Citation: Xiaochen Zhang, Fei Yu, Jie Ma. Cutting-Edge Applications of Multi-Angle Numerical Simulations for Capacitive Deionization[J]. Acta Physico-Chimica Sinica, ;2024, 40(11): 231102. doi: 10.3866/PKU.WHXB202311026 shu

Cutting-Edge Applications of Multi-Angle Numerical Simulations for Capacitive Deionization

Xiaochen Zhang ^{1, 2} ,
Fei Yu ³ ,
Jie Ma ^{1, 2,,}

1.
Research Center for Environmentally Functional Materials, College of Environmental Science and Engineering, Tongji University, Shanghai 200092, China
2.
School of Civil Engineering, Kashi University, Kashi 844000, the Xinjiang Uygur Autonomous Region, China
3.
College of Oceanography and Ecological Science, Shanghai Ocean University, Shanghai 201306, China

Corresponding author: Jie Ma, jma@tongji.edu.cn
Received Date: 21 November 2023
Revised Date: 25 December 2023
Accepted Date: 26 December 2023
Available Online: 26 February 2024
Fund Project: the National Natural Science Foundation of China 22276137the National Natural Science Foundation of China 52170087

Capacitive deionization (CDI) technology is considered to be an emerging water treatment technology in the 21st century, owing to its low energy consumption, absence of secondary pollution, and straightforward operation. The advancement of basic theory and computer science has facilitated the use of multi-angle numerical simulations for CDI. However, due to errors in experimental methods, a direct understanding of mechanisms such as the kinetic characteristics of ion diffusion inside electrode materials, structural evolution during charging and discharging, and the intrinsic connection between potentials and structures is lacking. Existing experimental methods fall short of providing clear theoretical explanations for these phenomena. In contrast, numerical simulations offer a better comprehension of the chemical and electrochemical evolution in CDI. Beyond electrode materials, the device configuration of CDI significantly impacts its performance. Utilizing numerical simulations to study the optimal device configuration is expected to enhance economic efficiency and promote the practical application of CDI. While current reviews of CDI focus primarily on electrode materials and device configurations, there is a dearth of comprehensive reviews on cutting-edge numerical simulation research in the CDI field. This review commences with the earliest continuous-scale model used to describe the dynamic process of CDI. It systematically categorizes multi-angle numerical simulations in CDI, summarizes the strengths and weaknesses of different numerical simulation methods, and anticipates future development directions. Continuous-scale models accurately characterize the ion dynamics of CDI, determining rate and process constraints. Pore-scale models analyze the microstructure of porous media, obviating the need for empirical formulas to preset transport parameters for continuous-scale models. Researchers have introduced molecular dynamics simulation and density functional theory into CDI research, effectively analyzing the influence of structural features at the molecular/atomic level of electrode materials on the CDI system. This aids researchers in enhancing the efficacy and ionic selectivity of CDI electrode materials through pore engineering, defect engineering, and electrochemical microcosmic modulation engineering. Finite element analysis guides improvements in ion diffusion and stability of electrode materials, while computational fluid dynamics provides references for designing high-performance CDI devices. Data-driven machine learning excels in handling nonlinear data and uncovering complex mechanisms of CDI water treatment processes, while digital twin technology can reduce operation and maintenance costs of CDI. Considering costs in practical applications, techno-economic analysis plays a pivotal role in promoting the practical application of CDI technology. This review, the first of its kind, provides an essential theoretical foundation and research ideas for the new paradigm of CDI research by summarizing the advantages and disadvantages of different numerical simulation methods and offering insights into cutting-edge perspectives in the field of CDI.
- Capacitive deionization,
- Molecular dynamics,
- Density functional theory,
- Finite element analysis,
- Machine learning
1. [1]
  Rodell, M.; Famiglietti, J. S.; Wiese, D. N.; Reager, J. T.; Beaudoing, H. K.; Landerer, F. W.; Lo, M. H. Nature 2018, 557 (7707), 651. doi: 10.1038/s41586-018-0123-1 doi: 10.1038/s41586-018-0123-1
