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Carbohydrate Polymers: Potential Green Solutions for Gas Hydrate Challenges 碳水化合物聚合物:天然气水合物挑战的潜在绿色解决方案
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c06423
Bahaeddine Mihoubi, , , Baojiang Sun, , , Md Mehedi Hasan, , and , Litao Chen*, 

Carbohydrate polymers have emerged as renewable, biodegradable materials with dual roles in gas hydrate management. This sustainable functionality positions them as a crucial alternative to conventional chemical inhibitors and promoters, which are often associated with significant ecological toxicity and environmental hazards. However, despite their potential, the literature lacks a comprehensive and systematic review that critically consolidates their dual role as both inhibitors and promoters while connecting fundamental research to practical application. To address this gap, this review provides a critical analysis of the current state of knowledge regarding carbohydrate polymers in gas hydrate systems. It comprehensively examines their dual roles as both kinetic inhibitors and promoters. The review also provides a foundational overview of gas hydrate structures and a classification of carbohydrate polymers, followed by a critical analysis of standard experimental methodologies, characterization techniques, and molecular dynamics simulations. Finally, this work underscores the potential of carbohydrate polymers to enable sustainable hydrate management technologies and identifies critical research gaps that must be addressed to develop them into cost-effective and high-performance solutions.

碳水化合物聚合物是一种可再生的、可生物降解的材料,在天然气水合物管理中具有双重作用。这种可持续的功能使它们成为传统化学抑制剂和促进剂的重要替代品,而传统化学抑制剂和促进剂通常具有重大的生态毒性和环境危害。然而,尽管它们具有潜力,但文献缺乏全面和系统的综述,以严格巩固它们作为抑制剂和启动子的双重作用,同时将基础研究与实际应用联系起来。为了解决这一差距,这篇综述提供了一个关于碳水化合物聚合物在天然气水合物体系知识的现状的关键分析。它全面考察了它们作为动力学抑制剂和促进剂的双重作用。该综述还提供了天然气水合物结构的基本概述和碳水化合物聚合物的分类,随后对标准实验方法、表征技术和分子动力学模拟进行了批判性分析。最后,这项工作强调了碳水化合物聚合物实现可持续水合物管理技术的潜力,并确定了必须解决的关键研究空白,以将其开发成具有成本效益和高性能的解决方案。
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引用次数: 0
Exploring Heat Release from Liquid Ammonia Injections Dual-Fueled with Heptane 以庚烷为双燃料的液氨注射剂的放热研究
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c06353
David Zilles*,  and , David Robert Emberson, 

Ammonia (NH3) has the potential to decarbonize combustion engines for deep-sea shipping as a noncarbonaceous fuel. The low reactivity of NH3 necessitates the use of a combustion-enhancing strategy. This study explores a dual-fuel approach using small heptane pilot injections to improve the ignition and combustion of liquid NH3 injections under typical compression ignition engine conditions. A novel constant volume combustion chamber with direct fuel injectors is used. Among other criteria, ignition delay time is defined and measured from heat release analysis. Spray interaction is controlled by various relative injection timings, relative injector rotation, and pilot umbrella spray angle. Seven- and Single-hole pilot injections are performed to reduce the consumption of pilot fuel, reaching ammonia energy shares of 45–96%. The fuel spray interaction, both spatially and temporally, is found to be crucial in controlling the heat release characteristics of NH3 combustion. To reduce pilot fuel consumption, it is essential to aim the combustion energy and hot combustion products at the locations of the NH3 spray. The results show that hot pilot combustion products should interact with (1) areas close to the nozzle, where strong NH3 evaporation cools the surrounding air, resulting in predominantly rich NH3/O2 mixtures that lack sufficient temperature to reach autoignition, or (2) regions with lean NH3 mixtures that fail to sustain a flame. In (1), small pilot injections are prone to extinction owing to the influence of ammonia evaporation. Because (2) requires continuous pilot interaction, it is recommended to avoid very lean zones in general and ignite NH3 in areas close to stoichiometry, thereby reducing the quenching potential near the chamber walls and crevices. The results were combined to propose an ideal multipoint injection strategy.

