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Industrialization prospects for hydrogen production by coal gasification in supercritical water and novel thermodynamic cycle power generation system with no pollution emission

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Science China(Technological Sciences) 2015年第12期58卷 1989-2002页

作者： GUO LieJin JIN Hui GE ZhiWei LU YouJun CAO ChangQing State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University

Energy conversion and utilization, particularly carbon-based fuel burning in air phase, have caused great environmental pollution and serious problems to society. The reactions in water phase may have the potential to realize clean and efficient energy conversion and utilization. Coal gasification in supercritical water is a typical carbon-based fuel conversion process in water phase, and it takes the advantages of the unique chemical and physical properties of supercritical water to convert organic matter in coal to H2 and CO2. N, S, P, Hg and other elements are deposited as inorganic salts to avoid pollution emission. The state {1. laboratory of multiphase flow in power engineering has obtained extensive experimental and theoretical results based on coal gasification in supercritical water. Supercritical water fluidized bed reactor was developed for coal gasification and seven kinds of typical feedstock were selected. The hydrogen yield covers from 0.67 to 1.74 Nm3/kg and the carbon gasification efficiency is no less than 97%. This technology has a bright future in industrialization not only in electricity generation but also in hydrogen production and high value-added chemicals. Given the gas yield obtained in laboratory-scale unit, the hydrogen production cost is U.S.$ 0.1.1.Nm3 when the throughput capacity is 2000 t/d. A novel thermodynamic cycle power generation system based on coal gasification in supercritical water was proposed with the obvious advantages of high coal-electricity conversion efficiency and zero pollutant emission. The cost of U.S.$ 3.69 billion for desulfuration, denitration and dust removal in China in 201. would have been saved with this technology. Five kinds of heat supply methods are analyzed and the rates of return of investment are roughly estimated. An integrated cooperative innovation center called a new type of high-efficient coal gasification technology and its large-scale utilization was founded to enhance the industrialization o

关键词： industrialization prospects hydrogen production supercritical water gasification power generation zero emission

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Numerical Analysis of flow Instability in the Water Wall of a Supercritical CFB Boiler with Annular Furnace

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Journal of Thermal Science 2016年第4期25卷 372-379页

作者： XIE Beibei YANG Dong XIE Haiyan NIE Xin LIU Wanyu State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University

In order to expand the study on flow instability of supercritical circulating fluidized bed(CFB) boiler,a new numerical computational model considering the heat storage of the tube wall metal was presented in this *** lumped parameter method was proposed for wall temperature calculation and the single channel model was adopted for the analysis of flow *** on the time-domain method,a new numerical computational program suitable for the analysis of flow instability in the water wall of supercritical CFB boiler with annular furnace was *** verify the code,calculation results were respectively compared with data of commercial *** to the comparisons,the new code was proved to be reasonable and accurate for practical engineering application in analysis of flow *** on the new program,the flow instability of supercritical CFB boiler with annular furnace was simulated by time-domain *** 1.2 times heat load disturbance was applied on the loop,results showed that the inlet flow rate,outlet flow rate and wall temperature fluctuated with time eventually remained at constant values,suggesting that the hydrodynamic flow was *** results also showed that in the case of considering the heat storage,the flow in the water wall is easier to return to stable state than without considering heat storage.

关键词： supercritical CFB with annular furnace heat storage flow instability wall temperature numerical analysis

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Critical anomaly and finite size scaling of the self-diffusion coefficient for Lennard Jones fluids by non-equilibrium molecular dynamic simulation

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Chinese Physics B 2011年第10期20卷 362-367页

作者： Ahmed Asad 吴江涛 State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University

We use non-equilibrium molecular dynamics simulations to calculate the self-diffusion coefficient, D, of a Lennard Jones fluid over a wide density and temperature range. The change in self-diffusion coefficient with temperature decreases by increasing density. For density ρ＊ = ρσ3 = 0.84 we observe a peak at the value of the self-diffusion coefficient and the critical temperature T＊ = kT/ε = 1.25. The value of the self-diffusion coefficient strongly depends on system size. The data of the self-diffusion coefficient are fitted to a simple analytic relation based on hydrodynamic arguments. This correction scales as N-α, where α is an adjustable parameter and N is the number of particles. It is observed that the values of a 〈 1.provide quite a good correction to the simulation data. The system size dependence is very strong for lower densities, but it is not as strong for higher densities. The self-diffusion coefficient calculated with non-equilibrium molecular dynamic simulations at different temperatures and densities is in good agreement with other calculations fronl the literature.