2. [2]
  AlMarzooqi, F. A.; Al Ghaferi, A. A.; Saadat, I.; Hilal, N. Desalination 2014, 342, 3. doi: 10.1016/j.desal.2014.02.031 doi: 10.1016/j.desal.2014.02.031
3. [3]
  Shannon, M. A.; Bohn, P. W.; Elimelech, M.; Georgiadis, J. G.; Mariñas, B. J.; Mayes, A. M. Nature 2008, 452 (7185), 301. doi: 10.1038/nature06599 doi: 10.1038/nature06599
4. [4]
  Elimelech, M.; Phillip, W. A. Science 2011, 333 (6043), 712. doi: 10.1126/science.1200488 doi: 10.1126/science.1200488
5. [5]
  Li, Y.; Hu, X. S.; Huang, J. W.; Wang, L.; She, H. D.; Wang, Q. Z. Acta Phys. -Chim. Sin. 2021, 37 (8), 2009022. doi: 10.3866/PKU.WHXB202009022 doi: 10.3866/PKU.WHXB202009022
6. [6]
  Wang, W. L.; Zhang, H. C.; Chen, Y. G.; Shi, H. F. Acta Phys. -Chim. Sin. 2022, 38 (7), 2201008. doi: 10.3866/PKU.WHXB202201008 doi: 10.3866/PKU.WHXB202201008
7. [7]
  Zhou, L.; Li, Y. F.; Zhang, Y. K.; Qiu, L. W.; Xing, Y. Acta Phys. -Chim. Sin. 2022, 38 (7), 2112027. doi: 10.3866/PKU.WHXB202112027 doi: 10.3866/PKU.WHXB202112027
8. [8]
  Chen, Q.; Zhao, J.; Cheng, H. H.; Qu, L. T. Acta Phys. -Chim. Sin. 2022, 38 (1), 2101020. doi: 10.3866/PKU.WHXB202101020 doi: 10.3866/PKU.WHXB202101020
9. [9]
  Chang, M. K.; Hu, N.; Li, Y.; Xian, D. F.; Zhou, W. Q.; Wang, J. Y.; Shi, Y. L.; Liu, C. L. Acta Phys. -Chim. Sin. 2022, 38 (3), 2003031. doi: 10.3866/PKU.WHXB202003031 doi: 10.3866/PKU.WHXB202003031
10. [10]
  Liu, Z. Z.; Wan, S. W.; Wu, Y.; Wang, B. Y.; Ji, H. L. Acta Phys. -Chim. Sin. 2023, 39 (5), 2211019. doi: 10.3866/PKU.WHXB202211019 doi: 10.3866/PKU.WHXB202211019
11. [11]
  Suss, M. E.; Porada, S.; Sun, X.; Biesheuvel, P. M.; Yoon, J.; Presser, V. Energy Environ. Sci. 2015, 8 (8), 2296. doi: 10.1039/C5EE00519A doi: 10.1039/C5EE00519A
12. [12]
  Chen, F.; Huang, Y.; Guo, L.; Sun, L.; Wang, Y.; Yang, H. Y. Energy Environ. Sci. 2017, 10 (10), 2081. doi: 10.1039/C7EE00855D doi: 10.1039/C7EE00855D
13. [13]
  Kumar, S.; Aldaqqa, N. M.; Alhseinat, E.; Shetty, D. Angew. Chem. Int. Ed. 2023, 62 (35), e202302180. doi: 10.1002/anie.202302180 doi: 10.1002/anie.202302180
14. [14]
  Xu, L.; Peng, S.; Mao, Y.; Zong, Y.; Zhang, X.; Wu, D. Water Res. 2022, 216, 118290. doi: 10.1016/j.watres.2022.118290 doi: 10.1016/j.watres.2022.118290
15. [15]
  Jeon, S.-i.; Park, H.-R.; Yeo, J.-G.; Yang, S.; Cho, C. H.; Han, M. H.; Kim, D. K. Energy Environ. Sci. 2013, 6 (5), 1471. doi: 10.1039/C3EE24443A doi: 10.1039/C3EE24443A
16. [16]
  Rhee, H.; Kwak, R. Water Res. 2023, 244, 120436. doi: 10.1016/j.watres.2023.120436 doi: 10.1016/j.watres.2023.120436
17. [17]
  Du, J.; Xing, W.; Yu, J.; Feng, J.; Tang, L.; Tang, W. Water Res. 2023, 235, 119831. doi: 10.1016/j.watres.2023.119831 doi: 10.1016/j.watres.2023.119831
18. [18]
  Lu, M.; Liu, J. Y.; Cheng, J.; Wang, S. P.; Yang, J. M. Acta Phys. -Chim. Sin. 2014, 30 (12), 2263. doi: 10.3866/PKU.WHXB201410141 doi: 10.3866/PKU.WHXB201410141
19. [19]
  Wang, L.; Yu, F.; Ma, J. Acta Phys. -Chim. Sin. 2017, 33 (7), 1338. doi: 10.3866/PKU.WHXB201704113 doi: 10.3866/PKU.WHXB201704113
20. [20]
  Wang, X. W.; Jiang, F. T.; Suo, Q. L.; Fang, Y. Z.; Lu, Y. Acta Phys. -Chim. Sin. 2011, 27 (11), 2605. doi: 10.3866/PKU.WHXB20111116 doi: 10.3866/PKU.WHXB20111116
21. [21]
  Wang, L.; Lin, S. Environ. Sci. Technol. 2019, 53 (10), 5797. doi: 10.1021/acs.est.9b00655 doi: 10.1021/acs.est.9b00655
22. [22]
  Seo, S.-J.; Jeon, H.; Lee, J. K.; Kim, G.-Y.; Park, D.; Nojima, H.; Lee, J.; Moon, S.-H. Water Res. 2010, 44 (7), 2267. doi: 10.1016/j.watres.2009.10.020 doi: 10.1016/j.watres.2009.10.020
23. [23]
  Uwayid, R.; Guyes, E. N.; Shocron, A. N.; Gilron, J.; Elimelech, M.; Suss, M. E. Water Res. 2022, 210, 117959. doi: 10.1016/j.watres.2021.117959 doi: 10.1016/j.watres.2021.117959
24. [24]
  Yoon, H.; Lee, J.; Kim, S.-R.; Kang, J.; Kim, S.; Kim, C.; Yoon, J. Desalination 2016, 392, 46. doi: 10.1016/j.desal.2016.03.019 doi: 10.1016/j.desal.2016.03.019
25. [25]
  Wang, W.; Ma, P.; Li, H. Desalination 2023, 564, 116798. doi: 10.1016/j.desal.2023.116798 doi: 10.1016/j.desal.2023.116798
26. [26]
  Yu, F.; Zhang, X.; Liu, P.; Chen, B.; Ma, J. Small 2023, 19 (10), 2205619. doi: 10.1002/smll.202205619 doi: 10.1002/smll.202205619
27. [27]
  Kang, H.; Zhang, D.; Chen, X.; Zhao, H.; Yang, D.; Li, Y.; Bao, M.; Wang, Z. Water Res. 2023, 229, 119441. doi: 10.1016/j.watres.2022.119441 doi: 10.1016/j.watres.2022.119441
28. [28]
  Wang, G.; Yan, T.; Shen, J.; Zhang, J.; Zhang, D. Environ. Sci. Technol. 2021, 55 (17), 11979. doi: 10.1021/acs.est.1c03228 doi: 10.1021/acs.est.1c03228
