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Surface Topography Effects on Pool Boiling via Non-equilibrium Molecular Dynamics Simulations

  • Alessio D. Lavino*
    Alessio D. Lavino
    Department of Chemical Engineering, Imperial College London, South Kensington Campus, London SW7 2AZ, U.K.
    *Email: [email protected]
  • Edward Smith
    Edward Smith
    Department of Mechanical and Aerospace Engineering, Brunel University London, Uxbridge, Middlesex UB8 3PH, U.K.
    More by Edward Smith
  • Mirco Magnini
    Mirco Magnini
    Department of Mechanical, Materials and Manufacturing Engineering, University of Nottingham, Nottingham NG7 2RD, U.K.
  • , and 
  • Omar K. Matar
    Omar K. Matar
    Department of Chemical Engineering, Imperial College London, South Kensington Campus, London SW7 2AZ, U.K.
Cite this: Langmuir 2021, 37, 18, 5731–5744
Publication Date (Web):April 29, 2021
https://doi.org/10.1021/acs.langmuir.1c00779
Copyright © 2021 American Chemical Society

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    Abstract

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    In this work, we investigate nucleate pool boiling via non-equilibrium molecular dynamics simulations. The effect of nano-structured surface topography on nucleation and transition to a film-like boiling regime is studied at the molecular scale, by varying the cavity aspect ratio, wall superheat, and wettability through a systematic parametric analysis conducted on a Lennard-Jones (LJ) system. The interplay of the aforementioned factors is rationalized by means of a classical nucleation theory-based model. The solid surface is heated uniformly from the bottom in order to induce the nanobubble nucleation. Insight into the cavity behavior in heat transfer problems is achieved by looking at temperature and heat flux profiles inside the cavity itself, as well as at the time of nucleation, for different operating conditions. The role of the cavity size in controlling the vapor embryo formation is highlighted, and its dependence on the other investigated parameters is summarized in a phase diagram. Our results show that heterogeneity at the nanoscale plays a key role in determining pool boiling heat transfer performance, suggesting a promising approach to optimize nanostructured surfaces for energy and thermal management applications.

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    The Supporting Information is available free of charge at https://pubs.acs.org/doi/10.1021/acs.langmuir.1c00779.

    • Trajectory evolution of the pool boiling over simulation time for all the wettability cases investigated in this work with further analysis and methodologies applied throughout the manuscript (PDF)

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    Cited By

    This article is cited by 13 publications.

    1. Wei Chang, Wenming Li, Jiaxuan Ma, Kai Luo, Chen Li. Enhanced Flow Boiling in Microchannels Integrated with Hierarchical Structures of Micro-Pinfin Fences and Nanowires. Langmuir 2021, 37 (30) , 8989-8996. https://doi.org/10.1021/acs.langmuir.1c00891
    2. Hantao Jiang, Yingwen Liu, Huaqiang Chu. A review of numerical investigation on pool boiling. Journal of Thermal Analysis and Calorimetry 2023, 148 (17) , 8697-8745. https://doi.org/10.1007/s10973-023-12292-0
    3. Shakeel Ahmad, Chung Ki Cheng, Kwun Ting Lau, Shahid Ali Khan, Xinyan Huang, Jiyun Zhao. Studying the Synergistic Roles of Nanostructures on the Rapid Boiling Process Using Molecular Dynamics Simulation. Heat Transfer Engineering 2023, 44 (14) , 1193-1207. https://doi.org/10.1080/01457632.2022.2127043
    4. Zirui Li, Zhenyu Wang, Wei Shao, Qun Cao, Zheng Cui. Ultrathin liquid film nucleate boiling on grooved surfaces with variational aspect ratio. Thermal Science and Engineering Progress 2023, 43 , 102023. https://doi.org/10.1016/j.tsep.2023.102023
    5. Hamed Hajebzadeh, Ehsan Abedini, Pouyan Adibi, Mohammad Hosseini. Molecular dynamics simulation of argon pool boiling: A comparative study of employing nanoparticles and creating tree-root type nanostructures. International Communications in Heat and Mass Transfer 2023, 146 , 106890. https://doi.org/10.1016/j.icheatmasstransfer.2023.106890
    6. Wei Deng, Tianquan Wang, Jingtan Chen, Sihong He, Kejian Dong, Jiyun Zhao. Performance enhancement of nanoscale heat pipe with hydrophilic/hydrophobic pattern. International Communications in Heat and Mass Transfer 2023, 144 , 106767. https://doi.org/10.1016/j.icheatmasstransfer.2023.106767
    7. Chang Guo, Can Ji, Yalong Kong, Zhigang Liu, Lin Guo, Yawei Yang. The Effect of Liquid–Solid Interactions upon Nucleate Boiling on Rough Surfaces: Insights from Molecular Dynamics. Materials 2023, 16 (5) , 1984. https://doi.org/10.3390/ma16051984
    8. Kaihang Shi, Edward R. Smith, Erik E. Santiso, Keith E. Gubbins. A perspective on the microscopic pressure (stress) tensor: History, current understanding, and future challenges. The Journal of Chemical Physics 2023, 158 (4) https://doi.org/10.1063/5.0132487
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    10. Xilin Wang, Lu Liu, Chen Yang, Xinyu Dong, Xueming Yang. Molecular dynamics simulation of liquid film boiling on solid metal and liquid metal surfaces. International Journal of Heat and Mass Transfer 2023, 200 , 123528. https://doi.org/10.1016/j.ijheatmasstransfer.2022.123528
    11. Jiada Wang, Ying Guo, Zhen Jiao, Jin Tan, Mengnan Zhang, Qiang Zhang, Ning Gu. Generation of micro-nano bubbles by magneto induced internal heat for protecting cells from intermittent hypoxic damage. Colloids and Surfaces A: Physicochemical and Engineering Aspects 2022, 655 , 130289. https://doi.org/10.1016/j.colsurfa.2022.130289
    12. Seyed Alireza Rozati, Praneethreddy Keesara, Chaitanya Mahajan, Kunal Mondal, Anju Gupta. Magnetically aligned metal-organic deposition (MOD) ink based nickel/copper heater surfaces for enhanced boiling heat transfer. Applied Thermal Engineering 2022, 211 , 118473. https://doi.org/10.1016/j.applthermaleng.2022.118473
    13. Lu Liu, Xilin Wang, Chen Yang, xy dong, Xueming Yang. Molecular Dynamics Simulation of Liquid Film Boiling on Solid Metal and Liquid Metal Surfaces. SSRN Electronic Journal 2022, 118 https://doi.org/10.2139/ssrn.4194432

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