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Time Dependent Wave Packet Study of the H-+ H2 Nonreactive Scattering H-+ H2非反应散射的时变波包研究
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12013
S. Akpinar, S. Surucu
Time dependent wave packet calculations have been performed for the H-+ H2nonreactive scattering, summed of elastic and inelastic probabilities, on the recent reported potential energy surface of the systems. The total probabilities for total angular momentum J up to 35 have been calculated to get the converged integral cross sections over collision energy range of 0.20 - 1.42 eV. Integral cross-sections and rate constants have been calculated from the wave packet transition probabilities for the initial states (υ = 0, j = 0) by means of J-shifting method and uniform J-shifting method for J > 0.
在最近报道的系统势能面上,对H-+ h2non - reactive scattering进行了时间相关的波包计算,并对弹性和非弹性概率进行了求和。计算了总角动量J≥35的总概率,得到了碰撞能量在0.20 ~ 1.42 eV范围内的收敛积分截面。从初始态(υ = 0, j = 0)的波包跃迁概率出发,采用j -移位法和j > 0的均匀j -移位法计算了积分截面和速率常数。
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引用次数: 0
Third Order Optical Nonlinearities and Spectral Characteristics of Methylene Blue 亚甲基蓝的三阶光学非线性及光谱特性
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12010
V. Sukumaran, A. Ramalingam
We have investigated third order nonlinear optical properties and spectral characteristics of methylene blue dye in both polymer and liquid mixtures. The spectral characteristics of the dye is studied by recording the absorption and fluorescence spectra of the dye doped in poly(methylmethacrylate) modified with additive n-butyl acetate(nBA) and the dye in MMA and nBA (liquid mixture). The spectral results of the dye doped polymer rod are compared with dye in liquid Mixture. The nonlinear measurements of the dye in liquid and polymer medium were performed using CW He-Ne laser of wavelength 632.8 nm by employing z-scan technique. The dye methylene blue showed a negative nonlinear refractive index.
研究了亚甲基蓝染料在聚合物和液体混合物中的三阶非线性光学性质和光谱特性。通过记录染料在添加剂乙酸正丁酯(nBA)修饰的聚甲基丙烯酸甲酯中掺杂和在MMA和nBA(液体混合物)中掺杂的吸收光谱和荧光光谱,研究了染料的光谱特性。将掺杂染料聚合物棒的光谱结果与液体混合物中的染料进行了比较。利用波长为632.8 nm的连续氦氖激光器,采用z-扫描技术对液体和聚合物介质中的染料进行了非线性测量。染料亚甲基蓝的非线性折射率为负。
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引用次数: 19
The Actual Nature of Light (Ⅰ) Reveal the Mystery about the Actual Nature of Light from Newton, Einstein to the Recent Mistakes 《光的真实本质》(Ⅰ)揭示从牛顿、爱因斯坦到最近的错误的光的真实本质的奥秘
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12008
He-Zhou Wang, He-Xiang He, Jie Feng, Xiao-Dong Chen, Wei Lin
When Newton became the President of the Royal Society, he proposed corpuscle concept (wave-particle duality) to destroy the fruitions of Hooke and Huygens, because Newton mistook Hooke and Huygens as his enemies. Thereafter, this erroneous concept governed the scientific world for more than one hundred years. This paper will reveal the mystery: why corpuscle concept could govern the scientific world for one hundred years after Newton’s death. In the beginning of last century, photon, a palingenesis of Newton’s corpuscle, was proposed by Einstein again, as a sudden whim, because Planck strongly opposed this wrong concept, since 1907, Einstein strongly doubted this concept. Finally, Einstein disappointedly said: “The quanta really are a hopeless mess.” This paper will reveal the mystery: why photon concept can govern the scientific world until now, and give the evidences for the actual nature of light.
当牛顿成为皇家学会主席时,他提出了微粒概念(波粒二象性)来破坏胡克和惠更斯的成果,因为牛顿把胡克和惠更斯误认为是他的敌人。此后,这个错误的观念统治了科学界一百多年。本文将揭示牛顿死后的一百年里,为什么微粒概念还能统治科学界的奥秘。最后,爱因斯坦失望地说:“量子确实是一团无望的乱。”本文将揭示光子概念为何能统治科学界至今的谜团,并为光的真实本质提供证据。
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引用次数: 2
Modeling of the Chemico-Physical Process of Protonation of Molecules Entailing Some Quantum Chemical Descriptors 基于量子化学描述符的分子质子化的化学物理过程建模
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12012
S. K. Rajak, N. Islam, D. C. Ghosh
Relying upon the basic tenets of scientific modeling, an ansatz for the evaluation of proton affinity of mole-cules are evolved in terms of a four component model. The components of the model chosen are global de-scriptors like ionization energies, global softness, electronegativity and electrophilicity index. These akin quantum mechanical descriptors of atoms and molecules are linked with the charge rearrangement and polarization that occur during the physico-chemical process of protonation of molecules. The suggested ansatz is invoked to compute the protonation energy of as many as 43 compounds of diverse physico-chemical nature viz, hydrocarbons, alcohols, carbonyls, carboxylic acids, esters, aliphatic amines and aromatic amines. A detailed comparative study of theoretically evaluated protonation energies of the above mentioned molecules vis-a-vis their corresponding experimental counterparts reveals that there is a close agreement between the theory and experiment. Thus the results strongly suggest that the proposed modeling and the ansatz for computing PA, the proton affinity, of molecules for studying the physico-chemical process of protonation may be valid proposition.