29. [29]
  Cao, Y.; Yan, L.; Gang, H.; Wu, B.; Wei, D.; Chen, P.; Zhang, T.; Wang, H. Desalination 2023, 551, 116409. doi: 10.1016/j.desal.2023.116409 doi: 10.1016/j.desal.2023.116409
30. [30]
  He, Y.; Huang, L.; Zhao, Y.; Yang, W.; Hao, T.; Wu, B.; Deng, H.; Wei, D.; Wang, H.; Luo, J. Environ. Sci.: Nano 2020, 7 (10), 3007. doi: 10.1039/D0EN00826E doi: 10.1039/D0EN00826E
31. [31]
  Lei, J.; Xiong, Y.; Yu, F.; Ma, J. Chem. Eng. J. 2022, 437, 135381. doi: 10.1016/j.cej.2022.135381 doi: 10.1016/j.cej.2022.135381
32. [32]
  Wang, K.; Liu, Y.; Ding, Z.; Chen, Z.; Xu, X.; Wang, M.; Lu, T.; Pan, L. Chem. Eng. J. 2022, 433, 133578. doi: 10.1016/j.cej.2021.133578 doi: 10.1016/j.cej.2021.133578
33. [33]
  Zhang, Z.; Li, H. Environ. Sci.: Nano 2021, 8 (7), 1886. doi: 10.1039/D1EN00350J doi: 10.1039/D1EN00350J
34. [34]
  Xiong, Y. C.; Yu, F.; Ma, J. Acta Phys. -Chim. Sin. 2022, 38 (5), 2006037. doi: 10.3866/PKU.WHXB202006037 doi: 10.3866/PKU.WHXB202006037
35. [35]
  Cuong, D. V.; Wu, P.-C.; Liou, S. Y. H.; Hou, C.-H. J. Hazard. Mater. 2022, 423, 127084. doi: 10.1016/j.jhazmat.2021.127084 doi: 10.1016/j.jhazmat.2021.127084
36. [36]
  Fan, C.-S.; Tseng, S.-C.; Li, K.-C.; Hou, C.-H. J. Hazard. Mater. 2016, 312, 208. doi: 10.1016/j.jhazmat.2016.03.055 doi: 10.1016/j.jhazmat.2016.03.055
37. [37]
  Huang, X.; Guo, X.; Dong, Q.; Liu, L.; Tallon, R.; Chen, J. Environ. Sci.: Nano 2019, 6 (11), 3225. doi: 10.1039/C9EN00730J doi: 10.1039/C9EN00730J
38. [38]
  Liu, P.; Yan, T.; Zhang, J.; Shi, L.; Zhang, D. J. Mater. Chem. A 2017, 5 (28), 14748. doi: 10.1039/C7TA03515B doi: 10.1039/C7TA03515B
39. [39]
  Bharath, G.; Rambabu, K.; Banat, F.; Hai, A.; Arangadi, A. F.; Ponpandian, N. Sci. Total Environ. 2019, 691, 713. doi: 10.1016/j.scitotenv.2019.07.069 doi: 10.1016/j.scitotenv.2019.07.069
40. [40]
  Hou, S.; Xu, X.; Wang, M.; Lu, T.; Sun, C. Q.; Pan, L. Chem. Eng. J. 2018, 337, 398. doi: 10.1016/j.cej.2017.12.120 doi: 10.1016/j.cej.2017.12.120
41. [41]
  Xu, L.; Yu, C.; Mao, Y.; Zong, Y.; Zhang, B.; Chu, H.; Wu, D. J. Hazard. Mater. 2021, 402, 123568. doi: 10.1016/j.jhazmat.2020.123568 doi: 10.1016/j.jhazmat.2020.123568
42. [42]
  Wang, S.; Zhuang, H.; Shen, X.; Zhao, L.; Pan, Z.; Liu, L.; Lv, S.; Wang, G. J. Hazard. Mater. 2023, 457, 131785. doi: 10.1016/j.jhazmat.2023.131785 doi: 10.1016/j.jhazmat.2023.131785
43. [43]
  Deng, H.; Wei, W.; Yao, L.; Zheng, Z.; Li, B.; Abdelkader, A.; Deng, L. Adv. Sci. 2022, 9 (30), 2203189. doi: 10.1002/advs.202203189 doi: 10.1002/advs.202203189
44. [44]
  Tian, Y.; Chen, N.; Yang, X.; Li, C.; He, W.; Ren, N.; Liu, G.; Yang, W. Water Res. 2023, 231, 119645. doi: 10.1016/j.watres.2023.119645 doi: 10.1016/j.watres.2023.119645
45. [45]
  Xu, L.; Ding, R.; Mao, Y.; Peng, S.; Li, Z.; Zong, Y.; Wu, D. Water Res. 2021, 202, 117423. doi: 10.1016/j.watres.2021.117423 doi: 10.1016/j.watres.2021.117423
46. [46]
  Bian, Y.; Chen, X.; Ren, Z. J. Environ. Sci. Technol. 2020, 54 (14), 9116. doi: 10.1021/acs.est.0c01836 doi: 10.1021/acs.est.0c01836
47. [47]
  Sun, J.; Garg, S.; Waite, T. D. Environ. Sci. Technol. 2023, 57 (39), 14726. doi: 10.1021/acs.est.3c03922 doi: 10.1021/acs.est.3c03922
48. [48]
  Chen, J.; Zuo, K.; Li, Y.; Huang, X.; Hu, J.; Yang, Y.; Wang, W.; Chen, L.; Jain, A.; Verduzco, R.; et al. Water Res. 2022, 216, 118351. doi: 10.1016/j.watres.2022.118351 doi: 10.1016/j.watres.2022.118351
49. [49]
  Xiang, S.; Mao, H.; Geng, W.; Xu, Y.; Zhou, H. J. Hazard. Mater. 2022, 431, 128591. doi: 10.1016/j.jhazmat.2022.128591 doi: 10.1016/j.jhazmat.2022.128591
50. [50]
  Tang, K.; Zheng, H.; Du, P.; Zhou, K. Environ. Sci. Technol. 2022, 56 (12), 8885. doi: 10.1021/acs.est.2c00982 doi: 10.1021/acs.est.2c00982
51. [51]
  Pi, S.-Y.; Sun, M.-Y.; Zhao, Y.-F.; Chong, Y.-X.; Chen, D.; Liu, H. Chem. Eng. J. 2022, 435, 134967. doi: 10.1016/j.cej.2022.134967 doi: 10.1016/j.cej.2022.134967
52. [52]
  Wang, Y.; El-Deen, A. G.; Li, P.; Oh, B. H. L.; Guo, Z.; Khin, M. M.; Vikhe, Y. S.; Wang, J.; Hu, R. G.; Boom, R. M.; et al. ACS Nano 2015, 9 (10). doi: 10.1021/acsnano.5b03763 doi: 10.1021/acsnano.5b03763
53. [53]
  Porada, S.; Zhao, R.; van der Wal, A.; Presser, V.; Biesheuvel, P. M. Prog. Mater. Sci. 2013, 58 (8), 1388. doi: 10.1016/j.pmatsci.2013.03.005 doi: 10.1016/j.pmatsci.2013.03.005
54. [54]
  Avraham, E.; Noked, M.; Bouhadana, Y.; Soffer, A.; Aurbach, D. J. Electrochem. Soc. 2009, 156 (10), 157. doi: 10.1149/1.3193709 doi: 10.1149/1.3193709
55. [55]
