IDEAS home Printed from https://ideas.repec.org/a/eee/energy/v292y2024ics036054422400149x.html
   My bibliography  Save this article

A novel method for predicting the thermal stabilization temperature of organic Rankine cycle system working fluids based on transition state theory

Author

Listed:
  • Yu, Wei
  • Liu, Chao
  • Ban, Xijie
  • Li, Zhirong
  • Yan, Tianlong
  • Xin, Liyong
  • Wang, Shukun

Abstract

The use of organic working fluids in organic Rankine cycle (ORC) systems may lead to thermal decomposition, which negatively impacts system performance and safety. In this work, a simplified theoretical method based on the transition state theory is proposed to predict the ideal maximum thermal stabilization temperature of organic working fluids. This method involves considering the initial decomposition reaction of the working fluids and calculating the total reaction rate of the initial decomposition. By setting an acceptable decomposition rate, the ideal maximum thermal stabilization temperature of the working fluid can be determined. Using this method, the total reaction rate constants of several typical hydrocarbon, hydrofluorocarbon and siloxane working fluids were obtained in the temperature range of 300∼700 K. The predicted maximum operational temperatures were in good agreement with most experimental results. The branch ratio analyses show that C–C bond cleavage contributed mainly to the decomposition of hydrocarbons, the removal of HF and C–C bond cleavage contributed mainly to that of HFCs, and the Si–C bond cleavage contributed mainly to that of siloxanes. Only considering these main reactions in the reaction rate calculation can greatly reduce calculation cost without significantly impacting the prediction accuracy.

Suggested Citation

  • Yu, Wei & Liu, Chao & Ban, Xijie & Li, Zhirong & Yan, Tianlong & Xin, Liyong & Wang, Shukun, 2024. "A novel method for predicting the thermal stabilization temperature of organic Rankine cycle system working fluids based on transition state theory," Energy, Elsevier, vol. 292(C).
    • Handle: RePEc:eee:energy:v:292:y:2024:i:c:s036054422400149x
    DOI: 10.1016/j.energy.2024.130378
    as

    Download full text from publisher

    File URL: http://www.sciencedirect.com/science/article/pii/S036054422400149X
    Download Restriction: Full text for ScienceDirect subscribers only
    File URL: https://libkey.io/10.1016/j.energy.2024.130378?utm_source=ideas
    LibKey link: if access is restricted and if your library uses this service, LibKey will redirect you to where you can use your library subscription to access this item
    ---><---

    As the access to this document is restricted, you may want to search for a different version of it.

    References listed on IDEAS

    as
    1. Mohammadi, Zahra & Fallah, Mohsen, 2023. "Conventional and advanced exergy investigation of a double flash cycle integrated by absorption cooling, ORC, and TEG power system driven by geothermal energy," Energy, Elsevier, vol. 282(C).
    2. Xin, Liyong & Liu, Chao & Tan, Luxi & Xu, Xiaoxiao & Li, Qibin & Huo, Erguang & Sun, Kuan, 2021. "Thermal stability and pyrolysis products of HFO-1234yf as an environment-friendly working fluid for Organic Rankine Cycle," Energy, Elsevier, vol. 228(C).
    3. Eyerer, Sebastian & Dawo, Fabian & Kaindl, Johannes & Wieland, Christoph & Spliethoff, Hartmut, 2019. "Experimental investigation of modern ORC working fluids R1224yd(Z) and R1233zd(E) as replacements for R245fa," Applied Energy, Elsevier, vol. 240(C), pages 946-963.
    4. Al-Sulaiman, Fahad A. & Dincer, Ibrahim & Hamdullahpur, Feridun, 2012. "Energy and exergy analyses of a biomass trigeneration system using an organic Rankine cycle," Energy, Elsevier, vol. 45(1), pages 975-985.
    5. Yu, Wei & Liu, Chao & Tan, Luxi & Li, Qibin & Xin, Liyong & Wang, Shukun, 2023. "Thermal stability and thermal decomposition mechanism of octamethyltrisiloxane (MDM): Combined experiment, ReaxFF-MD and DFT study," Energy, Elsevier, vol. 284(C).
    6. Keulen, L. & Gallarini, S. & Landolina, C. & Spinelli, A. & Iora, P. & Invernizzi, C. & Lietti, L. & Guardone, A., 2018. "Thermal stability of hexamethyldisiloxane and octamethyltrisiloxane," Energy, Elsevier, vol. 165(PB), pages 868-876.
    7. Gioele Di Marcoberardino & Costante Mario Invernizzi & Paolo Iora & Luca Arosio & Marcello Canavese & Angelo Lunghi & Antonella Mazzei, 2022. "Thermal Stability and Thermodynamic Performances of Pure Siloxanes and Their Mixtures in Organic Rankine Cycles," Energies, MDPI, vol. 15(10), pages 1-20, May.
    8. Gallarini, Simone & Spinelli, Andrea & Lietti, Luca & Guardone, Alberto, 2023. "Thermal stability of linear siloxanes and their mixtures," Energy, Elsevier, vol. 278(C).
    Full references (including those not matched with items on IDEAS)

