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Silicon-Based Technology for Ligand-Receptor Molecular Identification 配体受体分子鉴定的硅基技术
Pub Date : 2012-01-11 DOI: 10.1155/2012/948390
A. Lamberti, C. Sanges, N. Migliaccio, L. Stefano, I. Rea, E. Orabona, G. Scala, I. Rendina, P. Arcari
One of the most important goals in the fields of biology and medicine is the possibility to dispose of efficient tools for the characterization of the extraordinary complexity of ligand-receptor interactions. To approach this theme, we explored the use of crystalline silicon (cSi) technology for the realization of a biotechnological device in which the ligand-receptor interactions are revealed by means of optical measurements. Here, we describe a chemical procedure for the functionalization of microwell etched on silicon wafers, and the subsequent anchoring of biological molecules like an antibody anti-A20 murine lymphoma cell line. The optical analysis of the interaction on the biochips between the bound biomolecule and their corresponding ligand indicated that the functionalized cSi is suitable for this application.
生物学和医学领域最重要的目标之一是有可能处理有效的工具来表征配体-受体相互作用的异常复杂性。为了接近这个主题,我们探索了使用晶体硅(cSi)技术来实现一种生物技术装置,其中配体与受体的相互作用通过光学测量来揭示。在这里,我们描述了一种化学过程,用于在硅片上蚀刻微孔的功能化,以及随后锚定生物分子,如抗a20小鼠淋巴瘤细胞系的抗体。结合的生物分子与相应的配体在生物芯片上相互作用的光学分析表明,功能化的cSi适合于这种应用。
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引用次数: 6
Millimeterwave Spectral Studies of Propynal (HCCCHO) Produced by DC Glow Discharge and Ab Initio DFT Calculation 直流辉光放电产生丙醛(HCCCHO)的毫米波光谱研究及从头算DFT计算
Pub Date : 2011-12-20 DOI: 10.1155/2011/439019
A. I. Jaman, Rangana Bhattacharya, Debasish Mandal, A. Das
The ground-state () millimeterwave rotational spectrum of propynal (HCCCHO) produced by a DC glow discharge through a low-pressure (~10–20 mTorr) flow of propargyl alcohol (HCCCH2OH) vapor has been observed in the frequency region: 36.0–94.0 GHz. Measured rotational transition frequencies along with the previously reported microwave and millimeterwave transitions were fitted to a standard asymmetric-top Hamiltonian to determine an improved set of rotational and centrifugal distortion constant. Detailed DFT calculations were also carried out with various functional and basis sets to evaluate the spectroscopic constants, dipole moment, and various structural parameters of propynal and compared with the corresponding experimental values.
在36.0 ~ 94.0 GHz频率范围内,研究了丙炔醇(HCCCH2OH)蒸汽在低压(~10 ~ 20 mTorr)流下直流辉光放电产生的基态()毫米波旋转光谱。测量的旋转跃迁频率与先前报道的微波和毫米波跃迁一起拟合到标准的非对称顶部哈密顿量中,以确定一组改进的旋转和离心畸变常数。利用各种泛函和基集进行了详细的DFT计算,计算了丙烯的光谱常数、偶极矩和各种结构参数,并与相应的实验值进行了比较。
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引用次数: 4
The Field Confinement, Narrow Transmission Resonances, and Green Function of a Multilayered Microsphere with Metamaterial Defects 具有超材料缺陷的多层微球的场约束、窄透射共振和格林函数
Pub Date : 2011-10-24 DOI: 10.1155/2011/217020
G. Burlak, A. Díaz-de-Anda
We numerically investigate the optical transmission through a compound spherical stack withconventional and metamaterial (MM) layers and also embedded MM defect. A formation of extremely narrow resonant peak with nearly complete transmittance in area of a band gap is found.We demonstrate that photon fields of certain frequencies can be strongly confined by a left-handed(LH) defect. The influence of a random deviation in the width of compound spherical layers aswell the transit to the whispering gallery mode (WGM) is also discussed.
我们数值研究了具有常规层和超材料层(MM)以及嵌入MM缺陷的复合球面堆叠的光传输。在带隙区域内形成了一个极窄的谐振峰,透射率几乎完全。我们证明了某些频率的光子场可以被左旋(LH)缺陷强烈限制。本文还讨论了复合球层宽度随机偏差的影响以及过渡到耳语通道模式(WGM)。
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引用次数: 3
Comparison of the Calculated Collision-Induced Absorption Spectra by Dense Hydrogen-Helium, Deuterium-Helium, and Tritium-Helium Gas Mixtures 稠密氢氦、氘氦和氚氦混合气体碰撞诱导吸收光谱的比较
Pub Date : 2011-10-11 DOI: 10.1155/2011/470530
M. Abel, L. Frommhold, Xiaoping Li, Katherine L.C. Hunt
We have recently determined the induced dipole surface (IDS) and potential energy surface (PES) of collisional H2-He complexes. We have used these surfaces to compute the binary collision-induced absorption spectra of H2 molecules interacting with He atoms and of D2 molecules interacting with He atoms. Here we extend these calculations to the case of T2 molecules interacting with He atoms. Whereas the electronic structure of X2-He is virtually the same for all hydrogen isotopes X = H, D, or T, the collisional dynamics and molecular scattering wave functions are different for the different collisional pairs. We have calculated spectra up to a temperature of 9000 K and frequencies up to 20,000 cm−1. Here we compare the calculated collision-induced absorption spectra for the different hydrogen isotopes. While we have observed reasonable agreement between our calculations and laboratory measurements for the collisional H2-He and D2-He complexes, there are no laboratory measurements for T2-He collisional complexes, and one must rely on the fundamental theory, supported by the agreement between theory and experiment for the other isotopes.
