• 제목/요약/키워드: self-consistent method

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이온빔 처리된 폴리머 표면의 자가나노구조화를 이용한 반사방지 필름 제조용 소프트 몰드 임프린팅 연구 (Soft Mold Imprinting Fabrication of Anti-reflection Film using Self-Organized Nanostructure Polymer Surfaces Irradiated by Ion Beams)

  • 이승훈;변은연;최주연;정성훈;유병길;김도근
    • 한국표면공학회지
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    • 제50권6호
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    • pp.480-485
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    • 2017
  • Soft mold imprinting method that uses nanostructured polymer mold was investigated for anti-reflection film fabrication. The nanostructured soft mold was polyethylene terephthalate(PET) irradiated by oxygen ion beams. The collisional energy transfer between oxygen ion and the polymer surface induced cross-linking and scission reactions, resulting in self-organized nanostructures with regular patterns of the wavenumber of $5{\mu}m^{-1}$. Post processes including ultra-violet curable resin coating and delamination fabricated anti-reflection films. The imprinted resin surface also showed the consistent wavenumber, $5{\mu}m^{-1}$. Pristine PET, oxygen ion beam treated PET, and imprinted replica sample showed total transmittance of 91.04, 93.25, and 93.57-93.88%, respectively.

Recent Advances in Multireference-Based Perturbation Theory

  • Nakano, Haruyuki;Hirao, Kimihiko
    • Bulletin of the Korean Chemical Society
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    • 제24권6호
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    • pp.812-816
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    • 2003
  • Accurate ab initio computational chemistry has evolved dramatically. In particular, the development of multireference-based approaches has opened up a completely new area, and has had a profound impact on the potential of theoretical chemistry. Multireference-based perturbation theory (MRPT) is an extension of the closed-shell single reference Møller-Plesset method, and has been successfully applied to many chemical and spectroscopic problems. MRPT has established itself as an efficient technique for treating nondynamical and dynamical correlations. Usually, a complete active space self-consistent field (CASSCF) wave function is chosen as a reference function of MRPT. However, CASSCF often generates too many configurations, and the size of the active space can outgrow the capacity of the present technology. Many attempts have been proposed to reduce the dimension of CASSCF and to widen the range of applications of MRPT. This review focuses on our recent development in MRPT.

유한요소법에 의한 펌프축계의 안정성해석 (Stability analysis of pump using finite element method)

  • 양보석
    • Journal of Advanced Marine Engineering and Technology
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    • 제10권4호
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    • pp.31-40
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    • 1986
  • With the tendency toward high speed and high pressure in centrifugal pumps, the problem of sub-synchronous vibration has arisen, caused by the hydraulic forces of the working fluid, such as wearring, balance piston, impeller, etc.. These forces can drastically alter the rotor critical speeds and stability characteristics, and can be acted significant destabilizing forces. For preventing such self-excited vibration, the desing of the rotor system needs, which would secure the stability of the machine. In this paper, a procedure is presented for dynamic modeling of rotor-bearing-seal-impeller systems which consist of rigid disks, distributed parameter finite rotor elements and discrete bearings, seals and impellers. A finite element model including the effects of rotatory inertia and gyroscopic moments is developed using the consistent matrix approach. The technique of dynamic matrix reduction is applied to the shaft matrices to reduce them to a set of matrices of dynamic of significantly fewer degrees of freedom. The representation of bearing, seal and impeller elements is in term of linearized stiffness and damping matrices by reasonably small perturbations from equilibrium. The stability behavior of a typical double suction centrifugal pump is presented. Results show the influence of clearance and flow conditions on running speeds and stability characteristics.

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Prediction of the Secondary Structure of the AgfA Subunit of Salmonella enteritidis Overexpressed as an MBP-Fused Protein

  • Won, Mi-Sun;Kim, So-Youn;Lee, Seung-Hwan;Kim, Chul-Jung;Kim, Hyun-Su;Jun, Moo-Hyung;Song, Kyung-Bin
    • Journal of Microbiology and Biotechnology
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    • 제11권1호
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    • pp.164-166
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    • 2001
  • To examine the characteristics of the recombinant thin aggregative fimbriae of Salmonella, the AgfA subunit gene was amplified from Salmonella enteritidis using a PCR. The maltose binding protein (MBP)-AgfA fusion protein was overproduced in E. coli and purified. The secondary structure of AgfA was then elucidated from the difference CD spectra. An estimation of the secondary structure of AgfA using the self-consistent method revealed a mostly ${\beta}-sheet$ structure.

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콘크리트 탄성계수의 미시역학적 추정 (Evaluation of Elastic Modulus of Concrete Using Micro-mechanics Models)

  • 유동우;조호진;송하원;변근주
    • 한국콘크리트학회:학술대회논문집
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    • 한국콘크리트학회 1995년도 봄 학술발표회 논문집
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    • pp.345-349
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    • 1995
  • Although heterogeneous materials consisted of micro-constituents are complicated, it is possible to evaulate effective elastic moduli by using micro-mechanics models. In order to evaluate effective elastic moduli of concrete, all aggregates in a representative volume element(RVE) are assumed spherical and randomly distributed. A dilute distribution of inclusions is considered first, and the corresponding overall elastic moduli of the RVE are estimated. Then, the self-consistent method is used in order to take into account the interaction effects. The elastic moduli of concrete are calculated using the models and compared with those of experiment for different volume fractions of the aggregates and elastic moduli of the mortar and the aggregates.