关键词： self-diffusion coefficient non-equilibrium molecular dynamic simulation Lennard Jonesfluid critical dynamics

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Calculation of the Critical Speed and Stability Analysis of Cryogenic Turboexpanders with Different Structures

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Plasma Science and Technology 2012年第10期14卷 919-926页

作者：陈双涛赵红利马斌侯予 State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University

A modularized code based on the Finite Element QZ （FEQZ） method is developed, for a better estimate of the critical speed and a more convenient method of rotor-dynamic stability analysis for a gas bearing high speed turboexpander rotor system with actual structure and application of a cryogenic turboexpander. This code is then validated by the experimental data of a gas bearing turboexpander, with a rotor diameter of 25 mm and a rated speed of 1.6,400 rpm. With this code, four rotors with different structures, available to the turboexpander, are parametrically analyzed by the available speed range, vibration modes and logarithmic attenuation rate. The results suggest that the rotor with a structure of two thrust collars on the system exhibits a better performance in the designed conditions.

关键词： critical speed gas bearing cryogenic turboexpander

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Experimental Investigation on Critical Heat Flux for Water flowing in a Vertical Uniformly Heated Rifled Tube under Near-critical Pressures

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Journal of Thermal Science 2018年第6期27卷 527-540页

作者： XIE Haiyan YANG Dong ZHAO Yunjie JIANG Huiqing QU Mofeng State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University

This study experimentally investigated the critical heat flux(CHF) of departure from nucleate boiling(DNB) of water flowing under near-critical pressures in a 2 m-long vertical upward rifled tube with the size of Φ35 × 5.67 mm. Operating conditions included pressures of 1.–21.MPa, mass fluxes of 475–1.00 kg·m^(-2)·s^(-1., inlet subcooling temperatures of 3–5°C, and wall heat fluxes of 40–960 kW·m^(-2). Tube wall temperature distribution and heat transfer performance in different test conditions were obtained. The effects of the operating parameters on CHF were analyzed. Four heat transfer coefficient correlations were evaluated against our experimental data for further investigation of the two-phase heat transfer characteristics. A heat transfer correlation based on Martinelli number utilized in two-phase region and two empirical correlations used to predict the CHF in rifled tube at near-critical pressures were proposed. Meanwhile, experimental CHF data in rifled tube were compared with six widely used correlations and a CHF look-up table. The CHF enhancement effect in rifled tube is obvious as compared with the CHF data in smooth tube. Results show that DNB occurs at low vapor quality and subcooled region in the rifled tube at near-critical pressures. The increase in pressure leads to the early occurrence of DNB and the decrease in CHF, whereas the increase in mass flux delays the occurrence of DNB and results in the increase in CHF. DNB presents a tendency to move toward the inlet of the rifled tube. At individual operating conditions, DNB and dryout coexist at different sections of the rifled tube.