我们最近确定了碰撞H2-He配合物的诱导偶极子表面(IDS)和势能表面(PES)。我们利用这些表面计算了H2分子与He原子相互作用和D2分子与He原子相互作用的二元碰撞诱导吸收光谱。这里我们将这些计算扩展到T2分子与He原子相互作用的情况。虽然所有氢同位素X = H, D或T的X2-He的电子结构几乎相同,但不同碰撞对的碰撞动力学和分子散射波函数是不同的。我们已经计算了光谱高达9000 K的温度和频率高达20000 cm−1。本文比较了不同氢同位素碰撞诱导吸收光谱的计算结果。虽然我们观察到我们对H2-He和D2-He碰撞配合物的计算和实验室测量之间有合理的一致性,但没有对T2-He碰撞配合物的实验室测量,必须依靠基本理论,并得到其他同位素理论和实验之间一致性的支持。
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引用次数: 5
Millimeter-Wave Rotational Spectrum, Barrier to Internal Rotation, and DFT Calculation of o-Tolunitrile 邻苯甲腈的毫米波旋转光谱、内旋势垒和DFT计算
Pub Date : 2011-07-26 DOI: 10.1155/2011/480396
A. I. Jaman, P. H. Kumar, P. Bangal
The millimeter-wave rotational spectra of o-tolunitrile (C6H4CH3CN) have been investigated in the ground torsional state in the frequency range 50.0–75.0 GHz. Many high-J rotational lines with large A-E splitting due to internal rotation of the methyl top have been assigned. A least squares analysis of the A-E splitting of 92 transitions resulted in the determination of accurate values of internal rotation parameters. The observed parameters were compared with the previously reported experimental values and DFT calculation results.
在50.0 ~ 75.0 GHz频率范围内,研究了邻甲苯腈(C6H4CH3CN)在地面扭转状态下的毫米波旋转光谱。许多高j旋转谱线由于甲基顶的内旋引起了大的A-E分裂。对92个跃迁的A- e分裂进行最小二乘分析,确定了内部旋转参数的精确值。将观测到的参数与先前报道的实验值和DFT计算结果进行了比较。
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引用次数: 3
Polarization Holography in 3-Indoly-Benzylfulgimide/PMMA Film 3-吲哚苯基富尔胺/PMMA薄膜的偏振全息
Pub Date : 2011-05-23 DOI: 10.1155/2011/509507
Neimule Menke, Baoli Yao, Yingli Wang, Yi Chen
The photochromic and photoanisotropic properties of materials can be used in ordinary and polarization holographic recording respectively. Fulgides are well known as thermally irreversible organic photochromic compounds. And it is found that there exists photoinduced anisotropy in fulgide-doped polymeric films. In this report, a 3-indoly-benzylfulgimide/PMMA film was studied as a holographic storage media. First, the spectra and dynamics of photochromic and photoanisotropic properties of the sample are measured or calculated. Second, the diffraction efficiency (DE) dynamics at 633 nm of four kinds of different polarization holograms recorded in this sample are measured. The maximum DE value about 1% was gotten. Third, the DE spectra and DE dynamics are theoretically calculated in detail, and a good correlation of theoretically derived DE dynamic curves and the measured experimental curves was found. From the DE spectra, it is known that at the wavelengths less than 450 nm or greater than 700 nm, the nondestructive reading can be realized. The DWPS obtained in the experiments are same with the theortically deduced ones, which shows that in the orthogonal polarization holography, the polarization state of the diffracted light is orthogonal to that of the reconstruction light, which is very important to increase the SNR of the holographic storage. And all these results are applied and proved to be correct in high-density holographic image storage experiment. The area density of bits/cm2 was obtained, and the encoded data was retrieved without error.