氨(NH3)作为一种非碳燃料,有可能使深海航运的内燃机脱碳。NH3的低反应性需要使用助燃策略。本研究探索了在典型压缩点火发动机工况下,采用小庚烷先导喷射的双燃料方法来改善液态NH3喷射的点火和燃烧。采用了一种新型的带直接喷油器的恒容燃烧室。在其他标准中,点火延迟时间是由热释放分析定义和测量的。喷雾相互作用由各种相对喷射时间、相对喷射器旋转和飞行员伞喷射角度控制。为了减少先导燃料的消耗,进行了七孔和单孔先导注入,使氨的能量占比达到45-96%。在空间和时间上,燃料喷雾相互作用对控制NH3燃烧的放热特性至关重要。为了减少中试燃料消耗,必须将燃烧能量和热燃烧产物对准NH3喷雾的位置。结果表明,热的中试燃烧产物应该与(1)靠近喷嘴的区域相互作用,在那里,强烈的NH3蒸发冷却了周围的空气,导致主要是富含NH3/O2的混合物,缺乏足够的温度来达到自燃,或者(2)含有少量NH3混合物的区域无法维持火焰。在(1)中,由于氨蒸发的影响,小导注容易熄灭。由于(2)需要连续的导爆相互作用,建议一般避开非常稀薄的区域,在接近化学计量的区域点燃NH3,从而降低室壁和缝隙附近的淬火电位。结合实验结果,提出了一种理想的多点注入策略。
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引用次数: 0
Divergent Thermal Damage Pathways in Coal-Measure Sandstone and Shale: Implications for High-Temperature Energy Subsurface Systems 煤系砂岩和页岩的不同热损伤路径:对高温能量地下系统的启示
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c06676
Arijit Sahoo, , , Ashutosh Tripathy*, , , Madhurima Mazumder, , , T. N. Singh, , and , Shiqi Liu, 

High-temperature conditions significantly influence the physicochemical and mechanical characteristics of rocks, directly affecting deep geological applications, such as UCG, CCUS, and nuclear waste management. This research investigates the divergent thermomechanical response of sandstone and shale from the Barakar Formation, Jharia Basin, India, exposed from room temperature to 700 °C. A comprehensive multitechnique approach utilizing UCS, BTS, ultrasonic velocity, LPGA, He Pycnometer, and SEM was employed to analyze the interplay of porosity, microstructure, and mechanical integrity with temperature. We propose a three-zone paradigm for thermal degradation using the integrated data set, which mechanistically describes the nonlinear evolution of both rock types. Zone 1 is a conditioning stage characterized by minimal microcracking, mineral stability, and the loss of absorbed water. Due to intergranular tightness, sandstone temporarily gains strength, whereas shale loses strength due to clay mineral dehydration. The key damage-acceleration window, Zone 2, is characterized by organic matter pyrolysis, clay dehydroxylation, the α–β quartz transition, and the rapid formation of interconnected fracture networks. Both rocks experience significant strength loss, while shale disintegrates catastrophically. In Zone 3, high-temperature reorganization occurs due to partial sintering or recrystallization of certain minerals, expansion of fracture networks, and material degradation. Due to bond reprecipitation, sandstone exhibits a slight strength recovery, although shale’s structural integrity is still impaired. The zone-based paradigm offers a mechanistic understanding of the temperature thresholds governing bulk instability and pore–mineral interactions. The thermal design and risk assessment in UCG, geothermal operations, nuclear waste repositories, and fire-damaged rock engineering are directly impacted by these findings.

