Volume 6 Issue 1
Feb.  2021
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Article Navigation >  Green Energy&Environment  > 2021  >  6(1): 102-113
Pei Xiong, Peng He, Yixin Qu, Liguo Wang, Yan Cao, Shuang Xu, Jiaqiang Chen, Muhammad Ammar, Huiquan Li. The adsorption properties of NaY zeolite for separation of ethylene glycol and 1,2-butanediol: Experiment and molecular modelling. Green Energy&Environment, 2021, 6(1): 102-113. doi: 10.1016/j.gee.2019.12.006
Citation: Pei Xiong, Peng He, Yixin Qu, Liguo Wang, Yan Cao, Shuang Xu, Jiaqiang Chen, Muhammad Ammar, Huiquan Li. The adsorption properties of NaY zeolite for separation of ethylene glycol and 1,2-butanediol: Experiment and molecular modelling. Green Energy&Environment, 2021, 6(1): 102-113. doi: 10.1016/j.gee.2019.12.006
shu

The adsorption properties of NaY zeolite for separation of ethylene glycol and 1,2-butanediol: Experiment and molecular modelling

doi: 10.1016/j.gee.2019.12.006
  • a.

    College of Chemical Engineering, Beijing University of Chemical Technology, Beijing, 100029, China

  • b.

    CAS Key Laboratory of Green Process and Engineering, National Engineering Laboratory for Hydrometallurgical Cleaner Production Technology, Institute of Process Engineering, Chinese Academy of Sciences, Beijing, 100190, China

  • c.

    Sino-Danish College, University of Chinese Academy of Sciences, Beijing, 100049, China

  • d.

    Sino-Danish Center for Education and Research, University of Chinese Academy of Sciences, Beijing, 10049, China

  • e.

    School of Chemical Engineering, University of Chinese Academy of Sciences, Beijing, 100049, China

  • f.

    Dalian National Laboratory for Clean Energy, Dalian, 116023, China

  • g.

    Department of Chemical Engineering Technology, Government College University, Faisalabad 38000, Pakistan

More Information
  • Corresponding author: E-mail address: phe@ipe.ac.cn (Peng He); E-mail address: lgwang@ipe.ac.cn (Liguo Wang); E-mail address: hqli@ipe.ac.cn (Huiquan Li)
  • Received date 13 November 2019, Accepted date 25 December 2019, RevRecd date 24 December 2019, Available online 25 January 2020, Publish date 28 February 2021,
    Abstract
  • The separation of ethylene glycol (EG) and 1,2-butanediol (1,2-BDO) azeotrope in the synthesis process of EG via coal and biomass is becoming of increasing commercial and environmental importance. Selective adsorption is deemed as the most promising methods because of energy saving and environment favorable. In this paper, NaY zeolite was used to separate 1,2-BDO from EG, and its adsorption properties was then investigated. The isotherms of EG and 1,2-BDO in vapor and liquid phases from 298 to 328 K indicated that they fitted Langmuir model quite well, and the NaY zeolite absorbent favored EG more than 1,2-BDO. The Grand Canonical Monte Carlo (GCMC) and molecular dynamics (MD) simulation techniques were conducted to investigate the competition adsorption and diffusion characteristics in different adsorption regions. It was observed that EG and 1,2-BDO molecules all have the most probable locations of the center of the 12-membered ring near the Na cations. The diffusivities of EG are lower than those of 1,2-BDO at the same adsorption concentration. At last, the breakthrough curves of the binary mixture regressed from the empirical Dose–Response model in fixed-bed column showed that the adsorption selectivity of EG could reach to as high as 2.43, verified that the NaY zeolite could effectively separate EG from 1,2-BDO. This work is also helpful for further separation of other dihydric alcohol mixtures from coal and biomass fermentation.

     

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