  Srimuk, P.; Zeiger, M.; Jäckel, N.; Tolosa, A.; Krüner, B.; Fleischmann, S.; Grobelsek, I.; Aslan, M.; Shvartsev, B.; Suss, M. E.; et al. Electrochim. Acta 2017, 224, 314. doi: 10.1016/j.electacta.2016.12.060 doi: 10.1016/j.electacta.2016.12.060
56. [56]
  Lee, J.-B.; Park, K.-K.; Eum, H.-M.; Lee, C.-W. Desalination 2006, 196 (1), 125. doi: 10.1016/j.desal.2006.01.011 doi: 10.1016/j.desal.2006.01.011
57. [57]
  Yang, F.; He, Y.; Rosentsvit, L.; Suss, M. E.; Zhang, X.; Gao, T.; Liang, P. Water Res. 2021, 200, 117222. doi: 10.1016/j.watres.2021.117222 doi: 10.1016/j.watres.2021.117222
58. [58]
  Tang, W.; Liang, J.; He, D.; Gong, J.; Tang, L.; Liu, Z.; Wang, D.; Zeng, G. Water Res. 2019, 150, 225. doi: 10.1016/j.watres.2018.11.064 doi: 10.1016/j.watres.2018.11.064
59. [59]
  Hwang, J.-Y.; Myung, S.-T.; Sun, Y.-K. Chem. Soc. Rev. 2017, 46 (12), 3529. doi: 10.1039/C6CS00776G doi: 10.1039/C6CS00776G
60. [60]
  Kim, H.; Hong, J.; Park, K.-Y.; Kim, H.; Kim, S.-W.; Kang, K. Chem. Rev. 2014, 114 (23), 11788. doi: 10.1021/cr500232y doi: 10.1021/cr500232y
61. [61]
  Pasta, M.; Wessells, C. D.; Cui, Y.; La Mantia, F. Nano Lett. 2012, 12 (2), 839. doi: 10.1021/nl203889e doi: 10.1021/nl203889e
62. [62]
  Byles, B. W.; Cullen, D. A.; More, K. L.; Pomerantseva, E. Nano Energy 2018, 44, 476. doi: 10.1016/j.nanoen.2017.12.015 doi: 10.1016/j.nanoen.2017.12.015
63. [63]
  Yuan, S.; Liu, Y.-B.; Xu, D.; Ma, D.-L.; Wang, S.; Yang, X.-H.; Cao, Z.-Y.; Zhang, X.-B. Adv. Sci. 2015, 2 (3), 1400018. doi: 10.1002/advs.201400018 doi: 10.1002/advs.201400018
64. [64]
  Wang, X.; Kajiyama, S.; Iinuma, H.; Hosono, E.; Oro, S.; Moriguchi, I.; Okubo, M.; Yamada, A. Nat. Commun. 2015, 6 (1), 6544. doi: 10.1038/ncomms7544 doi: 10.1038/ncomms7544
65. [65]
  Bao, W.; Tang, X.; Guo, X.; Choi, S.; Wang, C.; Gogotsi, Y.; Wang, G. Joule 2018, 2 (4), 778. doi: 10.1016/j.joule.2018.02.018 doi: 10.1016/j.joule.2018.02.018
66. [66]
  Ye, M.; Pasta, M.; Xie, X.; Cui, Y.; Criddle, C. S. Energy Environ. Sci. 2014, 7 (7), 2295. doi: 10.1039/C4EE01034E doi: 10.1039/C4EE01034E
67. [67]
  Nam, D.-H.; Choi, K.-S. J. Am. Chem. Soc. 2017, 139 (32), 11055. doi: 10.1021/jacs.7b01119 doi: 10.1021/jacs.7b01119
68. [68]
  Li, Y.; Ding, Z.; Li, J.; Li, J.; Lu, T.; Pan, L. Desalination 2019, 469, 114098. doi: 10.1016/j.desal.2019.114098 doi: 10.1016/j.desal.2019.114098
69. [69]
  Wu, Y.; Zeng, R.; Nan, J.; Shu, D.; Qiu, Y.; Chou, S.-L. Adv. Energy Mater. 2017, 7 (24), 1700278. doi: 10.1002/aenm.201700278 doi: 10.1002/aenm.201700278
70. [70]
  Su, X.; Kushima, A.; Halliday, C.; Zhou, J.; Li, J.; Hatton, T. A. Nat. Commun. 2018, 9 (1), 4701. doi: 10.1038/s41467-018-07159-0 doi: 10.1038/s41467-018-07159-0
71. [71]
  Li, Q.; Zheng, Y.; Xiao, D.; Or, T.; Gao, R.; Li, Z.; Feng, M.; Shui, L.; Zhou, G.; Wang, X.; Chen, Z. Adv. Sci. 2020, 7 (22), 2002213. doi: 10.1002/advs.202002213 doi: 10.1002/advs.202002213
72. [72]
  Metzger, M.; Besli, M. M.; Kuppan, S.; Hellstrom, S.; Kim, S.; Sebti, E.; Subban, C. V.; Christensen, J. Energy Environ. Sci. 2020, 13 (6), 1544. doi: 10.1039/D0EE00725K doi: 10.1039/D0EE00725K
73. [73]
  Liu, S.; Do, V. Q.; Smith, K. C. Curr. Opin. Electrochem. 2020, 22, 72. doi: 10.1016/j.coelec.2020.05.003 doi: 10.1016/j.coelec.2020.05.003
74. [74]
  Sun, K.; Tebyetekerwa, M.; Wang, C.; Wang, X.; Zhang, X.; Zhao, X. S. Adv. Funct. Mater. 2023, 33 (18), 2213578. doi: 10.1002/adfm.202213578 doi: 10.1002/adfm.202213578
75. [75]
  Dutta, S.; de Luis, R. F.; Goscianska, J.; Demessence, A.; Ettlinger, R.; Wuttke, S. Adv. Funct. Mater. 2023, 2304790. doi: 10.1002/adfm.202304790 doi: 10.1002/adfm.202304790
76. [76]
  Zuo, K.; Garcia-Segura, S.; Cerrón-Calle, G. A.; Chen, F.-Y.; Tian, X.; Wang, X.; Huang, X.; Wang, H.; Alvarez, P. J. J.; Lou, J.; et al. Nat. Rev. Mater. 2023, 8 (7), 472. doi: 10.1038/s41578-023-00564-y doi: 10.1038/s41578-023-00564-y
77. [77]
  Hao, Z.; Sun, X.; Chen, J.; Zhou, X.; Zhang, Y. Small 2023, 19 (33), 2300253. doi: 10.1002/smll.202300253 doi: 10.1002/smll.202300253
78. [78]
  Murphy, G. W.; Caudle, D. D. Electrochim. Acta 1967, 12 (12), 1655. doi: 10.1016/0013-4686(67)80079-3 doi: 10.1016/0013-4686(67)80079-3
79. [79]
  Johnson, A. M.; Newman, J. J. Electrochem. Soc. 1971, 118 (3), 510. doi: 10.1149/1.2408094. doi: 10.1149/1.2408094
80. [80]
  de Levie, R. Electrochim. Acta 1963, 8 (10), 751. doi: 10.1016/0013-4686(63)80042-0 doi: 10.1016/0013-4686(63)80042-0
81. [81]
  Helmholtz, H. Ann. Phys. 1879, 243 (7), 337. doi: 10.1002/andp.18792430702 doi: 10.1002/andp.18792430702
82. [82]
  Gouy, M. J. Phys. Theor. Appl. 1910, 9 (1), 457. doi: 10.1051/jphystap:019100090045700.Ajp doi: 10.1051/jphystap:019100090045700.Ajp