高温条件会显著影响岩石的物理化学和力学特性,直接影响深层地质应用,如UCG、CCUS和核废料管理。本研究研究了印度Jharia盆地Barakar组砂岩和页岩在室温至700℃条件下的不同热力学响应。采用UCS、BTS、超声速度、LPGA、He Pycnometer和SEM等综合技术分析了孔隙度、微观结构和力学完整性与温度的相互作用。我们利用综合数据集提出了热降解的三区范式,该范式从机制上描述了两种岩石类型的非线性演化。区域1是一个调节阶段,其特点是微开裂最小,矿物稳定性和吸收水分的损失。由于粒间紧密性,砂岩暂时获得强度,而页岩由于粘土矿物脱水而失去强度。关键损伤加速窗口2区以有机质热解、粘土脱羟基化、α -β石英转变和互连裂缝网络的快速形成为特征。这两种岩石都经历了显著的强度损失,而页岩则灾难性地崩解。在3区,由于某些矿物的部分烧结或再结晶、断裂网络扩张和材料降解,高温重组发生。由于胶结再沉淀,砂岩的强度略有恢复,但页岩的结构完整性仍受到损害。基于区域的范式提供了对控制体不稳定性和孔隙-矿物相互作用的温度阈值的机制理解。这些发现直接影响到UCG、地热作业、核废料储存库和火灾破坏岩石工程的热设计和风险评估。
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引用次数: 0
β-Cyclodextrin Hydrothermal Carbon Microspheres/Polymer Composites for Filtration Loss Control in Ultrahigh-Temperature Water-Based Drilling Fluids β-环糊精水热碳微球/聚合物复合材料在超高温水基钻井液中的滤失控制
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c06569
Shaocong Pang, , , Jingyi Yu, , , Tianle Li, , , Liangliang Yan, , and , Yuxiu An*, 

Extreme high-temperature and high-salinity environments pose severe challenges for the field application of water-based drilling fluids. The thermal degradation of conventional polymer loss control agents is a key factor limiting their performance. The incorporation of nanomaterials offers a novel approach to enhance the high-temperature resistance of polymer loss control agents, making it a research hotspot in this field. In this study, a novel composite additive (DANT/HCM) was developed by physically blending β-cyclodextrin (β-CD) hydrothermal carbon microspheres (HCMs) with a comb-like polymer (DANT). Thermogravimetric analysis showed that DANT/HCM has excellent thermal stability. Structural characterization results reveal that oxygen-containing functional groups on the HCM surface form stable interfacial interactions with polymer segments via hydrogen bonding, conferring unique structural synergistic effects to the system. Scanning electron microscopy images showed that the HCM maintained an intact spherical structure after compositing. Performance tests showed that after aging at 240 °C, the filtration loss of the base mud with 1.5 wt % DANT/HCM was only 9.0 mL, significantly lower than the 20.8 mL of DANT alone. Additionally, this composite material exhibits excellent salt resistance, maintaining a filtration volume of 27 mL even in 30 wt % NaCl drilling fluid. Combined with the zeta potential, particle size distribution, and SEM analyses, the performance enhancement was mainly due to the enhanced thermal stability of the composite system, improved particle dispersion, and the formation of a dense, uniform filter cake structure. This study achieves highly efficient filtration loss reduction by introducing thermally stable, nanosized, water-based, thermally carbonized microspheres and combining them with long-chain comb polymers, thereby forming a unique synergistic loss reduction mechanism. It provides a theoretical basis and practical reference for the development of high-performance, high-temperature-resistant filtration loss reduction additives suitable for ultradeep wells and high-temperature environments and has a good prospect for engineering applications.

