Transport property of hydrogen sulfide in amorphous polyethylene using grand canonical Monte Carlo and molecular dynamics simulations

被引:0
|
作者
Huang, Hao [1 ]
Liu, Bing [1 ]
Zheng, Dukui [1 ]
Xin, Fubin [1 ]
Shi, Xian [2 ]
机构
[1] College of Petroleum Engineering, Yangtze University, Wuhan,430100, China
[2] College of Petroleum Engineering, China University of Petroleum (East China), Qingdao,266580, China
关键词
34;
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
相关论文
共 50 条
  • [21] Spatially adaptive grand canonical ensemble Monte Carlo simulations
    Chatterjee, A
    Katsoulakis, MA
    Vlachos, DG
    PHYSICAL REVIEW E, 2005, 71 (02):
  • [22] Grand canonical Monte Carlo simulations of water in protein environments
    Woo, HJ
    Dinner, AR
    Roux, B
    JOURNAL OF CHEMICAL PHYSICS, 2004, 121 (13): : 6392 - 6400
  • [23] Sequential updating algorithms for grand canonical Monte Carlo simulations
    Ren, Ruichao
    O'Keeffe, C. J.
    Orkoulas, G.
    MOLECULAR PHYSICS, 2007, 105 (2-3) : 231 - 238
  • [24] Grand canonical Monte Carlo simulations of equilibrium polymers and networks
    Kindt, JT
    MESOSCALE PHENOMENA IN FLUID SYSTEMS, 2003, 861 : 298 - 312
  • [25] Grand canonical Monte Carlo simulations of elastic membranes with fluidity
    Koibuchi, H
    Kusano, N
    Nidaira, A
    Suzuki, K
    Yamada, M
    PHYSICS LETTERS A, 2003, 319 (1-2) : 44 - 52
  • [26] Atomistic Adsorption of Oxygen and Hydrogen on Platinum Catalysts by Hybrid Grand Canonical Monte Carlo/Reactive Molecular Dynamics
    Gai, Lili
    Shin, Yun Kyung
    Raju, Muralikrishna
    van Duin, Adri C. T.
    Raman, Sumathy
    JOURNAL OF PHYSICAL CHEMISTRY C, 2016, 120 (18): : 9780 - 9793
  • [27] Delineating ion modulated conformational changes in ribosomal RNA using grand-canonical Monte-Carlo/molecular dynamics simulations
    Lakkaraju, Sirish
    Lemkul, Justin
    Mackerell, Alexander
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 252
  • [28] Adsorption and separation of hydrogen isotopes in carbon nanotubes: Multicomponent grand canonical Monte Carlo simulations
    Challa, SR
    Sholl, DS
    Johnson, JK
    JOURNAL OF CHEMICAL PHYSICS, 2002, 116 (02): : 814 - 824
  • [29] Adsorption and Diffusion Properties of Gas in Nanopores of Kerogen: Insights from Grand Canonical Monte Carlo and Molecular Dynamics Simulations
    Xiao, Shouheng
    Liu, Xiugang
    Li, Yun
    Zheng, Qiang
    Wang, Ning
    Qiao, Yun
    Zhang, Youyin
    Yi, Chuanjun
    PROCESSES, 2024, 12 (07)
  • [30] A comparative study by the grand canonical Monte Carlo and molecular dynamics simulations on the squeezing behavior of nanometers confined liquid films
    Leng, Yongsheng
    Xiang, Yuan
    Lei, Yajie
    Rao, Qi
    JOURNAL OF CHEMICAL PHYSICS, 2013, 139 (07):