• Title/Summary/Keyword: 밀도 함수

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Fundamental Mechanisms of Platinum Catalyst for Oxygen Reduction Reaction in Fuel Cell: Density Functional Theory Approach (연료전지 산소환원반응 향상 위한 백금 촉매의 구조적 특성: 밀도범함수이론 연구)

  • Kang, Seok Ho;Lee, Chang-Mi;Lim, Dong-Hee
    • Journal of Korean Society of Environmental Engineers
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    • v.38 no.5
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    • pp.242-248
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    • 2016
  • The overall reaction rate of fuel cell is governed by oxygen reduction reaction (ORR) in the cathode due to its slowest reaction compared to the oxidation of hydrogen in the anode. The ORR efficiency can be readily evaluated by examining the adsorption strength of atomic oxygen on the surface of catalysts (i.e., known as a descriptor) and the adsorption energy can be controlled by transforming the surface geometry of catalysts. In the current study, the effect of the surface geometry of catalysts (i.e., strain effect) on the adsorption strength of atomic oxygen on platinum catalysts was analyzed by using density functional theory (DFT). The optimized lattice constant of Pt ($3.977{\AA}$) was increased and decreased by 1% to apply tensile and compressive strain to the Pt surface. Then the oxygen adsorption strengths on the modified Pt surfaces were compared and the electron charge density of the O-adsorbed Pt surfaces was analyzed. As the interatomic distance increased, the oxygen adsorption strength became stronger and the d-band center of the Pt surface atoms was shifted toward the Fermi level, implying that anti-bonding orbitals were shifted to the conduction band from the valence band (i.e., the anti-bonding between O and Pt was less likely formed). Consequently, enhanced ORR efficiency may be expected if the surface Pt-Pt distance can be reduced by approximately 2~4% compared to the pure Pt owing to the moderately controlled oxygen binding strength for improved ORR.

Probable annual maximum of daily snowfall using improved probability distribution (개선된 확률밀도함수 적용을 통한 빈도별 적설심 산정)

  • Park, Heeseong;Chung, Gunhui
    • Journal of Korea Water Resources Association
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    • v.53 no.4
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    • pp.259-271
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    • 2020
  • In Korea, snow damage has happened in the region with little snowfalls in history. Also, accidental damage was caused by heavy snow leads and the public interest on heavy snow has been increased. Therefore, policy about the Natural Disaster Reduction Comprehensive Plan has been changed to include the mitigation measures of snow damage. However, since heavy snow damage was not frequent, studies on snowfall have not been conducted on different points. The characteristics of snow data commonly are not the same as the rainfall data. Some southern coastal areas in Korea are snowless during the year. Therefore, a joint probability distribution was suggested to analyze the snow data with many 0s in a previous research and fitness from the joint probability distribution was higher than the conventional methods. In this study, snow frequency analysis was implemented using the joint probability distribution and compared to the design codes. The results were compared to the design codes. The results of this study can be used as the basic data to develop a procedure for the snow frequency analysis in the future.

Study on the Backscattered Signal of Swimbladdred Fish: Target Strength due to Length and Behavior of Red Seabream (Pagrus Major) (부레를 가진 어류의 음향산란 강도에 관한 연구: 참돔의 길이 및 행동에 따른 산란강도)

  • 강돈혁;황두진;나정열;김수암
    • The Journal of the Acoustical Society of Korea
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    • v.20 no.5
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    • pp.100-109
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    • 2001
  • The backscattered sound energy by fish depends on size and physical structure and, most important, on the presence or absence of a swimbladder. Target strength experiments of red seabream (Pagrus major) were conducted by using 38 (split-beam), 120 (split-beam) and 200 kHz (dual-beam) frequencies with live fishes confined in a net-cage and free swimming in tank without the cage, respectively. For 38, 120, and 200 kHz frequencies, target strength equations are expressed as a function of fish length:TS/sub 38kHz/=20 log/sub 1o(l)/-66.41, TS/sub 120kHz/=20 log/sub 1o(1)/-71.80, and TS/sub 200kHz/=20 log/sub 1o(1)/-73.94. To test the acoustic models by using Helmholtz-Kirchhoff ray approximation, predictions of target strength based on swimbladder morphometries are compared with target strength measurements. The target strength of whole fish depends on variations in swimbladder morphology than fish body morphology. In the mean time, when the fish is confined in the net cage, scattering length by the backscattered signal matched with the Gaussian PDF, while under the free-swimming condition, scattering length is close to the Rayleigh PDF.