极端高温、高盐度环境对水基钻井液的现场应用提出了严峻挑战。传统聚合物减失剂的热降解是制约其性能的关键因素。纳米材料的加入为提高高分子减损剂的耐高温性能提供了新的途径,成为该领域的研究热点。本研究将β-环糊精(β-CD)水热碳微球(HCMs)与梳状聚合物(DANT)物理共混,制备了一种新型复合添加剂(DANT/HCM)。热重分析表明,DANT/HCM具有良好的热稳定性。结构表征结果表明,HCM表面的含氧官能团通过氢键与聚合物段形成稳定的界面相互作用,使体系具有独特的结构协同效应。扫描电镜图像显示复合后的HCM保持了完整的球形结构。性能试验表明,在240℃老化后,添加1.5% DANT/HCM的基础泥浆滤失量仅为9.0 mL,显著低于单独添加DANT的20.8 mL。此外,这种复合材料具有优异的耐盐性能,即使在30% NaCl的钻井液中也能保持27 mL的过滤体积。结合zeta电位、粒径分布和SEM分析,复合体系的性能增强主要是由于增强了热稳定性,改善了颗粒分散性,形成了致密均匀的滤饼结构。本研究通过引入热稳定、纳米级、水基、热碳化微球,与长链梳状聚合物结合,形成独特的协同降滤失机制,实现了高效降滤失。为开发适合超深井和高温环境的高性能耐高温降滤损添加剂提供了理论依据和实践参考,具有良好的工程应用前景。
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引用次数: 0
Breakthrough Zn(II) Catalyst for Direct Air Capture Employing CO2 Hydration 采用CO2水化直接捕集空气的突破性Zn(II)催化剂
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c06296
Priyabrata Biswal, , , Moushumi Sarma, , , Xin Gao, , , Saloni Bhatnagar, , , Sean R. Parkin, , , Kunlei Liu, , and , Jesse Thompson*, 

Direct air capture (DAC) represents a vital technology for atmospheric CO2 remediation, but few studies have tested catalysts at dilute atmospheric CO2 concentrations. Inspired by the carbonic anhydrase metalloenzyme, we report a catalytic DAC strategy employing robust zinc(II) enzyme mimics that enable efficient CO2 sequestration pathways. A catalyst-mediated CO2 hydration cycle in aqueous sorbents facilitates accelerated capture from dilute atmospheric air, thereby addressing the kinetic limitations observed in carbonate-based systems. Our developed complexes [ZnC1] and [ZnC2] enhance capture rates up to 2-fold at millimolar concentrations and improve the CO2 mass transfer by 40–60% in 1 M K2CO3 sorbent under ambient conditions. These bench-stable, earth-abundant zinc catalysts operate effectively under dilute CO2 concentrations, overcoming the kinetic limitations of conventional carbonate-based sorbents. Mechanistic studies support a biomimetic catalytic cycle that facilitates rapid CO2 conversion, demonstrating that a catalyst-assisted DAC can enable energy-efficient, scalable carbon capture technologies.

直接空气捕集(DAC)是大气CO2修复的一项重要技术,但很少有研究在稀释的大气CO2浓度下测试催化剂。受碳酸酐酶金属酶的启发,我们报道了一种催化DAC策略,采用强大的锌(II)酶模拟物,实现有效的二氧化碳封存途径。在水吸附剂中,催化剂介导的CO2水化循环有助于从稀释的大气中加速捕获,从而解决了在碳酸盐基体系中观察到的动力学限制。我们开发的配合物[ZnC1]和[ZnC2]在毫摩尔浓度下可将捕集率提高2倍,并在环境条件下将1m K2CO3吸附剂中的CO2传质提高40-60%。这些稳定的、富含土壤的锌催化剂在稀释的CO2浓度下有效地工作,克服了传统碳酸盐基吸附剂的动力学限制。机理研究支持一种促进二氧化碳快速转化的仿生催化循环,表明催化剂辅助DAC可以实现节能、可扩展的碳捕获技术。
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引用次数: 0
Specific Stratigraphic Division and Interpretation Method Using DNA Sequencing of Cuttings for Sustainable Development of Shale Resources 基于岩屑DNA测序的页岩资源可持续开发特定地层划分与解释方法
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c06365
Haitong Yang, , , Lingwen Meng, , , Chunlei Yu, , , Honghui Quan, , , Allegra Hosford Scheirer, , , Shuoliang Wang*, , and , Liangliang Jiang*, 

The specific division and interpretation of shale formations are crucial for the sustainable development of shale reservoirs. Conventional methods, which rely on well logging curves, seismic analysis, and geochemistry often face high costs, subjective uncertainties, and limited resolution. However, microbial DNA distribution analysis provides a promising alternative. Previous studies have primarily applied underground microbial distribution to production dynamic monitoring, such as interwell communication, production profiling, and fracture height monitoring. However, the application of microbial DNA in specific stratigraphic division has not been fully explored. This paper presents an approach for stratigraphic division and interpretation based on DNA sequencing in shale cuttings. Using DNA sequencing results and rank abundance, a method is developed to establish a geological microbial response profile and monitor the microbial diversity. In addition, a preliminary division method is developed to identify representative bacteria markers for each formation. Furthermore, a specific division method is established through a principal coordinate analysis of bacteria markers. This method provides a resolution of 1–2 m and can assist in stratigraphic division when logging curves have multiple solutions. This user-friendly, environment-friendly, and cost-effective approach offers a more scientific foundation and technical support for the sustainable development of shale oil and gas in a carbon-constrained world.

