• Title/Summary/Keyword: X-선 구조분석

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$({\eta}^5-C_5Me_5)_2BiCl$, The First Organobismuth Compound with $\pi$-bonded Cyclopentadienyl Ring Analysized by X-ray Diffractometry (X-선 회절 분석법에 의한 고리화펜타디에닐 고리가 $\pi$-결합된 최초의 유기비스무트화합물의 구조결정)

  • Lorberth, J.;Shin, Sung-Hee;Kong, Young Kun
    • Analytical Science and Technology
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    • v.11 no.1
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    • pp.42-46
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    • 1998
  • The reaction of $({\eta}^5-C_5Me_5)_2K$ with $BiCl_3$ yielded $({\eta}^5-C_5Me_5)_2BiCl$[I], the first organobismuth compound with ${\pi}$-bonded cyclopentadienyl ring. The compound I which was the violet crystal (yield, 30%) was decomposed to $PCpBiCl_2$. The Structure of $({\eta}^5-C_5Me_5)_2BiCl$ was identified as single crystal by X-ray diffraction method. The eliminated product $C_{20}H_{30}$, triclinic crystal of space group p1(Z=2) which was attached with C-C ${\sigma}$-bond of two cyclopentadienyl was defined by the structural analysis.

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Synthesis and Characterization of a Series of PtRu/C Catalysts for the Electrooxidation of CO (일산화탄소 산화를 위한 PtRu/C 시리즈 촉매의 합성 및 특성 연구)

  • Lee, Seonhwa;Choi, Sung Mook;Kim, Won Bae
    • Clean Technology
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    • v.18 no.4
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    • pp.432-439
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    • 2012
  • The electrocatalytic oxidation of CO was studied using carbon-supported 20 wt% PtRu (PtRu/C) catalysts, which were prepared with different Pt : Ru atomic ratios from 7 : 3 to 3 : 7 using a colloidal method combined with a freeze-drying procedure. The bimetallic PtRu/C catalysts were characterized by various physicochemical analyses, including X-ray diffraction (XRD), transmission electron microscopy (TEM), energy dispersive X-ray spectroscopy (EDS), and X-ray photoelectron spectroscopy (XPS). CO stripping voltammetry measurements indicated that the addition of Ru with a Pt catalyst significantly improved the electrocatalytic activity for CO electrooxidation. Among the tested catalysts, the $Pt_5Ru_5/C$ catalyst had the lowest onset potential (vs.Ag/AgCl) and the largest CO EAS. Structural modification via lattice parameter change and electronic modification in the unfilled d band states for Pt atoms may facilitate the electrooxidation of CO.

Investigation on the Distribution of Native Oxide in GaAs Wafer Using Angle-resolved X-ray Photoelectron Spectroscopy (각분해 X-선 광전자 분광기를 이용한 GaAs 자연 산화막의 분포연구)

  • Sa, Seung-Hun;Gang, Min-Gu;Park, Hyeong-Ho;O, Gyeong-Hui;Seo, Gyeong-Su
    • Korean Journal of Materials Research
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    • v.7 no.6
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    • pp.484-491
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    • 1997
  • 본 연구에서는 비파괴적 분석 기법인 각분해 X-선 광전자 분광기(Angle-Resolved X-ray Photoelectron Spectros-copy)를 이용하여 GaAs 표면 자연 산화막의 깊이에 따른 화학적 결합 상태 및 조성 분석을 수행하였다. GaAs의 벽개면 및 Ar이온으로 식각된 면을 기준시료로 하여 각 원자의 광전자 강도(intensity)를 보정해주는 인자인 ASF(atomic sensitivity factor)의 최적값을 구하였다. 이륙각에 따라 발생되어지는 각 원소의 피이크 분해와 정확한 ASF의 보정을 통한 각 원소의 실험적인 결과를 이용하여 깊이 방향으로의 조성 분포 모델을 세웠으며, 이론적인 강도와의 상호비교로부터 표면 오염층의 구조는 표면으로부터 탄소층, Ga-oxide와 As-oxide로 이루어진 oxides층, As-As결합의 elemental As층 및 GaAs기판의 순으로 존재함을 알 수 있었다. 또한 GaAs 표면에 존재하는 오염층은 35.8$\pm$3.3 $\AA$이었다. 또한 위 결과로부터 분석깊이 영역에서 원자수의 비로써 정의되는 의미로서의 실질조성을 구하였는데 단지 특정 이륙각에 따라 일반적인 ASF로 보정된 표면조성 결과는 표면 상태를 명확히 표현해주지 못함을 확인할 수 있었다.

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A Study on the Fabrication of Fe Based Alloy Powder for Laser Welding (레이저 용접용 Fe계 합금 분말 제조에 관한 연구)

  • Lee, Jong-Jae;Son, Young-San
    • Journal of the Korea Academia-Industrial cooperation Society
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    • v.13 no.8
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    • pp.3315-3318
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    • 2012
  • In this study, Fe-base alloy powder was prepared by gas atomizing method. Shape and crystal structure of the powder were investigated by FESEM, X-ray diffraction, and DSC. The powder was produced in a spherical shape, with a size of 45 ~ 90 ${\mu}m$. X-ray diffraction analysis revealed that the powder was fully amorphous, showing typical broad amorphous peak. From DSC analysis, Tg and Tx that are generally found in a bulk amorphous alloy were also observed in the alloy powder. Tg and Tx of the powder were $530^{\circ}C$ and $560^{\circ}C$, respectively. These results suggest us that the bulk amorphous alloy (BMG) powder prepared in this study is applicable to laser welding.