83. [83]
  Chapman, D. L. Lond. Edinb. Dubl. Phil. Mag. 1913, 25 (148), 475. doi: 10.1080/14786440408634187 doi: 10.1080/14786440408634187
84. [84]
  Zhao, R.; Biesheuvel, P. M.; van der Wal, A. Energy Environ. Sci. 2012, 5 (11), 9520. doi: 10.1039/C2EE21737F doi: 10.1039/C2EE21737F
85. [85]
  Biesheuvel, P. M.; Zhao, R.; Porada, S.; van der Wal, A. J. Colloid Interface Sci. 2011, 360 (1), 239. doi: 10.1016/j.jcis.2011.04.049 doi: 10.1016/j.jcis.2011.04.049
86. [86]
  Suss, M. E.; Biesheuvel, P. M.; Baumann, T. F.; Stadermann, M.; Santiago, J. G. Environ. Sci. Technol. 2014, 48 (3), 2008. doi: 10.1021/es403682n doi: 10.1021/es403682n
87. [87]
  Tang, W.; Kovalsky, P.; He, D.; Waite, T. D. Water Res. 2015, 84, 342. doi: 10.1016/j.watres.2015.08.012 doi: 10.1016/j.watres.2015.08.012
88. [88]
  Gao, X.; Porada, S.; Omosebi, A.; Liu, K. L.; Biesheuvel, P. M.; Landon, J. Water Res. 2016, 92, 275. doi: 10.1016/j.watres.2016.01.048 doi: 10.1016/j.watres.2016.01.048
89. [89]
  Biesheuvel, P. M.; Hamelers, H. V. M.; Suss, M. E. Colloids Interface Sci. Commun. 2015, 9, 1. doi: 10.1016/j.colcom.2015.12.001 doi: 10.1016/j.colcom.2015.12.001
90. [90]
  Guyes, E. N.; Malka, T.; Suss, M. E. Environ. Sci. Technol. 2019, 53 (14), 8447. doi: 10.1021/acs.est.8b06954 doi: 10.1021/acs.est.8b06954
91. [91]
  Hemmatifar, A.; Oyarzun, D. I.; Palko, J. W.; Hawks, S. A.; Stadermann, M.; Santiago, J. G. Water Res. 2017, 122, 387. doi: 10.1016/j.watres.2017.05.036 doi: 10.1016/j.watres.2017.05.036
92. [92]
  Li, B.; Zheng, T.; Ran, S.; Sun, M.; Shang, J.; Hu, H.; Lee, P.-H.; Boles, S. T. Environ. Sci. Technol. 2020, 54 (3), 1848. doi: 10.1021/acs.est.9b04749 doi: 10.1021/acs.est.9b04749
93. [93]
  Shi, C.; Wang, H.; Li, A.; Zhu, G.; Zhao, X.; Wu, F. Water Res. 2023, 230, 119517. doi: 10.1016/j.watres.2022.119517 doi: 10.1016/j.watres.2022.119517
94. [94]
  Porada, S.; Borchardt, L.; Oschatz, M.; Bryjak, M.; Atchison, J. S.; Keesman, K. J.; Kaskel, S.; Biesheuvel, P. M.; Presser, V. Energy Environ. Sci. 2013, 6 (12), 3700. doi: 10.1039/C3EE42209G doi: 10.1039/C3EE42209G
95. [95]
  Patel, S. K.; Qin, M.; Walker, W. S.; Elimelech, M. Environ. Sci. Technol. 2020, 54 (6), 3663. doi: 10.1021/acs.est.9b07482 doi: 10.1021/acs.est.9b07482
96. [96]
  Nordstrand, J.; Laxman, K.; Myint, M. T. Z.; Dutta, J. J. Phys. Chem. A 2019, 123 (30), 6628. doi: 10.1021/acs.jpca.9b05503 doi: 10.1021/acs.jpca.9b05503
97. [97]
  Nordstrand, J.; Dutta, J. Langmuir 2020, 36 (5), 1338. doi: 10.1021/acs.langmuir.9b03571 doi: 10.1021/acs.langmuir.9b03571
98. [98]
  Nordstrand, J.; Dutta, J. Langmuir 2022, 38 (11), 3350. doi: 10.1021/acs.langmuir.1c02806 doi: 10.1021/acs.langmuir.1c02806
99. [99]
  Smith, K. C.; Dmello, R. J. Electrochem. Soc. 2016, 163 (3), A530. doi: 10.1149/2.0761603jes doi: 10.1149/2.0761603jes
100. [100]
  Smith, K. C. Electrochim. Acta 2017, 230, 333. doi: 10.1016/j.electacta.2017.02.006 doi: 10.1016/j.electacta.2017.02.006
101. [101]
  Liu, S.; Smith, K. C. Electrochim. Acta 2018, 271, 652. doi: 10.1016/j.electacta.2018.03.065 doi: 10.1016/j.electacta.2018.03.065
102. [102]
  Reale, E. R.; Shrivastava, A.; Smith, K. C. Water Res. 2019, 165, 114995. doi: 10.1016/j.watres.2019.114995 doi: 10.1016/j.watres.2019.114995
103. [103]
  Singh, K.; Bouwmeester, H. J. M.; de Smet, L. C. P. M.; Bazant, M. Z.; Biesheuvel, P. M. Phys. Rev. Appl. 2018, 9 (6), 064036. doi: 10.1103/PhysRevApplied.9.064036 doi: 10.1103/PhysRevApplied.9.064036
104. [104]
  He, F.; Biesheuvel, P. M.; Bazant, M. Z.; Hatton, T. A. Water Res. 2018, 132, 282. doi: 10.1016/j.watres.2017.12.073 doi: 10.1016/j.watres.2017.12.073
105. [105]
  He, F.; Bazant, M. Z.; Hatton, T. A. J. Electrochem. Soc. 2021, 168 (5), 053501. doi: 10.1149/1945-7111/abfefd doi: 10.1149/1945-7111/abfefd
106. [106]
  Han, L.; Karthikeyan, K. G.; Anderson, M. A.; Gregory, K. B. J. Colloid Interface Sci. 2014, 430, 93. doi: 10.1016/j.jcis.2014.05.015 doi: 10.1016/j.jcis.2014.05.015
107. [107]
  Han, B.; Cheng, G.; Wang, Y.; Wang, X. Chem. Eng. J. 2019, 360, 364. doi: 10.1016/j.cej.2018.11.236 doi: 10.1016/j.cej.2018.11.236
108. [108]
  Zou, L.; Li, L.; Song, H.; Morris, G. Water Res. 2008, 42 (8), 2340. doi: 10.1016/j.watres.2007.12.022 doi: 10.1016/j.watres.2007.12.022
109. [109]
  Tsouris, C.; Mayes, R.; Kiggans, J.; Sharma, K.; Yiacoumi, S.; DePaoli, D.; Dai, S. Environ. Sci. Technol. 2011, 45 (23), 10243. doi: 10.1021/es201551e doi: 10.1021/es201551e
110. [110]