页岩储层的具体划分和解释对于页岩储层的可持续开发至关重要。传统方法依赖于测井曲线、地震分析和地球化学,往往面临成本高、主观不确定性和分辨率有限的问题。然而,微生物DNA分布分析提供了一个有希望的替代方法。以前的研究主要将地下微生物分布应用于生产动态监测,如井间通讯、生产剖面和裂缝高度监测。然而,微生物DNA在具体地层划分中的应用尚未得到充分的探索。本文提出了一种基于页岩岩屑DNA测序的地层划分和解释方法。利用DNA测序结果和序列丰度,建立了地质微生物响应剖面并监测微生物多样性的方法。此外,还开发了一种初步的分裂方法,以确定每个形成的代表性细菌标记。在此基础上,通过对细菌标记物的主坐标分析,建立了具体的划分方法。该方法可提供1 ~ 2 m的分辨率,当测井曲线有多个解时,可辅助地层划分。这种友好、环保、经济的方法为页岩油气的可持续发展提供了更多的科学基础和技术支持。
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引用次数: 0
Coupled Effects of CO2 and Temperature on Tight Reservoir Sandstone: Mechanical Properties, Mechanisms, and Models CO2和温度对致密储层砂岩的耦合效应:力学特性、机制和模型
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-02 DOI: 10.1021/acs.energyfuels.5c05643
Yang Ju*, , , Hang Yu, , , Peng Liu, , , Yufeng Bian, , , Hongwei Zhou, , and , Suping Peng, 

Tight sandstone reservoirs, characterized by low porosity and permeability, present substantial potential for CO2 utilization and sequestration. Understanding the mechanical behavior of tight sandstone under the influence of CO2 is critical for assessing geological CO2 sequestration and the CO2 fracturing capabilities of reservoirs. As the burial depth of the target reservoir increases, the formation temperature gradually rises, considerably altering the mechanical properties of reservoir sandstone, especially the interaction between CO2 and sandstone. However, few studies on the coupled effects are available. In this study, we built a high-temperature CO2 soaking system that allows CO2 injection across various formation temperatures (25 °C–160 °C). Uniaxial compression tests were conducted to explore the mechanical properties of the tight sandstone subjected to CO2 soaking at various temperatures. Scanning electron microscopy (SEM), X-ray diffraction (XRD), and energy-dispersive spectroscopy were used to quantitatively characterize the evolution of the mineral composition and micromorphology of tight sandstone after CO2 soaking at different temperatures. A stress–strain damage constitutive model was established to describe the behavior of tight sandstone under the coupled effects of temperature and CO2. The quantitative relationships between mineral dissolution, pore-throat evolution, and crack propagation revealed by SEM, XRD, and EDS analyses were integrated into the model to describe the prepeak damage evolution and deformation characteristics. The proposed model not only effectively characterized the macroscopic mechanical behavior of tight sandstone under coupled temperature–CO2 conditions but also provides a mechanistic explanation for the role of microstructural changes in controlling damage accumulation and strength degradation.

