• 제목/요약/키워드: Detailed Chemistry

검색결과 325건 처리시간 0.019초

층류 부상화염 구조의 해석 (Analysis of the Laminar Lifted Flame Structure)

  • 김후중;김용모;김세원
    • 대한기계학회논문집B
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    • 제23권9호
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    • pp.1098-1105
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    • 1999
  • A lifted laminar flame structure has been numerically analyzed. The present study employs the physical submodels including the detailed chemical kinetics and the variable transport properties. The validation cases Include a lifted laminar CH4/air flame with a central diluted fuel jet and a surrounding fuel-lean coflow. Numerical results indicate the present approach successfully simulate the detailed structure and mechanism of the triple flame in the lifted laminar methane flame.

석탄가스 난류비예혼합 화염장의 해석 (Numerical Analysis for the Detailed Structure of Syngas Turbulent Nonpremixed Flames)

  • 이정원;김창환;김용모
    • 한국신재생에너지학회:학술대회논문집
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    • 한국신재생에너지학회 2007년도 춘계학술대회
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    • pp.775-778
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    • 2007
  • The present study numerically investigate the detailed structure of the syngas diffusion flames. In order to realistically represent the turbulence-chemistry interaction, the transient flamelet model has been applied to simulate the combustion processes and $NO_X$ formation in the syngas turbulent nonpremixed flames. The single mixture fraction formulation is extended to account for the effects of the secondary inlet mixture. Computations are the wide range of syngas compositions and oxidizer dilutions. Based on numerical results, the detailed discussion has been made for the effects of syngas composition and oxidizer dilution on the structure of the syngas-air and syngas-oxygen turbulent nonpremixed flames.

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Ab initio Studies on d8-MCI(PH3)2(C2H2), M=Rh and Ir, Complexes

  • Kang, Sung-Kwon;Song, Jin-Soo;Moon, Jung-Hyun;Yun, Sock-Sung
    • Bulletin of the Korean Chemical Society
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    • 제18권1호
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    • pp.27-32
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    • 1997
  • The geometries and energies of the isomers in alkyne complexes MCl(PH3)2(η2-C2H2), M=Rh and Ir, are theoretically investigated using ab initio methods at the Hartree-Fock and up to MP4 level of theory and relativistic effective core potentials for Rh and Ir metals. The optimized structures of Rh complexes, 1-3 at MP2/ECP1 level are in good agreement with the related experimental data. The binding energies of C2H2 to d8-metal fragments are computed to be ∼55 kcal/mol. The vinylidene complexes for Rh and Ir metals are calculated to be much lower in energy than the alkyne complexes. The alkyne-vinylidene rearrangement is possible to proceed exothermically through the intermediate hydrido-alkynyl complexes, 2 or 9. Detailed comparison is given about the geometries and relative energies on Rh and Ir isomers at the various level ab initio calculations with orbital analysis.

Two New Species and Three New Records of Ascomycetes in Korea

  • Nguyen, Thuong T.T.;Lim, Hyo Jin;Chu, So Jeong;Lee, Hyang Burm
    • Mycobiology
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    • 제50권1호
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    • pp.30-45
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    • 2022
  • During a survey of plant-inhabiting fungi and water niches from Korea, noteworthy fungi were collected; among them, two new species, Paracamarosporium noviaquum sp. nov. and Phyllosticta gwangjuensis sp. nov., are described based on morphology and multi-gene phylogenies. Paracamarosporium noviaquum was characterized by its production of 1-celled and 2-celled conidia, forming conidiomata on only potato dextrose agar medium. Phyllosticta gwangjuensis was characterized by conidia hyaline, ovoid to ellipsoid shape, rounded at both ends, containing numerous guttulae or with a single large central guttule. Additional species were identified as Cosmospora lavitskiae, Monochaetia cameliae, and Roussoella doimaesalongensis, which are reported as new record species from Korea. Detailed descriptions and illustrations of these taxa are provided herein.

전자충격반응을 포함하는 플라즈마 화학반응을 고려한 용량결합형 산소플라즈마의 전산모사 연구 (Simulation Study of Capacitively Coupled Oxygen Plasma with Plasma Chemistry including Detailed Electron Impact Reactions)

  • 김헌창
    • 공업화학
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    • 제22권6호
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    • pp.711-717
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    • 2011
  • 전자충격반응을 고려한 three moment 플라즈마 모델과 전기적 중성성분의 반응을 고려한 유체 유동 모델을 결합하여 용량결합형 산소플라즈마에 대한 2차원적 전산모사 연구를 수행하였다. 전자의 에너지에 의하여 좌우되는 전자충격반응에 대한 반응속도는 전자와 $O_2$ 및 O 사이의 전자충돌단면적으로부터 계산되었다. 플라즈마 모델과 유체 유동 모델을 결합하고 상세한 반응메커니즘을 포함시킴으로써 전하를 띠는 전자와 이온($O_2{^+}$, $O^+$, $O_2{^-}$, and $O^-$) 그리고 기저상태의 산소($O_2$ and O)뿐만 아니라 $O_2(a^1{\Delta}_g)$, $O_2(b^1{{\Sigma}_g}^+)$, $O(^1D)$, $O(^1S)$ 등과 같이 산소플라즈마 특성에 중요한 역할을 하는 준안정상태 성분들의 시공간적 분포를 예측할 수 있었다. 또한 산소플라즈마의 전산모사로부터 sheath 경계에 이중층이 존재함을 확인할 수 있었다.

