The FT-IR spectra of the aerogels showed predominant β-sheets, responsible for the non-covalent bond formation. The aerogels had semi-crystalline structure, densities of 0.0009–0.003 g/mm3 and surface area of 2.4–7.6 m2/g. The LPC-pectin interactions can be explored to form tailor-made aerogels for bioactive delivery.

本研究研究了扁豆浓缩蛋白(LPC)与果胶水凝胶的相互作用及其对气凝胶物理化学特性的影响。首先,使用高强度超声(HIUS)形成乳液凝胶,并评估HIUS标称功率以及LPC和果胶的浓度对凝胶化的影响。然后,使用超临界CO2(SC-CO2)干燥乳液凝胶,并评估所形成的气凝胶的密度、表面积、结晶度指数、微观结构以及吸油和吸水能力。总体而言,HIUS功率对乳液凝胶的粘弹性行为没有显著影响。乳液凝胶表现出剪切稀化行为,并具有热可逆性质。气凝胶的FT-IR光谱显示出主要的β-片,负责非共价键的形成。气凝胶具有半结晶结构,密度为0.0009–0.003 g/mm3,表面积为2.4–7.6 m2/g。可以探索LPC-果胶相互作用,以形成用于生物活性递送的特制气凝胶。
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引用次数: 0
期刊
Journal of Supercritical Fluids
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