关键词： critical heat flux near-critical pressure rifled tube DNB heat transfer

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Unveiling micro- and nanoscale bubble dynamics for enhanced electrochemical water splitting

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Advances in Colloid and Interface Science 2025年 343卷 103544页

作者： Lu, Xinlong Yadav, Devendra He, Baichuan Zhou, Yu Zhou, Liwu Zeng, Zilong Ma, Lijing Jing, Dengwei International Research Center for Renewable Energy & State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Shaanxi Xi'an710049 China Department of Chemical Engineering Technion - Israel Institute of Technology Haifa3200003 Israel College of Mechanical Engineering Xi'an Shiyou University Shaanxi Xi'an710065 China

Bubbles generated during electrochemical and photoelectrochemical water splitting critically influence efficiency through complex factors, including chemical reactions, species transport, mass transfer at the three-phase interface, and bubble coverage. A detailed understanding of the nucleation, growth, coalescence, and detachment of micro- and nanoscale bubbles is vital for advancing water splitting technologies. Surface-attached bubbles significantly reduce the electrocatalytically active area of electrodes, leading to increased surface overpotential at a given current density. Consequently, their effective removal is pivotal for optimizing the electrolysis process. However, the intricate interplay among single bubble evolution, mass transport, bubble coverage, and overpotential remain inadequately understood. This review explores the fundamental mechanisms underpinning bubble evolution, with an emphasis on the Marangoni effect and its influence on bubble dynamics. Furthermore, recent advancements in understanding individual bubbles on micro and nano-electrodes are highlighted, offering valuable insights into scale-dependent bubble behavior. These findings enrich our knowledge of gas-liquid interfacial phenomena and underscore their industrial significance, presenting opportunities to enhance water splitting performance through optimized bubble dynamics. © 2025

关键词： Electrolysis

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General analytical equation of state for nanoconfined gases derived from statistical physics

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Physical Review E 2025年第2期111卷 025413-025413页

作者： Chengzhen Sun Haoxuan Li Zhixiang Zhao Mehdi Neek-Amal Bofeng Bai State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Xi'an Shaanxi 710049 China School of Urban Planning and Municipal Engineering Xi'an Polytechnic University Xi'an Shaanxi 710048 China Department of Physics Faculty of Sciences Shahid Rajaee Teacher Training University 16875-163 Lavizan Tehran Islamic Republic of Iran Department of Physics University of Antwerp Groenenborgerlaan 171 2020 Antwerp Belgium

The pressure prediction of nanoconfined gases is crucial for various industrial applications, yet existing equations of state (EOS) often compromise between accuracy and usability. This study derives a theoretical EOS in analytical form, combining precision and practicality through statistical physics. It begins by examining the pressure drop mechanism due to adsorbed molecules and refines molecular pairing and potential energy interactions. The resulting EOS accurately predicts the pressure of gases in nanoconfined spaces, especially with an average prediction error of about 5% for strongly adsorbing gases like nitrogen, oxygen, and argon. Additionally, it aligns with the Van der Waals EOS under macroscopic conditions, offering a unified framework across scales. This model enhances both {1. applications and the understanding of nanoconfined EOS.

关键词： Van der Waals forces

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Occurrence and flow Characteristics of Methane in High-Temperature and High-Pressure Nanopores of Deep Shale

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Kung Cheng Je Wu Li Hsueh Pao/Journal of engineering Thermophysics 2025年第4期46卷 1200-1204页

作者： Wang, Rui Sun, Chengzhen Yang, Xu State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong University Xi’an710049 China Petroleum Engineering School Southwest Petroleum University Chengdu610500 China

The understanding of gas transport in deep shale nanopores is still not clear. In this study, molecular simulations of methane occurrence and flow in illite slits of deep shales under the condition of high-temperature and high-pressure was carried out. The occurrence, diffusion and flow characteristics of methane molecules were analyzed. The effects of temperature and pressure on methane occurrence and flow were elucidated. The results show that the distribution of methane density in illite slits is nonuniform, and there are density peaks near the wall. Compared with Middle and Shallow shales, more methane molecules can exist in the pores of deep shale, and the diffusion ability is limited. The methane flow flux decreases with the decrease of pressure (5∼80 MPa) and increases with the decrease of temperature (60∼1.0◦C). Pressure is the main dominating factor of flow flux, and the flow flux decreases gradually during depressurization. © 2025 Science Press. All rights reserved.