  Li, L.; Zou, L.; Song, H.; Morris, G. Carbon 2009, 47 (3), 775. doi: 10.1016/j.carbon.2008.11.012 doi: 10.1016/j.carbon.2008.11.012
111. [111]
  Mayes, R. T.; Tsouris, C.; Kiggans, J. O., Jr.; Mahurin, S. M.; DePaoli, D. W.; Dai, S. J. Mater. Chem. 2010, 20 (39), 8674. doi: 10.1039/C0JM01911A doi: 10.1039/C0JM01911A
112. [112]
  Porada, S.; Weinstein, L.; Dash, R.; van der Wal, A.; Bryjak, M.; Gogotsi, Y.; Biesheuvel, P. M. ACS Appl. Mater. Interfaces 2012, 4 (3), 1194. doi: 10.1021/am201683j doi: 10.1021/am201683j
113. [113]
  Shirbani, M.; Siavashi, M.; Hosseini, M.; Bidabadi, M. J. Energy Storage 2022, 52, 104744. doi: 10.1016/j.est.2022.104744 doi: 10.1016/j.est.2022.104744
114. [114]
  Fang, W.-Z.; Tang, Y.-Q.; Ban, C.; Kang, Q.; Qiao, R.; Tao, W.-Q. Chem. Eng. J. 2019, 378, 122099. doi: 10.1016/j.cej.2019.122099 doi: 10.1016/j.cej.2019.122099
115. [115]
  Zakirov, T. R.; Varfolomeev, M. A.; Yuan, C. Chem. Eng. Res. Des. 2023, 189, 14. doi: 10.1016/j.cherd.2022.10.046 doi: 10.1016/j.cherd.2022.10.046
116. [116]
  Yoshida, H.; Kinjo, T.; Washizu, H. Commun. Nonlinear. Sci. 2014, 19 (10), 3570. doi: 10.1016/j.cnsns.2014.03.005 doi: 10.1016/j.cnsns.2014.03.005
117. [117]
  Zhang, L.; Wang, M. J. Geophys. Res. Solid Earth 2015, 120 (5), 2877. doi: 10.1002/2014JB011812 doi: 10.1002/2014JB011812
118. [118]
  Yang, Y.; Wang, M. Cem. Concr. Compos. 2018, 85, 92. doi: 10.1016/j.cemconcomp.2017.09.014 doi: 10.1016/j.cemconcomp.2017.09.014
119. [119]
  Yang, Y.; Wang, M. J. Colloid Interface Sci. 2018, 514, 443. doi: 10.1016/j.jcis.2017.12.047 doi: 10.1016/j.jcis.2017.12.047
120. [120]
  Liu, R.; Yao, S.; Li, Y.; Cheng, J. Int. J. Heat Mass Transf. 2019, 135, 769. doi: 10.1016/j.ijheatmasstransfer.2019.01.149 doi: 10.1016/j.ijheatmasstransfer.2019.01.149
121. [121]
  Liu, R.; Chen, L.; Yao, S.; Shen, Y. J. Mol. Liq. 2021, 332, 115863. doi: 10.1016/j.molliq.2021.115863 doi: 10.1016/j.molliq.2021.115863
122. [122]
  Liu, R.; Yao, S.; Shen, Y. Desalination 2022, 532, 115718. doi: 10.1016/j.desal.2022.115718 doi: 10.1016/j.desal.2022.115718
123. [123]
  Liu, M.; Waugh, J.; Babu, S. K.; Spendelow, J. S.; Kang, Q. Desalination 2022, 526, 115520. doi: 10.1016/j.desal.2021.115520 doi: 10.1016/j.desal.2021.115520
124. [124]
  Liu, R.; Luo, J.; Yao, S.; Yang, Y. Sep. Purif. Technol. 2022, 298, 121626. doi: 10.1016/j.seppur.2022.121626 doi: 10.1016/j.seppur.2022.121626
125. [125]
  Yao, N.; Chen, X.; Fu, Z.-H.; Zhang, Q. Chem. Rev. 2022, 122 (12), 10970. doi: 10.1021/acs.chemrev.1c00904 doi: 10.1021/acs.chemrev.1c00904
126. [126]
  Hawks, S. A.; Cerón, M. R.; Oyarzun, D. I.; Pham, T. A.; Zhan, C.; Loeb, C. K.; Mew, D.; Deinhart, A.; Wood, B. C.; Santiago, J. G.; et al. Environ. Sci. Technol. 2019, 53 (18), 10863. doi: 10.1021/acs.est.9b01374 doi: 10.1021/acs.est.9b01374
127. [127]
  Bone, S. E.; Steinrück, H.-G.; Toney, M. F. Joule 2020, 4 (8), 1637. doi: 10.1016/j.joule.2020.06.020 doi: 10.1016/j.joule.2020.06.020
128. [128]
  Xu, Y.; Zhou, H.; Wang, G.; Zhang, Y.; Zhang, H.; Zhao, H. ACS Appl. Mater. Interfaces 2020, 12 (37), 41437. doi: 10.1021/acsami.0c11233 doi: 10.1021/acsami.0c11233
129. [129]
  Rikhtehgaran, S.; Lohrasebi, A. Desalination 2015, 365, 176. doi: 10.1016/j.desal.2015.02.040 doi: 10.1016/j.desal.2015.02.040
130. [130]
  Cai, Y.; Zhang, W.; Fang, R.; Zhao, D.; Wang, Y.; Wang, J. Desalination 2021, 520, 115325. doi: 10.1016/j.desal.2021.115325 doi: 10.1016/j.desal.2021.115325
131. [131]
  Saffarimiandoab, F.; Sabetvand, R.; Zhang, X. J. Mater. Chem. A 2022, 10 (43), 23332. doi: 10.1039/D2TA06006J. doi: 10.1039/D2TA06006J
132. [132]
  Noked, M.; Avraham, E.; Bohadana, Y.; Soffer, A.; Aurbach, D. J. Phys. Chem. C 2009, 113 (17), 7316. doi: 10.1021/jp811283b doi: 10.1021/jp811283b
133. [133]
  Thøgersen, J.; Réhault, J.; Odelius, M.; Ogden, T.; Jena, N. K.; Jensen, S. J. K.; Keiding, S. R.; Helbing, J. J. Phys. Chem. B 2013, 117 (12), 3376. doi: 10.1021/jp310090u doi: 10.1021/jp310090u
134. [134]
  Cerón, M. R.; Aydin, F.; Hawks, S. A.; Oyarzun, D. I.; Loeb, C. K.; Deinhart, A.; Zhan, C.; Pham, T. A.; Stadermann, M.; Campbell, P. G. ACS Appl. Mater. Interfaces 2020, 12 (38), 42644. doi: 10.1021/acsami.0c07903 doi: 10.1021/acsami.0c07903
135. [135]
  Mao, Y.; Ardham, V. R.; Xu, L.; Cui, P.; Wu, D. Chem. Eng. J. 2021, 415, 128920. doi: 10.1016/j.cej.2021.128920 doi: 10.1016/j.cej.2021.128920
136. [136]
  Mao, Y.; Zhou, T.; Xu, L.; Wu, W.; Wang, R.; Xiong, Z.; Wu, D.; Shi, H. Chem. Eng. J. 2022, 435, 134750. doi: 10.1016/j.cej.2022.134750 doi: 10.1016/j.cej.2022.134750
137. [137]
