• 제목/요약/키워드: long range interaction

검색결과 96건 처리시간 0.027초

브라운 동력학 시뮬레이션에 의한 미세기공에서 단일한 다가전해질 사슬의 제한확산 연구 (Study on Hindered Diffusion of Single Polyelectrolyte Chain in Micro-Pores by Employing Brownian Dynamics Simulations)

  • 전명석;곽현욱
    • 멤브레인
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    • 제12권4호
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    • pp.207-215
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    • 2002
  • 한정된 미세공간에서의 제한확산(hindered diffusion)은 멤브레인 기공(pore)에서 입자들의 운동에 의해 결정되는 여과 메카니즘을 매우 미세한 수준에서 이해하는데 중요한 현상이다. 구형(spherical) 콜로이드 입자에 비해 보다 복잡한 형태(conformation)인 고분자사슬 구조를 갖는 다가전해질(polyelectrolyte)의 제한확산 거동에는 다양한 인자들이 관련되어 있기 때문에, 이론 접근은 물론 실험적 접근도 한층 어려운 것이 사실이다. 본 연구에서는, 슬릿형 미세기공에 한정되어 있는 단일한 다가전해질(single polyelectrolyte)에 coarse-grained bead spring model과 먼거리(long-range) 정전상호작용(electrostatic interaction)인 Debye-Huckel potential을 적용하여 분자시뮬레이션 기법인 브라운 동력학 모사를 수행하였다. 기공과 다가전해질 사슬(Polyelectrolyte chain)의 주어진 크기에서, 용액의 전해질 이온농도가 감소함에 따른 사슬의 신장(extension)효과는 제한확산계수를 감소시켰고, 기공 벽면의 하전성은 제한확산계수를 더욱 감소시켰다. 이는, 다가전해질 사슬(polyelectrolyte chain)의 입체적 장애(steric hindrance)와 함께 정전반발력이 미세기공에서의 확산이동을 억제함을 의미한다.

Invention of Ultralow - n SiO2 Thin Films

  • Dung, Mai Xuan;Lee, June-Key;Soun, Woo-Sik;Jeong, Hyun-Dam
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2010년도 제39회 하계학술대회 초록집
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    • pp.281-281
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    • 2010
  • Very low refractive index (<1.4) materials have been proved to be the key factor improving the performance of various optical components, such as reflectors, filters, photonic crystals, LEDs, and solar cell. Highly porous SiO2 are logically designed for ultralow refractive index materials because of the direct relation between porosity and index of refraction. Among them, ordered macroporous SiO2 is of potential material since their theoretically low refractive index ~1.10. However, in the conventional synthesis of ordered macroporous SiO2, the time required for the crystallization of organic nanoparticles, such as polystyrene (PS), from colloidal solution into well ordered template is typical long (several days for 1 cm substrate) due to the low interaction between particles and particle - substrate. In this study, polystyrene - polyacrylic acid (PS-AA) nanoparticles synthesized by miniemulsion polymerization method have hydrophilic polyacrylic acid tails on the surface of particles which increase the interaction between particle and with substrate giving rise to the formation of PS-AA film by simply spin - coating method. Less ordered with controlled thickness films of PS-AA on silicon wafer were successfully fabricated by changing the spinning speed or concentration of colloidal solution, as confirmed by FE-SEM. Based on these template films, a series of macroporous SiO2 films whose thicknesses varied from 300nm to ~1000nm were fabricated either by conventional sol - gel infiltration or gas phase deposition followed by thermal removal of organic template. Formations of SiO2 films consist of interconnected air balls with size ~100 nm were confirmed by FE-SEM and TEM. These highly porous SiO2 show very low refractive indices (<1.18) over a wide range of wavelength (from 200 to 1000nm) as shown by SE measurement. Refraction indices of SiO2 films at 633nm reported here are of ~1.10 which, to our best knowledge, are among the lowest values having been announced.

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Magnetic Semiconductors Thin Films-Unidirectional Anisotropy

  • Lubecka, M.;Maksymowicz, L.J.;Szymczak, R.;Powroznik, W.
    • Journal of Magnetics
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    • 제4권1호
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    • pp.33-37
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    • 1999
  • Unidirectional magnetic anisotropy field ($H_an$) was investigated for thin films of $CdCr{2-2x}In_{2X}Se_4 (0$\leq$x$\leq$0.2). This anisotropy originates from the microscopic anisotropic Dzyaloshinskii-Moriya (DM) interaction which arise from the spin-orbit scattering of the conduction electrons by the nonmagnetic impurities. This interaction maintains the remanent magnetization in the direction of the initial applied field. Then the single easy direction of the magnetization is parallel to the direction of the magnetic field. The anisotropy produced by field cooling is unidirectional I.e. the spins system deeps some memory of the cooling field direction. The chalcogenide spinel of$ CdCr_{2-2x}In){2X}Se_4$belongs to the class of the magnetic semiconductors. The magnetic disordered state is obtained when ferromagnetic structure is diluted by In. Then we have the mixed phase characterised by coexistence the magnetic long range ordering (IFN-infinite ferromagnetic network) and the spin glass order (Fc-finite clusters). The total magnetic anisotropy energy depends on the state of magnetic ordering. In our study we concentrated on the magnetic state with reentrant transition and spin glass state. The polycrystalline $ CdCr_{2-2x}In){2X}Se_4$ thin films were obtained by rf sputtering technique. We applied the ferromagnetic resonance (FMR) and M-H loop techniques for determining the temperature composition dependencies of Han. From the experimental data, we have found that Han decreases almost linearly when temperature is increased and in the low temperature is about three times bigger at SG state with comparison to the state with REE.