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Studies on the Major Factors Affecting the Population of the Overwintered Pine Needle Gall Midge, Thecodiplosis japonensis Uchida et Inouye (솔잎혹파리의 월동후(越冬後) 밀도변동(密度變動)에 미치는 주요인자(主要因子)에 관(關)한 연구(硏究))

  • Chung, Yeong-Jin;Hyun, Jai-Sun
    • Korean journal of applied entomology
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    • v.25 no.1 s.66
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    • pp.1-9
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    • 1986
  • Periodical samplings were made in the fields, located Hwasong-Gun, Banwal-Myon, Doondai-Ri, for two years to study the major factors responsible to the population of the overwintered pine needle gall midge, Thecodiplosis japonensis Uchida et Inouye. The population densities of the overwintered larvae reduced greatly at the time of pupation and the changing patterns seemed to be influenced by environmental conditions. The estimated 50% pupation day was about two weeks earlier for the 1980 generation compared with the 1979 generation, and much higher average and the daily maximum temperatures in 1981 affected on the development of the larvae. The relative emergence rates were 14.1% for 1979 and 14.9% for 1980 generation. The relative emergence rates(Y) were affected by the moisture contents of soil ($X_1$) and its variance $(X_2),\;Y=-68.41+4.3206X_1-0.6887X_2$. The relative emergence rates seemed to be decreased with the increased variance of the moisture contents of soil. Percents of needle gall were 49.63% for 1980 and 86.87% for 1981 generation.

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Estimation of Probability Precipitation by Regional Frequency Analysis using Cluster analysis and Variable Kernel Density Function (군집분석과 변동핵밀도함수를 이용한 지역빈도해석의 확률강우량 산정)

  • Oh, Tae Suk;Moon, Young-Il;Oh, Keun-Taek
    • KSCE Journal of Civil and Environmental Engineering Research
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    • v.28 no.2B
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    • pp.225-236
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    • 2008
  • The techniques to calculate the probability precipitation for the design of hydrological projects can be determined by the point frequency analysis and the regional frequency analysis. Probability precipitation usually calculated by point frequency analysis using rainfall data that is observed in rainfall observatory which is situated in the basin. Therefore, Probability precipitation through point frequency analysis need observed rainfall data for enough periods. But, lacking precipitation data can be calculated to wrong parameters. Consequently, the regional frequency analysis can supplement the lacking precipitation data. Therefore, the regional frequency analysis has weaknesses compared to point frequency analysis because of suppositions about probability distributions. In this paper, rainfall observatory in Korea did grouping by cluster analysis using position of timely precipitation observatory and characteristic time rainfall. Discordancy and heterogeneity measures verified the grouping precipitation observatory by the cluster analysis. So, there divided rainfall observatory in Korea to 6 areas, and the regional frequency analysis applies index-flood techniques and L-moment techniques. Also, the probability precipitation was calculated by the regional frequency analysis using variable kernel density function. At the results, the regional frequency analysis of the variable kernel function can utilize for decision difficulty of suitable probability distribution in other methods.

Reliability Based Design Optimization for Section Shape of Simple Structures (빔 단면형상에 대한 구조물 신뢰성 최적설계)

  • 임준수;임홍재;이상범;허승진
    • Proceedings of the Korean Society for Noise and Vibration Engineering Conference
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    • 2002.05a
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    • pp.672-676
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    • 2002
  • In this paper, a reliability-based design optimization method, which enables the determination of optimum design that incorporate confidence range for structures, is studied. Response surface method and Monte Carlo simulation are utilized to determine limit state function. The proposed method is applied to the I-type steel structure for reliability based optimal design.