  Bo, Z.; Yang, J.; Qi, H.; Yan, J.; Cen, K.; Han, Z. Energy Stor. Mater. 2020, 31, 64. doi: 10.1016/j.ensm.2020.06.001 doi: 10.1016/j.ensm.2020.06.001
138. [138]
  Breitsprecher, K.; Janssen, M.; Srimuk, P.; Mehdi, B. L.; Presser, V.; Holm, C.; Kondrat, S. Nat. Commun. 2020, 11 (1), 6085. doi: 10.1038/s41467-020-19903-6 doi: 10.1038/s41467-020-19903-6
139. [139]
  Deng, W.; Chen, Y.; Wang, Z.; Chen, X.; Gao, M.; Chen, F.; Chen, W.; Ao, T. Water Res. 2022, 222, 118927. doi: 10.1016/j.watres.2022.118927 doi: 10.1016/j.watres.2022.118927
140. [140]
  Huo, S.; Song, X.; Zhao, Y.; Ni, W.; Wang, H.; Li, K. J. Mater. Chem. A 2020, 8 (38), 19927. doi: 10.1039/D0TA07014A doi: 10.1039/D0TA07014A
141. [141]
  Liang, M.; Liu, N.; Zhang, X.; Xiao, Y.; Yang, J.; Yu, F.; Ma, J. Adv. Funct. Mater. 2022, 32 (49), 2209741. doi: 10.1002/adfm.202209741 doi: 10.1002/adfm.202209741
142. [142]
  Zhang, Z.; Li, H. Chem. Eng. J. 2022, 447, 137438. doi: 10.1016/j.cej.2022.137438 doi: 10.1016/j.cej.2022.137438
143. [143]
  Liu, N.; Yu, L.; Liu, B.; Yu, F.; Li, L.; Xiao, Y.; Yang, J.; Ma, J. Adv. Sci. 2023, 10 (2), 2204041. doi: 10.1002/advs.202204041 doi: 10.1002/advs.202204041
144. [144]
  Singh, K.; Li, G.; Lee, J.; Zuilhof, H.; Mehdi, B. L.; Zornitta, R. L.; de Smet, L. C. P. M. Adv. Funct. Mater. 2021, 31 (41), 2105203. doi: 10.1002/adfm.202105203 doi: 10.1002/adfm.202105203
145. [145]
  Liu, Z.; Li, H. Energy Environ. Mater. 2023, 6 (1), e12255. doi: 10.1002/eem2.12255 doi: 10.1002/eem2.12255
146. [146]
  Gong, S.; Liu, H.; Zhao, F.; Zhang, Y.; Xu, H.; Li, M.; Qi, J.; Wang, H.; Li, C.; Peng, W.; et al. ACS Nano 2023, 17 (5), 4843. doi: 10.1021/acsnano.2c11430 doi: 10.1021/acsnano.2c11430
147. [147]
  Tang, K.; Hong, T. Z. X.; You, L.; Zhou, K. J. Mater. Chem. A 2019, 7 (47), 26693. doi: 10.1039/C9TA08663C doi: 10.1039/C9TA08663C
148. [148]
  Dickinson, E. J. F.; Ekström, H.; Fontes, E. Electrochem. Commun. 2014, 40, 71. doi: 10.1016/j.elecom.2013.12.020 doi: 10.1016/j.elecom.2013.12.020
149. [149]
  Zang, X.; Xue, Y.; Ni, W.; Li, C.; Hu, L.; Zhang, A.; Yang, Z.; Yan, Y.-M. ACS Appl. Mater. Interfaces 2020, 12 (2), 2180. doi: 10.1021/acsami.9b12744 doi: 10.1021/acsami.9b12744
150. [150]
  Liu, M.; Xu, M.; Xue, Y.; Ni, W.; Huo, S.; Wu, L.; Yang, Z.; Yan, Y.-M. ACS Appl. Mater. Interfaces 2018, 10 (37), 31260. doi: 10.1021/acsami.8b08232 doi: 10.1021/acsami.8b08232
151. [151]
  Zang, X.; Fu, Z.; Wang, D.; Yuan, Z.; Shi, N.; Yang, Z.; Yan, Y.-M. J. Mater. Chem. A 2022, 10 (18), 9988. doi: 10.1039/D2TA00611A doi: 10.1039/D2TA00611A
152. [152]
  Xiong, Y.; Yu, F.; Arnold, S.; Wang, L.; Presser, V.; Ren, Y.; Ma, J. Research 2021, 2021. doi: 10.34133/2021/9754145 doi: 10.34133/2021/9754145
153. [153]
  Liu, X.; Xu, X.; Xuan, X.; Xia, W.; Feng, G.; Zhang, S.; Wu, Z.-G.; Zhong, B.; Guo, X.; Xie, K.; et al. J. Am. Chem. Soc. 2023, 145 (16), 9242. doi: 10.1021/jacs.3c01755 doi: 10.1021/jacs.3c01755
154. [154]
  Nordstrand, J.; Zuili, L.; Toledo-Carrillo, E. A.; Dutta, J. Desalination 2022, 525, 115493. doi: 10.1016/j.desal.2021.115493 doi: 10.1016/j.desal.2021.115493
155. [155]
  Nordstrand, J.; Dutta, J. SoftwareX 2022, 20, 101234. doi: 10.1016/j.softx.2022.101234 doi: 10.1016/j.softx.2022.101234
156. [156]
  Nordstrand, J. Desalination 2023, 566, 116899. doi: 10.1016/j.desal.2023.116899 doi: 10.1016/j.desal.2023.116899
157. [157]
  Nordstrand, J.; Dutta, J. Desalination 2023, 565, 116865. doi: 10.1016/j.desal.2023.116865 doi: 10.1016/j.desal.2023.116865
158. [158]
  Laxman, K.; Husain, A.; Nasser, A.; Al Abri, M.; Dutta, J. Desalination 2019, 449, 111. doi: 10.1016/j.desal.2018.10.021 doi: 10.1016/j.desal.2018.10.021
159. [159]
  Gaikwad, M. S.; Balomajumder, C.; Tiwari, A. K. Chemosphere 2020, 254, 126781. doi: 10.1016/j.chemosphere.2020.126781 doi: 10.1016/j.chemosphere.2020.126781
160. [160]
  Yan, L.; Annor Asare, J.; Wu, B.; Gang, H.; Wei, D.; Cao, Y.; Chen, P.; Wang, H.; Huang, L. ACS ES&T Water 2023, 3 (8), 2753. doi: 10.1021/acsestwater.3c00242 doi: 10.1021/acsestwater.3c00242
161. [161]
  He, C.; Lian, B.; Ma, J.; Zhang, C.; Wang, Y.; Mo, H.; Waite, T. D. Water Res. 2021, 203, 117498. doi: 10.1016/j.watres.2021.117498 doi: 10.1016/j.watres.2021.117498
162. [162]
  Lado, J. J.; Cartolano, V.; García-Quismondo, E.; García, G.; Almonacid, I.; Senatore, V.; Naddeo, V.; Palma, J.; Anderson, M. A. Desalination 2021, 501, 114912. doi: 10.1016/j.desal.2020.114912 doi: 10.1016/j.desal.2020.114912
163. [163]
