The design and evaluation of a smart polymer-based fluids transport inhibitor

被引:22
作者
Zhou, Yang [1 ,2 ]
Cai, Jingshun [2 ]
Chen, Ruixing [1 ,2 ]
Hou, Dongshuai [3 ]
Xu, Jun [1 ,4 ]
Lv, Kai [1 ]
Zheng, Qi [1 ,5 ]
机构
[1] Southeast Univ, Sch Mat Sci & Engn, Nanjing 211189, Peoples R China
[2] Jiangsu Res Inst Bldg Sci Co, State Key Lab High Performance Civil Engn Mat, Nanjing 211103, Peoples R China
[3] Qingdao Technol Univ, Sch Civil Engn, Qingdao 266033, Peoples R China
[4] Jiangsu Univ Sci & Technol, Coll Civil Engn & Architecture, Zhenjiang 212003, Jiangsu, Peoples R China
[5] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA
基金
中国国家自然科学基金;
关键词
Smart polymer; Nano-channel; Chloride transport; Cement-based materials; Molecular dynamics; CALCIUM-SILICATE-HYDRATE; MOLECULAR-DYNAMICS; FORCE-FIELDS; MECHANICAL-PROPERTIES; IONIC TRANSPORT; NANOCHANNELS; ADSORPTION; HYDROXIDE; BINDING;
D O I
10.1016/j.jclepro.2020.120528
中图分类号
X [环境科学、安全科学];
学科分类号
08 ; 0830 ;
摘要
The chloride transport through gel pores of cementitious matrixes determines the durability and sustainability of concrete, the most widely applied construction materials. In this work, a smart polymer is designed by molecular dynamics, which can effectively inhibit the transport of fluids throughout the nano-channels of calcium silicate hydrate (C-S-H). This polymer chain owns a high-polarity carboxyl group at one end, which can adsorb stably on the C-S-H surface by forming high-strength interfacial connections, while the rest parts are all hydrophobic alkyl groups. The polymer chain acts like a unilateral gate, which is open (lie on the matrix surface) when located in the dry nano-pore of CeSeH. Nevertheless, it can be closed rapidly (stand upright, vertical to the matrix), utilizing the hydrophobic groups to maximize the inhibiting effect once upon contact with the advancing fluids. Furthermore, a novel polymer-based nano-material is fabricated in the light of this philosophy, and the performance evaluation experiments are implemented. The results prove this material substantially decreases the water adsorption amount and chloride migration rate of the cement-based materials. (C) 2020 Elsevier Ltd. All rights reserved.
引用
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页数:12
相关论文
共 51 条
  • [1] Composition and density of nanoscale calcium-silicate-hydrate in cement
    Allen, Andrew J.
    Thomas, Jeffrey J.
    Jennings, Hamlin M.
    [J]. NATURE MATERIALS, 2007, 6 (04) : 311 - 316
  • [2] American Association of State Highway and Transportation Officials, STAND METH TEST RES
  • [3] Ann K.Y., 2007, CORROS SCI, DOI [10.1016/j.corsci.2007.05.007, DOI 10.1016/J.CORSCI.2007.05.007.]
  • [4] [Anonymous], 1983, 1881122 BS
  • [5] [Anonymous], 2007, LAMMPS LARGE SCALE A
  • [6] THE USE OF CVFF AND CFF91 FORCE-FIELDS IN CONFORMATIONAL-ANALYSIS OF CARBOHYDRATE MOLECULES - COMPARISON WITH AMBER MOLECULAR MECHANICS AND DYNAMICS CALCULATIONS FOR METHYL ALPHA-LACTOSIDE
    ASENSIO, JL
    MARTINPASTOR, M
    JIMENEZBARBERO, J
    [J]. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 1995, 17 (3-4) : 137 - 148
  • [7] BRACKE M, 1989, PROG COLL POL SCI S, V79, P142
  • [8] mTOR Regulates Lysosomal ATP-Sensitive Two-Pore Na+ Channels to Adapt to Metabolic State
    Cang, Chunlei
    Zhou, Yandong
    Navarro, Betsy
    Seo, Young-jun
    Aranda, Kimberly
    Shi, Lucy
    Battaglia-Hsu, Shyuefang
    Nissim, Itzhak
    Clapham, David E.
    Ren, Dejian
    [J]. CELL, 2013, 152 (04) : 778 - 790
  • [9] Molecular models and simulations of layered materials
    Cygan, Randall T.
    Greathouse, Jeffery A.
    Heinz, Hendrik
    Kalinichev, Andrey G.
    [J]. JOURNAL OF MATERIALS CHEMISTRY, 2009, 19 (17) : 2470 - 2481
  • [10] Molecular models of hydroxide, oxyhydroxide, and clay phases and the development of a general force field
    Cygan, RT
    Liang, JJ
    Kalinichev, AG
    [J]. JOURNAL OF PHYSICAL CHEMISTRY B, 2004, 108 (04) : 1255 - 1266