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Outage Probability of STTD System in Nakagami Fading Channel (나카가미 페이딩채널에서 STTD 시스템의 오수신확률)

  • 남우춘;한영열
    • The Journal of Korean Institute of Communications and Information Sciences
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    • v.26 no.9A
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    • pp.1459-1464
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    • 2001
  • 본 논문에서는 나카가미 페이딩에서 STTD(Space Time Transmitter Diversity)기법을 적용한 셀룰러 무선 시스템의 오수신확률을 유도한다. 라플라스 변환을 이용하여 L개의 독립적이고 동일분포의 다중간섭신호에 대한 새로운 확률밀도함수를 유도하고, 동일채널 나카가미 간섭신호속에서 나카가미 페이딩을 겪는 신호에 대한 오수신확률을 나타내며, 주파수 재사용거리의 함수로 오수신확률을 표현한다.

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New Formulation of MNDIF Method for Eigenvalue Analysis of Acoustic Cavities (음향 공동의 고정밀도 고유치 해석을 위한 새로운 MNDIF 법 정식 개발)

  • Kang, S.W.
    • Proceedings of the Korean Society for Noise and Vibration Engineering Conference
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    • 2013.10a
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    • pp.658-663
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    • 2013
  • A new formulation of the MNDIF method is introduced to extract highly accurate eigenvalues of concave acoustic cavities with arbitrary shapes. It is said that the MNDIF method cannot yield accurate eigenvalues for concave cavities. To overcome this weak point, a new approach of dividing a concave cavity into two convex domains is proposed. The validity of the proposed method is shown through a case study.

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Quantum Mechanical Investigations for the Interactions between Fullerene and Encapsulated Waters (풀러렌-물 클러스터의 상호작용에 대한 양자 역학적 이론 연구)

  • Kim, Sung-Hyun;Shin, Chang-Ho;Kim, Ji-Sun;Kang, So-Yung;Kim, Seung-Joon
    • Journal of the Korean Chemical Society
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    • v.59 no.1
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    • pp.9-17
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    • 2015
  • The density functional theory (DFT) calculations on $(H_2O)_n@C_{60}$, (n=1-10) complexes have been performed to elucidate hydrogen interaction between fullerene and water clusters. The optimized geometries, harmonic vibrational frequencies, and binding energies are predicted at various levels of theory. The harmonic vibrational frequencies for the molecules considered in this study show all real numbers implying true minima. We also compare the H-bond interaction between $(H_2O)_n$ and $(H_2O)_n@C_{60}$, (n=1-10) clusters.

The Study on the Characteristics of Pellets Manufactured with Morphologically Different Domestic Larix Kaemferi Carr Sawdust (국내산 낙엽송의 톱밥 유형에 따른 펠릿특성에 관한 연구)

  • Ryu, Jae-Yun;Kang, Chan-Young;Lee, Eung-Su;Seo, Jun-Won;Lee, Hyun-Jong;Park, Heon
    • Journal of the Korean Wood Science and Technology
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    • v.38 no.1
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    • pp.49-55
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    • 2010
  • morphologically different Larix Kaemferi Carr sawdust. The pellet characteristics included moisture contents satisfied the first grade (less than 10%) of quality standard of wood pellets announced by Korea Forest Research Institute. Densities were also adequate for the first grade (640kg/$m^3$) on the quality standard and there was no large difference in other characteristics of pellets, however, pellets manufactured with planer shavings had the highest density. Ash contents also passed the first grade (less than 0.7) of quality standard. But bark pellet exceeded the second grade (1.5%) in ash content. Lower absorption ratio of bark pellet showed the effect on hygroscpicity. The heating value of the manufactured wood pellets in this study exceeded the first grade of quality standard(more than 4,300 kcal/kg).