  Zhang, X.; Zhou, H.; He, Z.; Zhang, H.; Zhao, H. Water Res. 2022, 220, 118642. doi: 10.1016/j.watres.2022.118642 doi: 10.1016/j.watres.2022.118642
164. [164]
  Yoon, N.; Lee, S.; Park, S.; Son, M.; Cho, K. H. Desalination 2023, 561, 116676. doi: 10.1016/j.desal.2023.116676 doi: 10.1016/j.desal.2023.116676
165. [165]
  Newhart, K. B.; Holloway, R. W.; Hering, A. S.; Cath, T. Y. Water Res. 2019, 157, 498. doi: 10.1016/j.watres.2019.03.030 doi: 10.1016/j.watres.2019.03.030
166. [166]
  Jordan, M. I.; Mitchell, T. M. Science 2015, 349 (6245), 255. doi: 10.1126/science.aaa8415 doi: 10.1126/science.aaa8415
167. [167]
  Saffarimiandoab, F.; Mattesini, R.; Fu, W.; Kuruoglu, E. E.; Zhang, X. J. Mater. Chem. A 2021, 9 (4), 2259. doi: 10.1039/D0TA09531A doi: 10.1039/D0TA09531A
168. [168]
  Saffarimiandoab, F.; Mattesini, R.; Fu, W.; Kuruoglu, E. E.; Zhang, X. Desalination 2021, 515, 115197. doi: 10.1016/j.desal.2021.115197 doi: 10.1016/j.desal.2021.115197
169. [169]
  Dykstra, J. E.; Keesman, K. J.; Biesheuvel, P. M.; van der Wal, A. Water Res. 2017, 119, 178. doi: 10.1016/j.watres.2017.04.039 doi: 10.1016/j.watres.2017.04.039
170. [170]
  Son, M.; Yoon, N.; Jeong, K.; Abass, A.; Logan, B. E.; Cho, K. H. Desalination 2021, 516, 115233. doi: 10.1016/j.desal.2021.115233 doi: 10.1016/j.desal.2021.115233
171. [171]
  Park, S.; Angeles, A. T.; Son, M.; Shim, J.; Chon, K.; Cho, K. H. Desalination 2022, 537, 115826. doi: 10.1016/j.desal.2022.115826 doi: 10.1016/j.desal.2022.115826
172. [172]
  Son, M.; Yoon, N.; Park, S.; Abbas, A.; Cho, K. H. Sci. Total Environ. 2023, 856, 159158. doi: 10.1016/j.scitotenv.2022.159158 doi: 10.1016/j.scitotenv.2022.159158
173. [173]
  Salari, K.; Zarafshan, P.; Khashehchi, M.; Pipelzadeh, E.; Chegini, G. Desalination 2022, 540, 115992. doi: 10.1016/j.desal.2022.115992 doi: 10.1016/j.desal.2022.115992
174. [174]
  Schmidhuber, J. Neural Netw. 2015, 61, 85. doi: 10.1016/j.neunet.2014.09.003 doi: 10.1016/j.neunet.2014.09.003
175. [175]
  Zhu, L.; Cui, Y.; Takami, G.; Kanokogi, H.; Matsubara, T. Control. Eng. Pract. 2020, 97, 104331. doi: 10.1016/j.conengprac.2020.104331 doi: 10.1016/j.conengprac.2020.104331
176. [176]
  Yoon, N.; Park, S.; Son, M.; Cho, K. H. Water Res. 2022, 227, 119337. doi: 10.1016/j.watres.2022.119337 doi: 10.1016/j.watres.2022.119337
177. [177]
  Ullah, Z.; Yoon, N.; Tarus, B. K.; Park, S.; Son, M. Desalination 2023, 558, 116614. doi: 10.1016/j.desal.2023.116614 doi: 10.1016/j.desal.2023.116614
178. [178]
  Zhu, Y.; Lian, B.; Wang, Y.; Miller, C.; Bales, C.; Fletcher, J.; Yao, L.; Waite, T. D. Water Res. 2022, 227, 119349. doi: 10.1016/j.watres.2022.119349 doi: 10.1016/j.watres.2022.119349
179. [179]
  Sharma, A.; Kosasih, E.; Zhang, J.; Brintrup, A.; Calinescu, A. J. Ind. Inf. Integration 2022, 30, 100383. doi: 10.1016/j.jii.2022.100383 doi: 10.1016/j.jii.2022.100383
180. [180]
  Lian, B.; Zhu, Y.; Branchaud, D.; Wang, Y.; Bales, C.; Bednarz, T.; Waite, T. D. Desalination 2022, 525, 115482. doi: 10.1016/j.desal.2021.115482 doi: 10.1016/j.desal.2021.115482
181. [181]
  Omosebi, A.; Li, Z.; Holubowitch, N.; Gao, X.; Landon, J.; Cramer, A.; Liu, K. Environ. Sci.: Water Res. Technol. 2020, 6 (2), 321. doi: 10.1039/C9EW00797K doi: 10.1039/C9EW00797K
182. [182]
  Hand, S.; Guest, J. S.; Cusick, R. D. Environ. Sci. Technol. 2019, 53 (22), 13353. doi: 10.1021/acs.est.9b04347 doi: 10.1021/acs.est.9b04347
183. [183]
  Hasseler, T. D.; Ramachandran, A.; Tarpeh, W. A.; Stadermann, M.; Santiago, J. G. Water Res. 2020, 183, 116034. doi: 10.1016/j.watres.2020.116034 doi: 10.1016/j.watres.2020.116034
184. [184]
  Kim, H.; Kim, S.; Kim, N.; Su, X.; Kim, C. Desalination 2023, 549, 116350. doi: 10.1016/j.desal.2022.116350 doi: 10.1016/j.desal.2022.116350
185. [185]
  Xu, Z.; Duan, H.; Dou, Z.; Zheng, M.; Lin, Y.; Xia, Y.; Zhao, H.; Xia, Y. npj Comput. Mater. 2023, 9 (1), 105. doi: 10.1038/s41524-023-01049-w doi: 10.1038/s41524-023-01049-w
186. [186]
  Zhang, X.; Zhang, Z.; Yao, S.; Chen, A.; Zhao, X.; Zhou, Z. npj Comput. Mater. 2018, 4 (1), 13. doi: 10.1038/s41524-018-0070-2 doi: 10.1038/s41524-018-0070-2
187. [187]
  Mundt, M.; Hong, Y.; Pliushch, I.; Ramesh, V. Neural Netw. 2023, 160, 306. doi: 10.1016/j.neunet.2023.01.014 doi: 10.1016/j.neunet.2023.01.014
1. [1]
  Jiali CHEN , Guoxiang ZHAO , Yayu YAN , Wanting XIA , Qiaohong LI , Jian ZHANG . Machine learning exploring the adsorption of electronic gases on zeolite molecular sieves. Chinese Journal of Inorganic Chemistry, 2025, 41(1): 155-164. doi: 10.11862/CJIC.20240408
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沈阳化工大学材料科学与工程学院沈阳 110142