Percolation theory approach to transport phenomena in porous media

The percolation theory approach to static and dynamic properties of the single- and two-phase fluid flow in porous media is described. Using percolation cluster scaling laws, one can obtain functional relations between the saturation fraction of a given phase and the capillary pressure, the relative permeability, and the dispersion coefficient, in drainage and imbibition processes. In addition, the scale dependency of the transport coefficient is shown to be an outcome of the fractal nature of pore space and of the random flow pattern of the fluids or contaminant.     

REMARK ON STABILITY OF ISHIKAWA ITERATIVE PROCEDURES

1　ＩｎｔｒｏｄｕｃｔｉｏｎａｎｄＰｒｅｌｉｍｉｎａｒｉｅｓＳｕｐｐｏｓｅＥｉｓａｒｅａｌＢａｎａｃｈｓｐａｃｅａｎｄＴｉｓａｓｅｌｆｍａｐｏｆＥ .Ｓｕｐｐｏｓｅｘ0 ∈Ｅａｎｄｘｎ+1=ｆ(Ｔ ,ｘｎ)ｄｅｆｉｎｅｓａｎｉｔｅｒａｔｉｏｎｐｒｏｃｅｄｕｒｅｗｈｉｃｈｙｉｅｌｄｓａｓｅｑｕｅｎｃｅｏｆｐｏｉｎｔｓ ｘｎ ∞ｎ=0 ｉｎＥ .Ｆｏｒａｎｅｘａｍｐｌｅ ,ｔｈｅｆｕｎｃｔｉｏｎｉｔｅｒａｔｉｏｎｘｎ+1=ｆ(Ｔ ,ｘｎ) =Ｔｘ0 .ＳｕｐｐｏｓｅＦ(Ｔ) =ｘ∈Ｅ :Ｔｘ=ｘ ≠ ａｎｄｔｈａｔ ｘｎ ｃｏｎｖｅｒｇｅｓｓ…     

层状饱和土Biot固结问题状态空间法

针对饱和多孔介质空间非轴对Biot固结问题，引入状态变量，构造了两组相比独立的状态变量方程，利用Fourier级数和Laplace-Hankel变换，将状态变量方程转换为两组一阶常微分方程组，提出了均质饱和多孔介质空间非轴对称Biot固结问题的传递矩阵，得到以状态变量和传递矩阵乘积的形式表示的均质饱和多孔介质空间非轴对称Biot固结问题的解，利用层间完全接触的条件，可得到N层饱和多孔介质空间非轴对称Biot固结问题的一般解析表达式，文中考虑几种不同的边界条件，分析了两个算例，数值结果表明该方法具有较高的计算精度和良好的计算稳定性。     

高速荷载下多孔饱和地基的动力响应

研究高速荷载作用下梁与多孔饱和半空间的动力响应。由Fourier变换求解多孔饱和固体的动力基本方程，根据梁与半空间的接触条件得出多孔饱和半空间上梁的垂直位移的表达式。文中的数值算例考虑了荷载移动速度对梁的动力位移的影响，并与相应的弹性半空间问题作了对比。从算例中可以发现荷载移动速度对动力位移有很大的影响，当移动速度与半空间的表面波速相近时，地面会当产生很大的振动，同时还发现当速度大于介质的剪切波速时，多孔饱和半空间上梁的动力响应与弹性半空间上梁的动力响应有很大的差别。     

THE LIE SYMMETRIES AND CONSERVED QUANTITIES OF VARIABLE-MASS NONHOLONOMIC SYSTEM OF NON-CHETAEV''''S TYPE IN PHASE SPACE

ＩｎｔｒｏｄｕｃｔｉｏｎＴｈｅｓｔｕｄｙｏｆｓｙｍｍｅｔｒｙａｎｄｃｏｎｓｅｒｖｅｄｑｕａｎｔｉｔｙｏｆｍｅｃｈａｎｉｃａｌｓｙｓｔｅｍｉｓａｎｉｍｐｏｒｔａｎｔｔｏｐｉｃｉｎｍａｔｈｅｍａｔｉｃｓ,ｍｅｃｈａｎｉｃｓａｎｄｐｈｙｓｉｃｓ .ＴｈｅｍｏｄｅｒｎｔｈｅｏｒｉｅｓｏｆｓｙｍｍｅｔｒｙａｎｄｃｏｎｓｅｒｖｅｄｑｕａｎｔｉｔｙｏｆｍｅｃｈａｎｉｃａｌｓｙｓｔｅｍｉｎｃｌｕｄｅＮｏｅｔｈｅｒｓｙｍｍｅｔｒｙｔｈｅｏｒｙａｎｄＬｉｅｓｙｍｍｅｔｒｙｔｈｅｏｒｙ .Ｉｎ 1979Ｍ .Ｌｕｔｚｋｙａｎｄｏ…     

SCATTERING OF CIRCULAR CAVITY IN RIGHT-ANGLE PLANAR SPACE TO STEADY SH-WAVE

Complex function method and multi-polar coordinate transformation technology are used here to study scattering of circular cavity in right-angle planar space to SH-wave with out-of-plane loading on the horizontal straight boundary. At first, Green function of right-angle planar space which has no circular cavity is constructed; then the scattering solution which satisfies the free stress conditions of the two right-angle boundaries with the circular cavity existing in the space is formulated. Therefore, the total displacement field can be constructed using overlapping principle. An infinite algebraic equations of unknown coefficients existing in the scattering solution field can be gained using multi-polar coordinate and the free stress condition at the boundary of the circular cavity. It can be solved by using limit items in the infinite series which can give a high computation precision. An example is given to illustrate the variations of the tangential stress at the boundary of the circular cavity due to different dimensionless wave numbers, the location of the circular cavity, the loading center and the distributing range of the out-of-plane loading. The results show the efficiency and effectiveness of the method introduced here.     

Batch tautomer generation with MolTPC

Besides all their conformational degrees of freedom, drug‐like molecules and natural products often also undergo tautomeric interconversions. Compared to the huge efforts made in experimental investigation of tautomerism, open and free algorithmic solutions for prototropic tautomer generation are surprisingly rare. The few freely available software packages limit their output to a subset of the possible configurational space by sometimes unwanted prior assumptions and complete neglection of ring‐chain tautomerism. Here, we describe an adjustable fully automatic tautomer enumeration approach, which is freely available and also incorporates the detection of ring‐chain variants. The algorithm is implemented in the MolTPC framework and accessible on SourceForge. © 2013 Wiley Periodicals, Inc.     

量子体系的相空间规范变换

外尔于1918年引入的规范变换实际上是相位变换而非真正的尺度变换,但规范不变性、规范理论等概念都沿袭了下来。我们发现,针对由量子化条件[x,p]=ih而来的量子体系之本征值问题存在规范变换,或者说尺度变换,x→x/α,p→αp,该变换保体系的能量谱不变。量子谐振子、氢原子问题及一类多体问题的精确解析解证实了这一点。量子化条件[x,p]=ih看来是个对量子力学很强的约束,不止于能量的量子化。这个规范变换提醒我们相空间的体积及其量子化才是物理的关键,这也是量子力学和统计物理在潜意识里一直沿用却未予关注的思路。有趣的是,从量子谐振子体系的相空间表述似乎不能导向这个结论。如同规范理论所断言的电磁学量在给定坐标系下的数值表征与标度无关,我们认为量子体系的物理量,如能量谱等,在给定坐标系下的数值表征亦应与标度无关。此尺度变换与德布罗意关系相恰。