    Most related items

    These are the items that most often cite the same works as this one and are cited by the same works as this one.
    1. Yu, Wei & Liu, Chao & Tan, Luxi & Li, Qibin & Xin, Liyong & Wang, Shukun, 2023. "Thermal stability and thermal decomposition mechanism of octamethyltrisiloxane (MDM): Combined experiment, ReaxFF-MD and DFT study," Energy, Elsevier, vol. 284(C).
    2. Parisa Heidarnejad & Hadi Genceli & Nasim Hashemian & Mustafa Asker & Mohammad Al-Rawi, 2024. "Biomass-Fueled Organic Rankine Cycles: State of the Art and Future Trends," Energies, MDPI, vol. 17(15), pages 1-30, August.
    3. Chen, Yubo & Yang, Zhao & Lv, Zijian & Zhang, Yong & Li, Jie & Fei, Teng, 2023. "Combustion mechanism and product characteristics of 2,3,3,3-tetrafluoropropene as an environmentally friendly working fluid for organic Rankine cycle," Energy, Elsevier, vol. 268(C).
    4. Dabwan, Yousef N. & Pei, Gang & Gao, Guangtao & Li, Jing & Feng, Junsheng, 2019. "Performance analysis of integrated linear fresnel reflector with a conventional cooling, heat, and power tri-generation plant," Renewable Energy, Elsevier, vol. 138(C), pages 639-650.
    5. Ahmadi, Pouria & Dincer, Ibrahim & Rosen, Marc A., 2014. "Thermoeconomic multi-objective optimization of a novel biomass-based integrated energy system," Energy, Elsevier, vol. 68(C), pages 958-970.
    6. Dabwan, Yousef N. & Gang, Pei & Li, Jing & Gao, Guangtao & Feng, Junsheng, 2018. "Development and assessment of integrating parabolic trough collectors with gas turbine trigeneration system for producing electricity, chilled water, and freshwater," Energy, Elsevier, vol. 162(C), pages 364-379.
    7. Kerme, Esa Dube & Orfi, Jamel & Fung, Alan S. & Salilih, Elias M. & Khan, Salah Ud-Din & Alshehri, Hassan & Ali, Emad & Alrasheed, Mohammed, 2020. "Energetic and exergetic performance analysis of a solar driven power, desalination and cooling poly-generation system," Energy, Elsevier, vol. 196(C).
    8. Li, Jiaojiao & Zoghi, Mohammad & Zhao, Linfeng, 2022. "Thermo-economic assessment and optimization of a geothermal-driven tri-generation system for power, cooling, and hydrogen production," Energy, Elsevier, vol. 244(PB).
    9. Shi, Yao & Zhang, Zhiming & Chen, Xiaoqiang & Xie, Lei & Liu, Xueqin & Su, Hongye, 2023. "Data-Driven model identification and efficient MPC via quasi-linear parameter varying representation for ORC waste heat recovery system," Energy, Elsevier, vol. 271(C).
    10. Al Moussawi, Houssein & Fardoun, Farouk & Louahlia, Hasna, 2017. "Selection based on differences between cogeneration and trigeneration in various prime mover technologies," Renewable and Sustainable Energy Reviews, Elsevier, vol. 74(C), pages 491-511.
    11. Cai, Jianhui & Fei, Jiaming & Li, Liguang & Fei, Cheng & Maghsoudniazi, Mohammadhadi & Su, Zhanguo, 2023. "Multicriteria study of geothermal trigeneration systems with configurations of hybrid vapor compression refrigeration and Kalina cycles for sport arena application," Renewable Energy, Elsevier, vol. 219(P1).
    12. Tua Halomoan Harahap & Oriza Candra & Younis A. Sabawi & Ai Kamil Kareem & Karrar Shareef Mohsen & Ahmed Hussien Alawadi & Reza Morovati & Ehab Mahamoud Mohamed & Imran Khan & Dag Øivind Madsen, 2023. "Thermodynamic Analysis and Optimization of the Micro-CCHP System with a Biomass Heat Source," Sustainability, MDPI, vol. 15(5), pages 1-15, February.
