Journal of the Chinese Ceramic Society, Volume. 52, Issue 7, 2350(2024)
Molecular Dynamics on Hydration Mechanism and Swelling Properties of Pennine
[1] [1] SUN L L, LING C Y, LAVIKAINEN L P, et al. Influence of layer charge and charge location on the swelling pressure of dioctahedral smectites[J]. Chem Phys, 2016, 473: 40-45.
[2] [2] ZHENG Y, ZAOUI A, SHAHROUR I. A theoretical study of swelling and shrinking of hydrated Wyoming montmorillonite[J]. Appl Clay Sci, 2011, 51(1-2): 177-181.
[3] [3] CHEN Z C, ZHAO Y L, XU X W, et al. Structure and dynamics of Cs+ in kaolinite: Insights from molecular dynamics simulations[J]. Comput Mater Sci, 2020, 171: 109256.
[4] [4] TACHI Y, YOTSUJI K, SEIDA Y, et al. Diffusion and sorption of Cs+, I- and HTO in samples of the argillaceous Wakkanai Formation from the Horonobe URL, Japan: Clay-based modeling approach[J]. Geochim Cosmochim Acta, 2011, 75(22): 6742-6759.
[5] [5] PUTNIS A. Mineral replacement reactions: From macroscopic observations to microscopic mechanisms[J]. Mineral Mag, 2002, 66(5): 689-708.
[6] [6] YANG Guodong, LI Yilian, MA Xin, et al. Earth Sci, 2014, 39(4): 462-472.
[7] [7] ZHANG Lihu. Molecular dynamics simulation on clay minerals-fluid interfaces[D]. Nanjing: Nanjing University, 2017.
[8] [8] LI Mingyang. Nanoscale water-salt permeation and wetting simulation study of clay minerals[D]. Taian: Shandong Agricultural University, 2023.
[9] [9] WANG Yuan, YANG Xin, ZHAO Jianxing, et al. Yunnan Chem Technol, 2021, 48(9): 113-117.
[10] [10] XU Jiquan. Drill Fluid Complet Fluid, 1989, 6(2): 1-3.
[11] [11] WANG Jin, ZENG Fangui, WANG JunXia. Acta Chim Sin, 2006, 64(16): 1654-1658.
[12] [12] WANG Jin, WANG Junxia, ZENG Fangui. J Chin Ceram Soc, 2009, 37(4): 554-561.
[13] [13] CHANG F R C, SKIPPER N T, SPOSITO G. Computer simulation of interlayer molecular structure in sodium montmorillonite hydrates[J]. Langmuir, 1995, 11(7): 2734-2741.
[14] [14] MARRY V, TURQ P, CARTAILLER T, et al. Microscopic simulation of structure and dynamics of water and counterions in a monohydrated montmorillonite[J]. J Chem Phys, 2002, 117(7): 3454-3463.
[15] [15] CHAI Zhaoyun, ZHANG Haiyang, YANG Pan, et al. J China Coal Soc, 2021, 46(8): 2557-2564.
[16] [16] WANG Guan, LI Guichen, SUN Yuantian, et al. Coal Sci Technol Mag, 2017(3): 16-22.
[17] [17] LI Mingyang, LIAN De, HAO Junjie, et al. Chin J Process Eng, 2020, 20(8): 959-969.
[18] [18] LI Mingyang, LIAN De, LI Hao, et al. Met Mine, 2020(6): 56-61.
[19] [19] FANG Lei, HUANG Xiaojun, XU Mingjun. Commun Stand, 2004, 32(12): 94-97.
[20] [20] GAO Guorui. Chin J Geotech Eng, 1984, 6(2): 40-48.
[21] [21] WANG Chong, WANG Qicai, ZHANG Rongling, et al. Water Resour Hydropower Eng, 2018, 49(5): 123-128.
[22] [22] WANG Chong, WANG Qicai, ZHANG Rongling, et al. J Yangtze River Sci Res Inst, 2017, 34(11): 107-111.
[23] [23] WANG Rui. Research on law of ballastless track rail heave by subgrade or foundation swelling of high speed railway[D]. Shihezi: Shihezi University, 2021.
[24] [24] WELCH M D, MARSHALL W G. High-pressure behavior of clinochlore[J]. Am Mineral, 2001, 86(11-12): 1380-1386.
[25] [25] SKIPPER N T, CHANG F R C, SPOSITO G. Monte Carlo simulation of interlayer molecular structure in swelling clay minerals. 1. methodology[J]. Clays Clay Miner, 1995, 43(3): 285-293.
[27] [27] WANG Yuepeng, LIU Xiangjun, LIANG Lixi, et al. Sci Technol Eng, 2022, 22(22): 9574-9581.
[28] [28] WANG Jin, ZENG Fangui, WANG Junxia. J Chin Ceram Soc, 2005, 33(8): 996-1001.
[29] [29] WANG Zhi, HU Qianwen, WANG Ying, et al. J Chin Ceram Soc, 2013, 41(8): 1100-1104.
[30] [30] YUAN Wangzhi, LI Wenhui, TAO Daquan. J Chin Ceram Soc, 1990, 18(1): 65-71.
[31] [31] ZHANG Yayun, CHEN Mian, DENG Ya, et al. J Chin Ceram Soc, 2018, 46(10): 1489-1498.
[32] [32] MA Baoguo, YANG Hu, TAN Hongbo, et al. J Chin Ceram Soc, 2013, 41(3): 328-333.
[33] [33] PRESTI D, PEDONE A, MANCINI G, et al. Insights into structural and dynamical features of water at halloysite interfaces probed by DFT and classical molecular dynamics simulations[J]. Phys Chem Chem Phys, 2016, 18(3): 2164-2174.
[35] [35] STEINER T, DESIRAJU G R. Distinction between the weak hydrogen bond and the van der Waals interaction[J]. Chem Commun, 1998(8): 891-892.
Get Citation
Copy Citation Text
ZHANG Rui, YU Fei, TONG Kaiwen, HUANG Kang, ZAHNG Wei, DAI Zhangjun, CHEN Shanxiong. Molecular Dynamics on Hydration Mechanism and Swelling Properties of Pennine[J]. Journal of the Chinese Ceramic Society, 2024, 52(7): 2350
Category:
Received: Jan. 8, 2024
Accepted: --
Published Online: Aug. 26, 2024
The Author Email: Zhangjun DAI (zjdai@whrsm.ac.cn)