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Effect of Asp193 on Proton Affinity of the Schiff Base in pharaonis phoborhodopsin

  • Iwamoto, Masayuki;Furutani, Yuji;Sudo, Yuki;Shimono, Kazumi;Kandori, Hideki;Kamo, Naoki
    • Journal of Photoscience
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    • 제9권2호
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    • pp.305-307
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    • 2002
  • Spectroscopic titration of D 193N and D 193E mutants of pharaonis phoborhodopsin (ppR) were performed to evaluate the pK$_{a}$ of the Schiff base Asp 193 corresponds to Glu204 of bacteriorhodopsin (bR). The pK$_{a}$ of the Schiff base (SBH$^{+}$) of D193N was 10.1~10.0 (at XH$^{+}$) and 11.4~11.6 (at X) depending on the protonation state of a certain residue (designated by X) and independent on CI$^{[-10]}$ , while those of the wild-type and D193E were> 12. pK$_{a}$ of XH$^{+}$ were; 11.8~11.2 at the state of SB, 10.5 at SBH$^{+}$ state in the presence of CI$^{[-10]}$ , and 9.6 at SBH$^{+}$ without CI$^{[-10]}$ These imply the presence of a long-range interaction in the extracellular channel.r channel.

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A research on optimum designs of steel frames including soil effects or semi rigid supports using Jaya algorithm

  • Artar, Musa;Daloglu, Ayse T.
    • Structural Engineering and Mechanics
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    • 제73권2호
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    • pp.153-165
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    • 2020
  • The effect of soil foundation plays active role in optimum design of steel space frames when included. However, its influence on design can be calculated after a long iterative procedure. So it requires longer computer time and more computational effort if it is done properly. The main purpose of this study is to investigate how these effects can be calculated in more practical way in a shorter time. The effects of semi-rigid column bases are taken into account in optimum design of steel space frames. This study is carried out by using JAYA algorithm which is a novel and practical method based on a single revision equation. The displacement, stress and geometric size constraints are considered in the optimum design. A computer program is coded in MATLAB to achieve corporation with SAP2000-OAPI (Open Application Programming Interface) for optimum solutions. Four different steel space frames including soil structure interaction taken from literature are investigated according to different semi-rigidly supported models depending on different rotational stiffness values. And the results obtained from analyses are compared with the results available in reference studies. The results of the study show that semi-rigidly supported systems in the range of appropriate rotational stiffness values offer practical solutions in a very short time. And close agreement is obtained with the studies on optimum design of steel space frames including soil effect underneath.

차분격자볼츠만법에 의한 저Mach수 영역 edge tone의 유체해석 (Fluid analysis of edge Tones at low Mach number using the finite difference lattice Boltzmann method)

  • 강호근;김정환;김유택;이영호
    • 한국전산유체공학회:학술대회논문집
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    • 한국전산유체공학회 2004년도 춘계 학술대회논문집
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    • pp.113-118
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    • 2004
  • This paper presents a two-dimensional edge tone to predict the frequency characteristics of the discrete oscillations of a jet-edge feedback cycle by the finite difference lattice Boltzmann method (FDLBM). We use a new lattice BGK compressible fluid model that has an additional term and allow larger time increment comparing the conventional FDLBM, and also use a boundary fitted coordinates. The jet is chosen long enough in order to guarantee the parabolic velocity profile of the jet at the outlet, and the edge consists of a wedge with an angle of $\alpha=23^0$. At a stand-off distance $\omega$, the edge is inserted along the centreline of the jet, and a sinuous instability wave with real frequency f is assumed to be created in the vicinity of the nozzle and th propagate towards the downstream. We have succeeded in capturing very small pressure fluctuations result from periodically oscillation of jet around the edge. That pressure fluctuations propagate with the sound speed. Its interaction with the wedge produces an irrotational feedback field which, near the nozzle exit, is a periodic transverse flow producing the singularities at the nozzle lips. The lattice BGK model for compressible fluids is shown to be one of powerful tool for computing sound generation and propagation for a wide range of flows.