    13. Mehrabian, M.J. & Khoshgoftar Manesh, M.H., 2023. "4E, risk, diagnosis, and availability evaluation for optimal design of a novel biomass-solar-wind driven polygeneration system," Renewable Energy, Elsevier, vol. 219(P2).
    14. Braimakis, Konstantinos & Karellas, Sotirios, 2017. "Integrated thermoeconomic optimization of standard and regenerative ORC for different heat source types and capacities," Energy, Elsevier, vol. 121(C), pages 570-598.
    15. Huo, Erguang & Hu, Zheng & Wang, Shukun & Xin, Liyong & Bai, Mengna, 2022. "Thermal decomposition and interaction mechanism of HFC-227ea/n-hexane as a zeotropic working fluid for organic Rankine cycle," Energy, Elsevier, vol. 246(C).
    16. Fong, K.F. & Lee, C.K., 2015. "Performance analysis of internal-combustion-engine primed trigeneration systems for use in high-rise office buildings in Hong Kong," Applied Energy, Elsevier, vol. 160(C), pages 793-801.
    17. Cao, Yan & Habibi, Hamed & Zoghi, Mohammad & Raise, Amir, 2021. "Waste heat recovery of a combined regenerative gas turbine - recompression supercritical CO2 Brayton cycle driven by a hybrid solar-biomass heat source for multi-generation purpose: 4E analysis and pa," Energy, Elsevier, vol. 236(C).
    18. Md Shazzad Hossain & Ibrahim Sultan & Truong Phung & Apurv Kumar, 2024. "Performance Improvement of a Limaçon Gas Expander Using an Inlet Control Valve: Two Case Studies," Energies, MDPI, vol. 17(10), pages 1-22, May.
    19. Gioele Di Marcoberardino & Costante Mario Invernizzi & Paolo Iora & Luca Arosio & Marcello Canavese & Angelo Lunghi & Antonella Mazzei, 2022. "Thermal Stability and Thermodynamic Performances of Pure Siloxanes and Their Mixtures in Organic Rankine Cycles," Energies, MDPI, vol. 15(10), pages 1-20, May.
    20. Li, Tailu & Zhang, Yao & Wang, Jingyi & Jin, Fengyun & Gao, Ruizhao, 2024. "Techno-economic and environmental performance of a novel thermal station characterized by electric power generation recovery as by-product," Renewable Energy, Elsevier, vol. 221(C).

    Corrections

    All material on this site has been provided by the respective publishers and authors. You can help correct errors and omissions. When requesting a correction, please mention this item's handle: RePEc:eee:energy:v:292:y:2024:i:c:s036054422400149x. See general information about how to correct material in RePEc.

    If you have authored this item and are not yet registered with RePEc, we encourage you to do it here. This allows to link your profile to this item. It also allows you to accept potential citations to this item that we are uncertain about.

    If CitEc recognized a bibliographic reference but did not link an item in RePEc to it, you can help with this form .

    If you know of missing items citing this one, you can help us creating those links by adding the relevant references in the same way as above, for each refering item. If you are a registered author of this item, you may also want to check the "citations" tab in your RePEc Author Service profile, as there may be some citations waiting for confirmation.

    For technical questions regarding this item, or to correct its authors, title, abstract, bibliographic or download information, contact: Catherine Liu (email available below). General contact details of provider: http://www.journals.elsevier.com/energy .

    Please note that corrections may take a couple of weeks to filter through the various RePEc services.

    IDEAS is a RePEc service. RePEc uses bibliographic data supplied by the respective publishers.