材料的光致变色和光各向异性特性可分别用于普通全息记录和偏振全息记录。Fulgides是众所周知的热不可逆有机光致变色化合物。结果表明,掺氟化镓聚合物薄膜存在光致各向异性。本文研究了一种3-吲哚苯基富尔胺/PMMA薄膜作为全息存储介质。首先,测量或计算样品的光致变色和光各向异性的光谱和动力学特性。其次,测量了该样品所记录的4种不同偏振全息图在633 nm处的衍射效率动态。最大DE值约为1%。第三,对DE谱和DE动力学进行了详细的理论计算,发现理论推导的DE动力学曲线与实测实验曲线具有良好的相关性。从DE光谱可知,在波长小于450 nm或大于700 nm时,可以实现无损读取。实验得到的DWPS与理论推导的DWPS一致,说明在正交偏振全息中,衍射光的偏振态与重构光的偏振态是正交的,这对提高全息存储的信噪比是非常重要的。并将这些结果应用于高密度全息图像存储实验,证明了这些结果是正确的。得到了比特/平方厘米的面积密度,并准确地检索了编码后的数据。
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引用次数: 4
Spectral Line Broadening in Dense Plasmas 密集等离子体中的谱线展宽
Pub Date : 2011-05-03 DOI: 10.1155/2011/850807
B. Omar
Spectral line broadening is calculated based on a microscopic quantum statistical approach. By using thermodynamic Green's function, plasma correlation effect, electrostatic and dynamic screening, and perturber-radiator interaction are taken into account. Ions are treated in quasistatic approximation due to Stark effect. The line broadening for 6678 A (21P-31D) and 5016 A (21S-31P) transitions of neutral helium is calculated in the electron density range and temperature range , and the density and temperature dependence of the line width are investigated. A good agreement is shown by comparing the calculated values with the existing experimental and theoretical data.
光谱线展宽是基于微观量子统计方法计算的。利用热力学格林函数,考虑了等离子体相关效应、静电和动态筛选以及摄动器-辐射体相互作用。由于斯塔克效应,离子采用准静态近似处理。计算了中性氦的6678 A (21P-31D)和5016 A (21S-31P)跃迁在电子密度和温度范围内的谱线展宽,并研究了谱线宽度与密度和温度的关系。将计算值与已有的实验和理论数据进行了比较,结果表明两者吻合较好。
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引用次数: 4
An Introduction to Continuum Distorted Wave Theory 连续介质畸变波理论导论
Pub Date : 2010-07-13 DOI: 10.1155/2010/604572
D. Crothers
The author gives an introduction to Continuum Distorted Wave theory, in the form of a brief review.
作者以简要回顾的形式介绍了连续体畸变波理论。
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引用次数: 2
A Complete Postversion of the Three-Body Continuum Distorted Wave-Eikonal Initial State Approximation for Single Ionization of Multielectron Atoms 多电子原子单电离的三体连续体畸变波-斜向初始态近似的完全后置
Pub Date : 2010-05-19 DOI: 10.1155/2010/128473
J. Monti, O. Fojón, J. Hanssen, R. Rivarola
Single electron ionization of helium targets produced by the impact offast proton beams is investigated. The postversion of the continuum distorted wave-eikonalinitial state into a three-body approximation is reformulated, including thedynamic screening produced by the nonionized electron. This dynamic screening isshown to play a main role in the determination of double differential cross-sections. Agood agreement is found with predictions obtained employing the prior version of themodel, so that post-prior discrepancies are almost eliminated.
研究了快速质子束撞击氦靶产生的单电子电离。将连续体畸变波初始态的后置形式重新表述为三体近似,包括非电离电子产生的动态筛选。这种动态筛选在确定双微分截面中起主要作用。与使用模型的先前版本获得的预测结果很好地一致,因此几乎消除了后先验差异。
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引用次数: 6
Effective Potential for Ultracold Atoms at the Zero Crossing of a Feshbach Resonance 费什巴赫共振零交叉处超冷原子的有效势
Pub Date : 2009-09-07 DOI: 10.1155/2012/241051
N. Zinner
We consider finite-range effects when the scattering length goes to zero near a magnetically controlled Feshbach resonance. The traditional effective-range expansion is badly behaved at this point, and we therefore introduce an effective potential that reproduces the full T-matrix. To lowest order the effective potential goes as momentum squared times a factor that is well defined as the scattering length goes to zero. The potential turns out to be proportional to the background scattering length squared times the background effective range for the resonance. We proceed to estimate the applicability and relative importance of this potential for Bose-Einstein condensates and for two-component Fermi gases where the attractive nature of the effective potential can lead to collapse above a critical particle number or induce instability toward pairing and superfluidity. For broad Feshbach resonances the higher order effect is completely negligible. However, for narrow resonances in tightly confined samples signatures might be experimentally accessible. This could be relevant for suboptical wavelength microstructured traps at the interface of cold atoms and solid-state surfaces.
我们考虑了当散射长度趋近于零时的有限范围效应。传统的有效范围展开在这一点上表现很差,因此我们引入了一个再现完整t矩阵的有效势。最低阶的有效势等于动量的平方乘以一个因子,这个因子在散射长度趋于零时被很好地定义。电势与背景散射长度的平方乘以背景谐振有效范围成正比。我们继续估计该势对玻色-爱因斯坦凝聚体和双组分费米气体的适用性和相对重要性,其中有效势的吸引性质可能导致超过临界粒子数的坍缩或诱导对和超流体的不稳定性。对于宽费什巴赫共振,高阶效应完全可以忽略不计。然而,对于窄共振在严格限制的样品签名可能是实验可获得的。这可能与冷原子和固体表面界面的亚光学波长微结构陷阱有关。
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引用次数: 4
期刊
原子与分子物理学报
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