关键词： Nanopores

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Low-energy and accelerated hydrogen release from MgH2–5 wt% NaTiOxH catalyzed hydrogen storage reactor by graphite responsive microwave

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Journal of Magnesium and Alloys 2025年

作者： Wang, Bofei Wu, Zhen Liu, Honghao Yang, Fusheng Zhang, Zaoxiao Yao, Jing Li, Qian Cao, Hujun Li, Bo State Key Laboratory of Fluorine & Nitrogen Chemicals School of Chemical Engineering and Technology Xi'an Jiaotong University Xi'an710049 China State Key Laboratory of Multiphase Flow for Power Engineering Xi'an Jiaotong University Xi'an710049 China National Engineering Research Center for Magnesium Alloys Chongqing University Chongqing400044 China Dalian National Laboratory for Clean Energy Dalian Institute of Chemical Physics Chinese Academy of Sciences Dalian116023 China Faculty of Engineering Electrical Energy Management Group University of Bristol BristolBS8 1QU United Kingdom

Owing to high thermal stability and large reaction enthalpy, MgH2 has high reaction temperatures and sluggish reaction kinetics in the dehydrogenation process, which consumes lots of energy. To achieve hydrogen release with low energy consumption, accelerated reaction rate, and high heating uniformity, this paper proposes a novel method of graphite responsive microwave-assisted thermal management with NaTiOxH catalyst. A multi-physics model of the 5 wt% NaTiOxH catalyzed MgH2 reactor integrated with a microwave generator is developed to investigate the reaction, heat and mass transfer process of hydrogen release. It is found that the graphite responsive microwave heating method could improve the temperature uniformity of reaction bed, reduce the energy consumption by at least 1..71. and save the hydrogen release time by 53.49% compared with the traditional electric heating method. Moreover, the hydrogen desorption thermodynamics could be improved with the increase of microwave power. The hydrogen release time is shortened by 1..55% with the increase of 20 W microwave power. Meanwhile, it is also concluded that the microwave excitation frequency of 2.1.GHz and the graphite content of 2 wt% have better heating performance. Therefore, it can be verified that the graphite responsive microwave heating helps to low-energy and accelerated hydrogen release from MgH2 hydrogen storage reactor. © 2025

关键词： Reaction rates

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Constructing electron transport channel of SnO2/BaSO4 on g-C3N4 for enhanced visible-light-driven photocatalytic H2 production

Materials Today Catalysis

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Materials Today Catalysis 2025年 9卷

作者： Dong, Gongyue Guo, Xiaojuan Cheng, Cheng Chen, Feng Zhang, Jinfeng Du, Yanping Meng, Wei Liu, Maochang Shi, Jinwen International Research Center for Renewable Energy State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Xi'an710049 China Guangdong Provincial Key Laboratory of Multi-energy Complementary Distributed Energy Systems Dongguan University of Technology Dongguan523808 China School of Engineering Lancaster University LancasterLA1 4YW United Kingdom Gansu Company PipeChina Lanzhou730060 China Hunan Provincial Key Lab of Dark Tea and Jin-Hua Department of Material & Chemical Engineering Hunan City University Yiyang413000 China

Graphitic carbon nitride (g-C3N4) is confronted with the issue of poor utilization of photogenerated charge carriers, thereby leading to limited performance of photocatalytic hydrogen (H2) production, which restricts its potential application. Herein, the electron transport material SnO2/BaSO4 was synthesized to integrate with g-C3N4 for addressing the above problem. Various characterizations were conducted to investigate the g-C3N4-SnO2/BaSO4 photocatalyst, and it demonstrated that photogenerated electrons from g-C3N4 expeditiously migrate to SnO2/BaSO4 nanoparticles, which markedly hindered photogenerated carriers’ recombination. Subsequently, the g-C3N4-SnO2/BaSO4 photocatalyst demonstrated promoted photocatalytic H2 production at a rate of 1..2 μmol h−1.under visible-light illumination, which was 2.5 times higher than that of pristine g-C3N4. © 2025 The Authors

关键词： Barium sulfate

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