根据科学建模的基本原则,提出了一种基于四组分模型的分子质子亲和性评价方法。所选模型的组成部分是全局描述符,如电离能、全局柔软度、电负性和亲电性指数。这些类似于原子和分子的量子力学描述符与分子质子化的物理化学过程中发生的电荷重排和极化有关。建议的ansatz被用来计算多达43种不同物理化学性质的化合物的质子化能,即碳氢化合物、醇类、羰基、羧酸、酯类、脂肪胺和芳香胺。对上述分子的理论计算的质子化能与相应的实验分子的质子化能进行了详细的比较研究,结果表明理论与实验之间存在着密切的一致性。因此,这些结果强烈地表明,为研究质子化的物理化学过程而建立的分子质子亲和关系模型和计算方法可能是一个有效的命题。
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引用次数: 35
Revisions of the Foundations of Quantum Mechanics Suggested by Properties of Random Walk 随机游走特性对量子力学基础的修正
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12009
R. Charreton
A new theorem on random walks suggest some possible revisions of the foundations of Quantum Mechanics. This is presented below in the simplified framework of the description of the evolution of a material point in space. Grossly speaking, it is shown that the probabilities generated by normalizing the square modulus of a sum of probability amplitudes, in the setup of Quantum Mechanics, becomes asymptotically close (under the appropriate limiting conditions) to the probabilities generated by the usual causal processes of Classical Mechanics. This limiting coincidence has a series of interesting potential applications. In particular it allows us to reintroduce the concept of causality within the core of Quantum Mechanics. Moreover, it suggests, among other consequences, that gravitational interaction may not even exist. Even though the interpretations of Quantum Mechanics which follow from this mathematical result may seem to bring some unexpected innovations in the context of theoretical physics, there is an obvious necessity to study its theoretical impact on Quantum Mechanics. The first steps toward this aim are taken in the present article.
一个关于随机漫步的新定理提出了对量子力学基础的一些可能的修正。下面以空间中一个物质点的演化描述的简化框架来说明这一点。概括地说,在量子力学的设置中,通过对概率幅值和的平方模量进行归一化所产生的概率(在适当的极限条件下)与经典力学中通常的因果过程所产生的概率渐近接近。这种极限巧合有一系列有趣的潜在应用。特别是,它允许我们在量子力学的核心中重新引入因果关系的概念。此外,它还表明,引力相互作用甚至可能不存在。尽管从这一数学结果出发的量子力学解释似乎在理论物理的背景下带来了一些意想不到的创新,但研究它对量子力学的理论影响显然是必要的。本文将为实现这一目标迈出第一步。
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引用次数: 0
A New Interpretation of Quantum Mechanics 量子力学的新诠释
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12005
S. Ishikawa
The Copenhagen interpretation is the most authorized interpretation of quantum mechanics, but there are a number of ideas that are associated with the Copenhagen interpretation. It is ceratin that this fact is not necessarily desirable. Thus, we propose a new interpretation of measurement theory, which is the linguistic aspect (or, the mathematical generalization) of quantum mechanics. Although this interpretation is superficially similar to a part of so-called Copenhagen interpretation, we show that it has a merit to be applicable to both quantum and classical systems. For example, we say that Bell’s inequality is broken even in classical systems.
哥本哈根解释是量子力学中最权威的解释,但是有很多想法与哥本哈根解释有关。可以肯定的是,这一事实不一定是可取的。因此,我们提出了一种新的测量理论的解释,这是量子力学的语言方面(或数学推广)。虽然这种解释表面上类似于所谓的哥本哈根解释的一部分,但我们表明它具有适用于量子和经典系统的优点。例如,我们说贝尔不等式在经典系统中被打破。
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引用次数: 83
Adaptive Phase Matching in Grover's Algorithm Grover算法中的自适应相位匹配
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12006
Panchi Li, K. Song
When the Grover’s algorithm is applied to search an unordered database, the successful probability usually decreases with the increase of marked items. In order to solve this problem, an adaptive phase matching is proposed. With application of the new phase matching, when the fraction of marked items is greater , the successful probability is equal to 1 with at most two Grover iterations. The validity of the new phase matching is verified by a search example.