비파괴 분석법을 적용한 결정질 태양전지 모듈의 Snail trail 현상 연구 (Non-destructive Analysis of Snail Trail on Silver Grid Line in PV Module)

  • 김다정;김남수;황경준;이주호;정신영;정대홍
    • Current Photovoltaic Research
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    • 제2권2호
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    • pp.63-68
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    • 2014
  • In recent years, discoloration defects, called as snail trail, have been observed at many crystalline photovoltaic modules after a period of time ranging from several months to several years after initial installation. It has been reported that this phenomenon doesn't impact on the performance of photovoltaic modules, but it can be detected through simple visual inspection. The origin and detailed mechanism for the formation have not been identified. In this study, non-destructive analysis by Raman spectroscopy has been carried out to investigate the origin of this phenomenon. In parallel, destructive analysis by scanning electron microscopt and transmission electron microscopy was also performed in order to confirm the results from non-destructive method. Through the extensive analysis, it was found that the main cause for discoloration is the formations of $Ag_2CO_3$ and $AgC_2H_3O_2$. Detailed mechanism for the formation of these particles was indentified through systematic studies.

Laminar Flamelet Model을 이용한 비예혼합 난류제트화염의 연소과정 및 NO 생성 해석 (Laminar Flamelet Modeling of Combustion Processes and NO Formation in Nonpremixed Turbulent Jet Flames)

  • 김성구;김후중;김용모
    • 한국연소학회지
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    • 제4권2호
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    • pp.51-62
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    • 1999
  • NOx formation in turbulent flames is strongly coupled with temperature, superequilibrium concentration of O radical, and residence time. This implies that in order to accurately predict NO level, it is necessary to develop sophisticated models able to account for the complex turbulent combustion processes including turbulence/chemistry interaction and radiative heat transfer. The present study numerically investigates the turbulent nonpremixed hydrogen jet flames using the laminar flamelet model. Flamelet library is constructed by solving the modified Peters equations and the turbulent combustion model is extended to nonadiabatic flame by introducing the enthalpy defect. The effects of turbulent fluctuation are taken into account by the presumed joint PDFs for mixture fraction, scalar dissipation rate, and enthalpy defect. The predictive capability of the present model has been validated against the detailed experimental data. Effects of nonequilibrium chemistry and radiative heat loss on the thermal NO formation are discussed in detail.

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Laminar Flamelet Model을 이용한 비예혼합 난류제트화염의 연소과정 및 NO 생성 해석 (Laminar Flamelet Modeling of Combustion Processes and NO Formation in Nonpremixed Turbulent Jet Flames)

  • 김성구;김후중;김용모
    • 한국연소학회:학술대회논문집
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    • 한국연소학회 1999년도 제19회 KOSCO SYMPOSIUM 논문집
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    • pp.93-104
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    • 1999
  • NOx formation in turbulent flames is strongly coupled with temperature, superequilibrium concentration of O radical, and residence time. This implies that in order to accurately predict NO level, it is necessary to develop sophisticated models able to account for the complex turbulent combustion processes including turbulence/chemistry interaction and radiative heat transfer. The present study numerically investigates the turbulent nonpremixed hydrogen jet flames using the laminar flamelet model. Flamelet library is constructed by solving the modified Peters equations and the turbulent combustion model is extended to nonadiabatic flame by introducing the enthalpy defect. The effects of turbulent fluctuation are taken into account by the presumed joint PDFs for mixture fraction, scalar dissipation rate, and enthalpy defect. The predictive capability of the present model has been validated against the detailed experimental data. Effects of nonequilibrium chemistry and radiative heat loss on the thermal NO formation are discussed in detail.

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Synthesis and Characterization of Star-shaped Aliphatic Polyester

  • Shin, Young-Cheol;Park, Kil-Yeong;Jin, Moon-Young;Hong, Sung-Kwon;Donghyun Cho;Taihyun Chang;Moonhor Ree
    • Macromolecular Research
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    • 제9권2호
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    • pp.100-106
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    • 2001
  • Several star-polymers with aliphatic cores were synthesized by ring opening polymerization (ROP) of $\xi$-caprolactone using stannous 2-ethyl-hexanoate as a catalyst. The star-polymers were thoroughly analyzed by MALDI-TOF mass spectrometry, temperature gradient interaction chromatography and $\^$13/C-NMR to obtain detailed information of the molecular structure. The imperfection of the star-polymers seemed to be originated from restricted participation of sterically hindered hydroxyl groups of initiator. The synthesized star-polymers had narrow molecular weight distributions. Various reaction conditions to control the imperfection were studied.

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Nano-Optical Investigation of Enhanced Field at Gold Nanosphere-Gold Plane Junctions

  • Ahn, Sung-Hyun;Park, Won-Hwa;Kim, Zee-Hwan
    • Bulletin of the Korean Chemical Society
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    • 제28권12호
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    • pp.2200-2202
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    • 2007
  • The local field distribution around gold nanosphere-gold plane junction has been studied using the finitedifference time-domain (FDTD) electrodynamics calculation procedure. We find that both the in-plane and out-of-plane polarized excitation produce enhanced field strong enough to explain the observed SERS activities of the junctions. Comparison with a simple dipole-image dipole model shows that the enhanced field primarily originates from the multipole-image multipole interaction, which indicates that the detailed fine-structures of the nanoparticles also play a significant role in the SERS activities as well.