致密砂岩储层具有低孔隙度和低渗透率的特点,具有巨大的CO2利用和封存潜力。了解致密砂岩在CO2影响下的力学行为,对于评估地质CO2封存和储层CO2压裂能力至关重要。随着目标储层埋深的增加,地层温度逐渐升高,储层砂岩的力学性质,特别是CO2与砂岩的相互作用发生了较大的变化。然而,关于耦合效应的研究很少。在这项研究中,我们建立了一个高温二氧化碳浸泡系统,可以在不同的地层温度(25°C - 160°C)下注入二氧化碳。通过单轴压缩试验,探讨了致密砂岩在不同温度下CO2浸泡的力学性能。利用扫描电镜(SEM)、x射线衍射(XRD)和能量色散光谱(能谱)等手段,定量表征了致密砂岩在不同温度下CO2浸泡后矿物组成和微观形貌的演变。建立了致密砂岩在温度和CO2耦合作用下的应力-应变损伤本构模型。将SEM、XRD和EDS分析揭示的矿物溶解、孔喉演化和裂纹扩展之间的定量关系整合到模型中,以描述峰前损伤演化和变形特征。该模型不仅有效表征了致密砂岩在温度- co2耦合条件下的宏观力学行为,而且为微观结构变化在控制损伤积累和强度退化中的作用提供了机制解释。
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引用次数: 0
Micofluidic Visualization of Oil Displacement Mechanisms by CO2 Microbubbles co2微气泡驱油机理的微流体可视化研究
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-03-01 DOI: 10.1021/acs.energyfuels.5c06592
Mengting Liao, , , Baocai Tong, , , Xiaofeng Li, , , Lanlan Jiang*, , , Yi Zhang, , , Tao Yu, , and , Yongchen Song*, 

CO2-enhanced oil recovery (CO2-EOR) is a key carbon capture, utilization, and storage (CCUS) technology, delivering the dual benefits of enhanced oil recovery and CO2 geological storage. However, conventional CO2 gas flooding suffers from high gas mobility, early breakthrough, and a poor sweep efficiency. This study innovatively employed the green biodegradable surfactant alkyl polyglucoside (APG) and polymer xanthan gum (XG) to stabilize microbubbles, establishing a microbubble CO2 (MB-CO2) flooding system. The microscopic mechanisms of MB-CO2 flooding in heterogeneous porous media were systematically investigated by using a custom-built in situ visual microfluidic platform. The results reveal that MB-CO2 enhances oil recovery through three synergistic mechanisms: plugging mechanism (enabling dynamic synergistic plugging via the Jamin effect to expand sweep volume), interfacial interactions (weakening oil adhesion through wettability alteration and oleophilic interaction to promote oil stripping), and emulsification promotion (improving oil mobility via local shear and disturbance). Experimental results demonstrate a remarkable oil recovery factor of 93.64% and an extended breakthrough time of 0.734 PV for MB-CO2 flooding, substantially outperforming the results of CO2 gas flooding (45.25%) and APG-XG solution flooding (87.26%). Sector-based analysis further confirms superior recovery efficiency and uniformity across all radial directions, with effective adaptation to both high- and low-porosity zones and suppression of premature gas breakthrough. This work elucidates the multimechanistic synergy of MB-CO2 flooding and provides a theoretical and experimental foundation for its industrial application, offering significant insights for advancing CCUS deployment and fostering a sustainable energy transition.

二氧化碳提高采收率(CO2- eor)是一项关键的碳捕获、利用和封存(CCUS)技术,具有提高石油采收率和二氧化碳地质封存的双重优势。然而,传统的CO2气驱存在气相流动性高、突破早、波及效率差的问题。本研究创新性地采用绿色可生物降解表面活性剂烷基葡糖苷(APG)和高分子黄原胶(XG)稳定微泡,建立微泡CO2 (MB-CO2)驱油体系。利用自制的原位可视化微流控平台,系统研究了MB-CO2在非均质多孔介质中驱油的微观机理。结果表明,MB-CO2通过三种协同机制提高采收率:堵塞机制(通过Jamin效应实现动态协同堵塞,扩大波及体积)、界面相互作用(通过润湿性改变和亲油相互作用减弱油的附着力,促进油的剥离)和乳化促进机制(通过局部剪切和扰动改善油的流动性)。实验结果表明,MB-CO2驱的采收率达到了93.64%,突破时间延长了0.734 PV,大大优于CO2气驱(45.25%)和APG-XG溶液驱(87.26%)。基于部门的分析进一步证实了在所有径向方向上的优越采收率和均匀性,有效地适应了高孔隙度和低孔隙度区域,并抑制了过早的天然气突破。这项工作阐明了MB-CO2驱油的多机制协同作用,为其工业应用提供了理论和实验基础,为推进CCUS部署和促进可持续能源转型提供了重要见解。
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引用次数: 0
Sedimentology and Geochemistry of Gas Hydrate-Bearing Sands in the Greater Prudhoe Bay Area, Alaska North Slope: Insights from HYDRATE-02 Geo Data Well Core Analyses 阿拉斯加北坡大普拉德霍湾地区含天然气水合物砂的沉积学和地球化学:来自水合物-02地质数据井芯分析的见解
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-02-28 DOI: 10.1021/acs.energyfuels.5c04943
Akihiro Hiruta*, , , Jun Yoneda, , , Yusuke Jin*, , , Motoi Oshima, , , Michihiro Muraoka, , , Kiyofumi Suzuki, , and , Norio Tenma, 