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THE X-RAY EMISSION FROM EARLY TYPE GALAXIES

  • Kim, Dong-Woo
    • 천문학논총
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    • 제7권1호
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    • pp.63-69
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    • 1992
  • We have systematically investigated the X-ray spectra of normal galaxies, by using the Imaging Proportional Counter (IPC) data in the Einstein data base. We employed the X-ray color-color plot as well as the standard model fitting method which requires higher signal to noise ratio. We discuss X-ray emission mechanisms in terms of their spectral properties and the signature of cooling flows which are most likely present in X-ray bright early type galaxies. On the average, fits to absorbed thermal spectra show that the X-ray emission temperature of spirals is higher than that of ellipticals. This is consistent with our understanding that accreting binaries are a major X-ray source in spirals, while extended gaseous halos are present in ellipticals. The emission temperature becomes lower with increasing X-ray to optical luminosity ratio in E and S0 galaxies. This result is what we would expect if the emission of X-ray faint early type galaxies consists of a large evolved stellar component, while the gaseous emission becomes dominant in X-ray brighter galaxies. We also find a cool, self-absorbed core in some early type galaxies, which directly indicates the presence of cooling flows in such galaxies.

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High Power Single Mode Multi-Oxide Layer VCSEL with Optimized Thicknesses and Aperture Sizes of Oxide Layers

  • Yazdanypoor, Mohammad;Emami, Farzin
    • Journal of the Optical Society of Korea
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    • 제18권2호
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    • pp.167-173
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    • 2014
  • A novel multi-oxide layer structure for vertical cavity surface emitting laser (VCSEL) structures is proposed to achieve higher single mode output power. The structure has four oxide layers with different aperture sizes and thicknesses. The oxide layer thicknesses are optimized simultaneously to reach the highest single mode output power. A heuristic method is proposed for plotting the influence of these variable changes on the operation of optical output power. A comprehensive optical-electrical thermal-gain self-consistent VCSEL model is used to simulate the continuous-wave operation of the multi-layer oxide VCSELs. A comparison between optimized VCSELs with different structures is presented. The results show that by using multi-oxide layers with different thicknesses, higher single-mode optical output power could be achieved in comparison with multi-oxide layer structures with the same thicknesses.

레일의 제조공정에서 비금속 개재물에 의한 레일의 잔류응력 해석 (Analysis of the Residual Stress Produced by non-metallic Inclusions during Rail Manufacturing Process)

  • 구병춘;정우현;이희성;서정원
    • 한국철도학회:학술대회논문집
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    • 한국철도학회 1999년도 춘계학술대회 논문집
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    • pp.352-357
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    • 1999
  • During the cooling process of rail, residual stresses are produced due to the difference of the coefficients of thermal expansion between rail and inhomogeneous non-metallic inclusions such as sulphides and oxides. A micro-mechanical approach is used to obtain the stresses in the inclusions and matrix, After obtaining the stress of an elliptical inhomogeneous inclusion in an infinite domain, average stresses of randomly distributed spherical inclusions are obtained by use of Mori-Tanaka's self consistent method. The magnitude of the calculated residual stress is near to the yield stress of the matrix in case of the spherical inclusions.

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EFFECTS OF PARTICLE RESONANCE ON DISPERSION OF ELASTIC WAVES IN PARTICULATE COMPOSITES

  • Kim, J.Y.;Ih, J.G.;Lee, B.H.
    • 한국음향학회:학술대회논문집
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    • 한국음향학회 1994년도 FIFTH WESTERN PACIFIC REGIONAL ACOUSTICS CONFERENCE SEOUL KOREA
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    • pp.734-739
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    • 1994
  • Elastic wave propagation in discrete random medium is studied to evaluate the effects of particle resonance on dispersion and attenuation of composite materials containing spherical inclusions. The frequency-dependent wave speed and attenuation coefficient can be obtained from proposed self-consistent method. It can be observed that the abrupt increase of effective wave speed and the concurrent peak of attenuation at low frequency is due to the lowest resonance of particles, whereas those in high frequency region are due to higher ones. The lowest resonance is mainly caused by the density mismatch and higher resonances by the stiffness mismatch between matrix and particles. The dispersion and attenuation of elastic waves in particulate composites are affected by the lowest resonance much than by higher ones.

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AlGaAs/GaAs/AlGaAs 이중 이종집합 HEMT 구조에서의 2차원 전자개스 농도의 양자역학적 계산 (Quantum Mechanical Calculation of Two-Dimensional Electron Gas Density in AlGaAs/GaAs/AlGaAs Double-Heterojunction HEMT Structures)

  • 윤경식;이정일;강광남
    • 전자공학회논문지A
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    • 제29A권3호
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    • pp.59-65
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    • 1992
  • In this paper, the Numerov method is applied to solve the Schroedinger equation for $Al_{0.3}Ga_{0.7}AS/GaAs/Al_{0.3}Ga_{0.7}As$ double-heterojunction HEMT structures. The 3 subband energy levels, corresponding wave functions, 2-dimensional electron gas density, and conduction band edge profile are calculated from a self-consistent iterative solution of the Schroedinger equation and the Poisson equation. In addition, 2-dimensional electron gas densities in a quantum well of double heterostructure are calculated as a function of applied gate voltage. The density in the double heterojunction quantum well is increased to about more than 90%, however, the transconductance of the double heterostructure HEMT is not improved compared to that of the single heterostructure HEMT. Thus, double-heterojunction structures are expected to be suitable to increase the current capability in a HEMT device or a power HEMT structure.

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