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ABSORPTION LINE GRADIENTS IN THE SPECTRUM OF AN ELLIPTICAL GALAXY NGC 5864A

  • Sohn, Young-Jong;Yoon, Suk-Jin;Oh, Jung-Min
    • Journal of Astronomy and Space Sciences
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    • 제16권1호
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    • pp.1-10
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    • 1999
  • The archival long-slit spectra, covering the wavelength range 4050 ~ 5150 $\AA$, have been used to investigate the radial behavior of absorption line fea-tures (G4300, Fe4383, Ca4455, Fe4531, and $H{\beta}$) of an elliptical galaxy NGC 5846A. The heliocentric recession velocity of NGC 5846 has been derived as $1949{\pm}87\;kms^{-1}$. Fe absorption lines of NGC 5846A show significant radial gradients with the mean slope of $\Delta/Delta(r")=-0.863\pm0.202$. There is also a significant radial gradient of G band with a slope of $-1.109{\pm}0.098$. On the other hand, no radial gradients has been detected on the Ca4455 and $H{\beta}$ absorptions of NGC 5846A. A metallicity gradient, which is derived from the Fe line gradients, is similar to the abundance gradient predicted by Larson's (1975) dissipative models for the formation of elliptical galaxies. We also note that a galaxy-galaxy interaction could affect the line gradients of NGC 5864A.

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Molecular Dynamic Simulation for Penetration of Carbon Nanotubes into an Array of Carbon Nnantotubes

  • Jang, Ilkwang;Jang, Yong Hoon
    • Tribology and Lubricants
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    • 제36권5호
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    • pp.290-296
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    • 2020
  • When two layers of carbon nanotube (CNT) arrays are loaded to mate, the free ends of individual CNTs come into contact at the interface of the two layers. This leads to a higher contact resistance due to a smaller contact region. However, when the free CNT ends of one array penetrate into the mating array, the contact region increases, effectively lowering the contact resistance. To explore the penetration of mating CNTs, we perform molecular dynamic simulations of a simple unit cell model, incorporating four CNTs in the lower array layer coupled with a single moving CNT on the upper layer. The interaction with neighboring CNTs is modelled by long-range carbon bond order potential (LCBOP I). The model structure is optimized by energy minimization through the conjugate gradient method. A NVT ensemble is used for maintain a room temperature during simulation. The time integration is performed through the velocity-Verlet algorithm. A significant vibrational motion of CNTs is captured when penetration is not available, resulting in a specific vibration mode with a high frequency. Due to this vibrational behavior, the random behaviors of CNT motion for predicting the penetration are confirmed under the specific gap distances between CNTs. Thus, the probability of penetration is examined according to the gap distance between CNTs in the lower array and the aspect ratio of CNTs. The penetration is significantly affected by the vibration mode due to the van der Waals forces between CNTs.

Human Capacity Issues Along the STEM Pipeline

  • Melkers, Julia
    • STI Policy Review
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    • 제1권2호
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    • pp.1-18
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    • 2010
  • The development and maintenance of human capacity in economies is critical to long term competitiveness, but also for the overall health and environment of regions. Yet, human science and technology-based capacity is multidimensional and has interrelated characteristics which present certain policy challenges. This paper addresses a range of issues specific to a discussion on human capacity in S&T. First, the paper emphasizes the importance of acknowledging the complexity of human capacity issues and how they evolve along the STEM (science, technology, engineering, and mathematics) pipeline. The pipeline is an often used reference to describe the training and development in STEM disciplines, from early childhood education, to more advanced training, and finally to professional collaboration and interaction and serves as a useful organizing framework for the discussion of capacity along the career evolution process. Second, the paper offers an organizing framework for discussion of policy mechanisms that have been developed to address issues and gaps that occur along this STEM pipeline. Specifically, it contrasts the traditional mechanisms of building human capacity in STEM areas with newer "gap filling" and integrated approached to addressed human capacity disparities and priorities. Third, the paper addresses core challenges in human capacity in STEM, including the education and training, participation of women and underrepresented groups, brain drain/brain circulation issues, and the globalization of science. The paper concludes with a discussion of policy implication for the development of human capacity.

양자점 큐비트 기반 양자컴퓨팅의 국외 연구 동향 분석 (Research Trend for Quantum Dot Quantum Computing)

  • 백충헌;최병수
    • 전자통신동향분석
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    • 제35권2호
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    • pp.79-88
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    • 2020
  • Quantum computing is regarded as one of the revolutionary computing technologies, and has attracted considerable attention in various fields, such as finance, chemistry, and medicine. One of the promising candidates to realize fault tolerant quantum computing is quantum dot qubits, due to their expectation of high scalability. In this study, we briefly introduce the international tendencies for quantum dot quantum computing. First, the current status of quantum dot gate operations is summarized. In most systems, over 99% of single qubit gate operation is realized, and controlled-not and controlled-phase gates as 2-qubit entangling gates are demonstrated in quantum dots. Second, several approaches to expand the number of qubits are introduced, such as 1D and 2D arrays and long-range interaction. Finally, the current quantum dot systems are evaluated for conducting quantum computing in terms of their number of qubits and gate accuracies. Quantum dot quantum computing is expected to implement scalable quantum computing. In the noisy intermediate-scale quantum era, quantum computing will expand its applications, enabling upcoming questions such as a fault-tolerant quantum computing architecture and error correction scheme to be addressed.