当应用Grover算法搜索无序数据库时,成功概率通常随着标记项的增加而减小。为了解决这一问题,提出了一种自适应相位匹配方法。应用新阶段匹配方法,当标记项的比例较大时,通过最多两次Grover迭代,成功概率等于1。通过搜索算例验证了新相位匹配的有效性。
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引用次数: 6
Quantum Entanglement as a Consequence of a Cantorian Micro Spacetime Geometry 量子纠缠是康托里亚微观时空几何的结果
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12007
M. Naschie
Building upon the pioneering work of J. Bell [1] and an incredible result due to L. Hardy [2] it was shown that the probability of quantum entanglement of two particles is a maximum of 9.0169945 percent [2]. This happens to be exactly the golden mean to the power of five (?5) [3-7]. Although it has gone largely unnoticed for a long time, this result was essentially established independently in a much wider context by the present author almost two decades ago [3-6]. The present work gives two fundamentally different derivations of Hardy’s beautiful result leading to precisely the same general conclusion, namely that by virtue of the zero measure of the underlying Cantorian-fractal spacetime geometry the notion of spatial separability in quantum physics is devoid of any meaning [7]. The first derivation is purely logical and uses a probability theory which combines the discrete with the continuum. The second derivation is purely geometrical and topological using the fundamental equations of a theory developed by the author and his collaborators frequently referred to as E-infinity or Cantorian spacetime theory [3-7].
在J. Bell[1]的开创性工作和L. Hardy[2]的令人难以置信的结果的基础上,证明了两个粒子的量子纠缠概率最大为9.0169945%[2]。这恰好是五(?5)次方的黄金平均数[3-7]。虽然很长一段时间以来,它在很大程度上被忽视,但这一结果基本上是在近20年前由本作者在更广泛的背景下独立建立的[3-6]。目前的工作给出了Hardy美丽结果的两个根本不同的推导,导致完全相同的一般结论,即由于底层Cantorian-fractal时空几何的零测度,量子物理学中的空间可分性概念没有任何意义[7]。第一个推导是纯逻辑的,并使用了将离散与连续相结合的概率论。第二个推导是纯几何和拓扑的,使用了作者和他的合作者开发的理论的基本方程,通常被称为e -∞或Cantorian时空理论[3-7]。
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引用次数: 71
Bound States of the Klein-Gordon for Exponential-Type Potentials in D-Dimensions d维指数型势的Klein-Gordon束缚态
Pub Date : 2011-09-29 DOI: 10.4236/jqis.2011.12011
S. Ikhdair
The approximate analytic bound state solutions of the Klein-Gordon equation with equal scalar and vector exponential-type potentials including the centrifugal potential term are obtained for any arbitrary orbital quantum number l and dimensional space D. The relativistic/non-relativistic energy spectrum formula and the corresponding un-normalized radial wave functions, expressed in terms of the Jacobi polynomials and or the generalized hypergeometric functions have been obtained. A short-cut of the Nikiforov-Uvarov (NU) method is used in the solution. A unified treatment of the Eckart, Rosen-Morse, Hulthen and Woods-Saxon potential models can be easily derived from our general solution. The present calculations are found to be identical with those ones appearing in the literature. Further, based on the PT-symmetry, the bound state solutions of the trigonometric Rosen-Morse potential can be easily obtained.
对任意轨道量子数l和维空间d,得到了含有离心势项的标量和矢量指数势相等的Klein-Gordon方程的近似解析界态解,得到了用Jacobi多项式和广义超几何函数表示的相对论性/非相对论性能谱公式和相应的非归一化径向波函数。该溶液采用Nikiforov-Uvarov (NU)法的简化方法。从我们的通解中可以很容易地推导出对Eckart、rosenmorse、Hulthen和Woods-Saxon势模型的统一处理。本文的计算结果与文献中出现的计算结果一致。此外,基于pt对称,可以很容易地得到三角罗森-莫尔斯势的束缚态解。
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引用次数: 20
A Numerical study of the flow with heat Transfer of a Pseudoplastic fluid Between Parallel Plates 平行板间假塑性流体传热的数值研究
Pub Date : 2011-06-27 DOI: 10.4236/jqis.2011.11003
S. Iqbal, A. Zeb, A. Siddiqui, T. Haroon
One dimensional flow with heat transfer of a pseudoplastic fluid between two infinite horizontal parallel plates is investigated. The thermophysical properties of the fluid are assumed to be constant and numerical solution using the finite element method, along with the corresponding exact solution for the fluid velocity and the fluid temperature is obtained. The effect of variation of the governing parameters is studied using figures and tables. It is found that the numerical solution agrees well with the corresponding exact solution and that the fluid velocity, together with the fluid temperature, increases with increasing values of the governing parameters.
研究了假塑性流体在两个无限大水平平行板间的一维传热流动。假设流体的热物性恒定,采用有限元法进行数值求解,得到流体速度和温度的精确解。用图表研究了控制参数变化的影响。结果表明,数值解与精确解吻合较好,流体速度和温度随控制参数的增大而增大。
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引用次数: 3
期刊
J. Quantum Inf. Sci.
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