An extended-duration gas production test from a gas hydrate-hosting sand layer was conducted in the JOGMEC–DOE–USGS Collaborative Gas Hydrate R&D Project in Alaska. Thick gas hydrate-bearing sand layers within the Prudhoe Bay Unit, sampled as part of the project, were studied to obtain fundamental data relevant to reservoir characterization and insights into the evolution of gas hydrate-hosting sand layers. Geochemical and petrophysical data were collected from pressure-cored sediments, gas hydrates, and interstitial water in approximately 15-m thick D1 and B1 sands (699 and 844 m in top, respectively) and from the overlying clay-rich layers. The proportion of sand-sized particles increased upward within the B1 sand of the progradation deposit; quartz content also increased upward. These parameters correlated with the electrical resistivity profile. The degree of gas hydrate saturation could be linked to the grain size pattern of the host sediments. Grain size and mineralogical data indicated a less smooth progradation process for the D1 sand than for the B1 sand. Scattered authigenic pyrite contents in the D1 sand suggest that geochemical processes within the sediments were accompanied by fluctuations. Distributions of spherical aggregates of fine siderite particles were restricted to the upper part of the B1 sand, where the highest hydrate saturation was observed. The local occurrence of carbonate-saturated brine was probably linked to high gas hydrate formation in the past. In situ chloride concentrations of interstitial water were ∼70 mM in the clay-rich layer above the D1 sand and ∼35 mM above and within the B1 sand. The downward freshening trend is consistent with diffusion following brine formation caused by thickening permafrost during the most recent glaciation 20 ky ago. The lower half of the D1 sand may have been influenced by present freshwater input, then exhibit unexpectedly low in situ chloride concentrations.

在阿拉斯加的JOGMEC-DOE-USGS合作天然气水合物研发项目中,对含天然气水合物的砂层进行了长时间的产气测试。作为项目的一部分,研究人员对Prudhoe Bay单元内厚的含天然气水合物砂层进行了采样,以获得与储层特征相关的基本数据,并深入了解含天然气水合物砂层的演化。地球化学和岩石物理数据来自约15 m厚的D1和B1砂岩(顶部分别为699和844 m)的压心沉积物、天然气水合物和间隙水,以及上覆的富粘土层。积层B1砂内砂级颗粒的比例呈上升趋势;石英含量也呈上升趋势。这些参数与电阻率剖面相关。天然气水合物的饱和度与寄主沉积物的粒度模式有关。粒度和矿物学数据表明,D1砂的进积过程不如B1砂光滑。D1砂中自生黄铁矿含量分散,表明沉积物内部的地球化学过程存在波动。菱铁矿细粒球状团聚体的分布局限于B1砂的上部,水合物饱和度最高。碳酸盐岩饱和卤水的局部赋存可能与过去高天然气水合物的形成有关。在D1砂之上的富粘土层中,间隙水的原位氯浓度为~ 70 mM, B1砂之上和内部的原位氯浓度为~ 35 mM。这一下降趋势与20天前最近一次冰期冻土增厚导致的卤水形成后的扩散一致。D1砂的下半部分可能受到当前淡水输入的影响,因此表现出意想不到的低原位氯浓度。
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引用次数: 0
Theoretical Identification of Highly Active Mo2B (MBenes) toward CO2 Capture and Reduction 高活性Mo2B (MBenes)捕集和还原CO2的理论鉴定
IF 5.3 3区 工程技术 Q2 ENERGY & FUELS Pub Date : 2026-02-27 DOI: 10.1021/acs.energyfuels.5c04900
Asha Yadav, , , Gopal Sanyal, , and , Brahmananda Chakraborty*, 

