期刊文献+

具有表面弛豫的液体自扩散的Monte Carlo模拟 被引量:2

Monte Carlo Simulation of Liquid Self-diffusion with Surface Relaxation
下载PDF
导出
摘要 研究多孔介质中液体的自扩散行为能获得介质的微观结构信息,有助于了解介质中液体的传输性质.以具有不同孔隙大小的无限长圆柱体模型中的液体为对象,采用Monte Carlo随机行走方法,模拟存在表面弛豫时液体的自扩散系数和核自旋磁化强度随时间的变化,导出将NMR弛豫参数和随机行走参数联系在一起的表达式.结果表明:在快扩散区,液体的核自旋磁化强度随弛豫时间呈单指数衰减,且自扩散系数在短时情况下独立于表面弛豫率;在慢扩散区,液体的核自旋磁化强度衰减和自扩散系数在短时情况下均与表面弛豫率无关.模拟结果与理论分析相吻合,可用于求解介质的表面积与体积之比及孔径大小等结构信息. Time-dependent self-diffusion coefficients and magnetization attenuation of liquid with surface relaxation in porous media in an infinitely long cylinder are calculated with Monte Carlo random walk method. Relationship between parameters of NMR relaxation and random walk is obtained. In fast-diffusion area, magnetization of nuclear spins attenuates exponentially, and self-diffusion coefficients are independent of surface relaxivity within short diffusion time. In slow-diffusion area, both magnetization attenuation and self-diffusion coefficients are independent of surface relaxivity within short diffusion time. These results agree well with theoretical analysis. Surface-to-volume ratio and pore size can be determined.
出处 《计算物理》 EI CSCD 北大核心 2009年第1期42-48,共7页 Chinese Journal of Computational Physics
基金 国家自然科学基金(批准号10575085和10605019) 福建省自然科学基金(项目编号2008J0028)资助项目
关键词 自扩散 表面弛豫 磁化强度衰减 MONTE CARLO模拟 self-diffusion surface relaxation magnetization attenuation Monte Carlo simulation
  • 相关文献

参考文献13

  • 1Watson A T, Chang C T P. Characterizing porous media with NMR methods [ J]. Progress in Nuclear Magnetic Resonance Spectroscopy, 1997, 31(4) : 343 - 386. 被引量:1
  • 2Song Y Q, Ryu S G, Sen P N. Determining multiple length scales in rocks [J]. Nature, 2000, 406(6792) : 178 - 181. 被引量:1
  • 3Latour L L, Mitra P P, Kleinberg R L, Sotak C H. Time-dependent diffusion coefficient of fluids in porous media as a probe of surface-to-volume ratio [J]. Journal of Magnetic Resonance Series A, 1993, 101(3): 342-346. 被引量:1
  • 4Mitra P P, Sen P N, Schwartz L M, Le Doussal P. Diffusion propagator as a probe of the structure of porous media [J]. Physical Review Letters, 1992, 68(24) : 3555 - 3558. 被引量:1
  • 5Mitra P P, Sen P N, Cchwartz L M. Short-time behavior of the diffusion coefficient as a geometrical probe of porousmedia [J]. Physical Review B, 1993, 47(14) : 8565 - 8574. 被引量:1
  • 6Cai C B, Chen Z, Cai S H, Hwang L P, Zhong J H. Finite difference simulation of diffusion behaviors under inter- and intramolecular multiple-quantum coherences in liquid NMR [J]. Chemical Physics Letters, 2005, 407(4 - 6) : 438 - 443. 被引量:1
  • 7林巧玲,蔡淑惠,陈忠,蔡聪波.核磁共振中多量子相干扩散行为的理论表述和计算机模拟(英文)[J].Chinese Journal of Chemical Physics,2004,17(2):155-160. 被引量:6
  • 8Lin G X, Chen Z, Zhong J H, Lin D H, Liao X L. A novel propagator approach for NMR signal attenuation due to anisotropic diffusion under various magnetic field gradients [J]. Chemical Physics Letters, 2001, 335(3 -4): 249 -256. 被引量:1
  • 9Brownstein K R, Tarr C E. Importance of classic diffusion in NMR studies of water in biological cells [J]. Physical Review A, 1979, 19(6) : 2446 - 2453. 被引量:1
  • 10Hidajat I, Singh M, Cooper J, Mohanty K K. Permeability of porous media from simulated NMR response [J]. Transport in Porous Media. 2002, 48(2): 225- 247. 被引量:1

二级参考文献1

共引文献5

同被引文献7

引证文献2

二级引证文献10

相关作者

内容加载中请稍等...

相关机构

内容加载中请稍等...

相关主题

内容加载中请稍等...

浏览历史

内容加载中请稍等...
;
使用帮助 返回顶部