The search for efficient catalysts for the electrochemical reduction of CO2 into value-added fuels is ongoing. In this work, we investigate Mo2B, a two-dimensional (2D) MBene and an extension of the MXene family, as a potential catalyst for CO2 capture and reduction using first-principles calculations. In this study, the CO2 capture properties of pristine 2D Mo2B in the 2H phase, along with its functionalized derivatives Mo2BX2 (X = O, OH, H), are systematically evaluated. We found that Mo2BX2 is inert toward CO2 capture, while pristine Mo2B interacts strongly and effectively activates CO2 with a stronger adsorption energy of −2.47 eV. Projected density of states and Bader charge analyses reveal that pristine Mo2B exhibits a stronger CO2 capture affinity, which can be attributed to the high population of Mo dz2 states near the Fermi level and the substantial charge donation (∼0.31e) from each surrounding Mo atom to the O atoms of CO2. This substantial Mo-to-O charge transfer weakens the C═O bonds, thereby facilitating CO2 activation and the subsequent reduction mechanism. In contrast, surface functionalization weakens the direct interaction between Mo and CO2, leading to suppressed charge transfer. Electronic structure analysis also reveals that the stronger C═O interaction on Mo2B is primarily governed by the Mo dz2 and C/O pz orbitals of CO2. Further analysis of the reduction pathways indicates that captured CO2 can be converted to CH4, with the CO → HCO step exhibiting the highest Gibbs free energy change. The low limiting potential of Mo2B (−0.570 V), in comparison with the Gibbs free energy of H adsorption (−0.63 eV), suggests higher selectivity toward the CO2-to-CH4 conversion over the competing hydrogen evolution reaction. These results highlight Mo2B as a promising candidate for the electrochemical reduction of CO2. These theoretical insights may pave the way for the experimental realization of MBenes tailored for the CO2 reduction reactions.

寻找电化学将二氧化碳还原为增值燃料的有效催化剂的工作正在进行中。在这项工作中,我们研究了Mo2B,二维(2D) MBene和MXene家族的延伸,作为二氧化碳捕获和减少的潜在催化剂,使用第一性原理计算。在本研究中,系统地评估了原始2D Mo2B及其官能化衍生物Mo2BX2 (X = O, OH, H)在2H相的CO2捕集性能。我们发现Mo2BX2对CO2的捕获是惰性的,而原始的Mo2B相互作用强,有效地激活CO2,吸附能为- 2.47 eV。预测态密度和Bader电荷分析表明,原始Mo2B表现出更强的CO2捕获亲和力,这可归因于费米能级附近Mo dz2态的高密度以及每个周围Mo原子向CO2的O原子提供大量电荷(~ 0.31e)。这种大量的mo -O电荷转移削弱了C = O键,从而促进了CO2的活化和随后的还原机制。相反,表面功能化削弱了Mo和CO2之间的直接相互作用,导致电荷转移受到抑制。电子结构分析还表明,Mo2B上较强的C = O相互作用主要是由CO2的Mo dz2和C/O pz轨道控制的。对还原途径的进一步分析表明,捕获的CO2可以转化为CH4,其中CO→HCO步骤的吉布斯自由能变化最大。与氢吸附的吉布斯自由能(- 0.63 eV)相比,Mo2B的低极限电位(- 0.570 V)表明,相对于竞争的析氢反应,Mo2B对co2 - ch4转化具有更高的选择性。这些结果表明Mo2B是电化学还原CO2的一个有前途的候选材料。这些理论见解可能为实验实现适合于CO2还原反应的MBenes铺平道路。
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引用次数: 0
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