In situ Electric-Field-Dependent X-Ray Diffraction Experiments for Ferroelectric Ceramics (강유전 세라믹의 전기장 인가에 따른 in situ X-선 회절 실험)

  • Choi, Jin San;Kim, Tae Heon;Ahn, Chang Won
    • Journal of the Korean Institute of Electrical and Electronic Material Engineers
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    • v.35 no.5
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    • pp.431-438
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    • 2022
  • In functional materials, in situ experimental techniques as a function of external stimulus (e.g., electric field, magnetic field, light, etc.) or changes in ambient environments (e.g., temperature, humidity, pressure, etc.) are highly essential for analyzing how the physical properties of target materials are activated/evolved by the given stimulation. In particular, in situ electric-field-dependent X-ray diffraction (XRD) measurements have been extensively utilized for understanding the underlying mechanisms of the emerging electromechanical responses to external electric field in various ferroelectric, piezoelectric, and electrostrictive materials. This tutorial article briefly introduces basic principles/key concepts of in situ electric-field-dependent XRD analysis using a lab-scale XRD machine. We anticipate that the in situ XRD method provides a practical tool to systematically identify/monitor a structural modification of various electromechanical materials driven by applying an external electric field.

Vaccum Coating Synthesis and Characterization of the CdSe Nanostructures as a Semiconductor (화합물 반도체 CdSe 나노구조의 진공 코팅합성과 특성)

  • Chang, Ki-Seog;Hwang, Chang-Su;Park, Young-Heon
    • Korean Journal of Crystallography
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    • v.15 no.1
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    • pp.18-23
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    • 2004
  • In order to find the optical properties of CdSe thin film and CdSe nanostructure, the following experiments were performed: the CdSe wurtzite nanostructure was made by using 99.99% CdSe (Aldrich) powder with the $SiO_x$ substrates and the $AlO_x$ membranes in $7{\times}10^{-6}$ torr vacuum. (The average vacuum coating speed being 1 ${\AA}$/sec). The calculations obtained were about 200 nm diameter of nanotubes on the $AlO_x$ membranes and a crystallite size of about 2 nm on the $SiO_x$ substrates. These results were verified through the Scanning Electron Microscopy (SEM) analysis, thin film X-ray diffraction analysis and emission spectroscopy.

Electronic Structure and Si L2,3-edge X-ray Raman Scattering Spectra for SiO2 Polymorphs: Insights from Quantum Chemical Calculations (양자화학계산을 이용한 SiO2 동질이상의 전자 구조와 Si L2,3-edge X-선 라만 산란 스펙트럼 분석)

  • Kim, Yong-Hyun;Yi, Yoo Soo;Lee, Sung Keun
    • Korean Journal of Mineralogy and Petrology
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    • v.33 no.1
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    • pp.1-10
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    • 2020
  • The atomic structures of silicate liquids at high pressure provide insights into the transport properties including thermal conductivities or elemental partitioning behavior between rocks and magmas in Earth's interior. Whereas the local electronic structure around silicon may vary with the arrangement of the nearby oxygens, the detailed nature of such relationship remains to be established. Here, we explored the atomic origin of the pressure-induced changes in the electronic structure around silicon by calculating the partial electronic density of states and L3-edge X-ray absorption spectra of SiO2 polymorphs. The result showed that the Si PDOS at the conduction band varies with the crystal structure and local atomic environments. Particularly, d-orbital showed the distinct features at 108 and 130 eV upon the changes in the coordination number of Si. Calculated Si XAS spectra showed features due to the s,d-orbitals at the conduction band and varied similarly with those observed in s,d-orbitals upon changes in the crystal structures. The calculated Si XAS spectrum for α-quartz was analogous to the experimental Si XRS spectrum for SiO2 glass, implying the overall similarities in the local atomic environments around the Si. The edge energies at the center of gravity of XAS spectra were closely related to the Si-O distance, thus showing the systematic changes upon densification. Current results suggest that the Si L2,3-edge XRS, sensitive probe of the Si-O distance, would be useful in unveiling the densification mechanism of silicate glasses and melts at high pressure.

3D Analysis of Crack Growth in Metal Using Tension Tests and XFEM (인장 실험과 XFEM을 이용한 금속 균열 성장의 3 차원적 분석)

  • Lee, Sunghyun;Jeon, Insu
    • Transactions of the Korean Society of Mechanical Engineers A
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    • v.38 no.4
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    • pp.409-417
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    • 2014
  • To prevent the occurrence of fractures in metal structures, it is very important to evaluate the 3D crack growth process in those structures and any related parts. In this study, tension tests and two simulations, namely, Simulation-I and Simulation-II, were performed using XFEM to evaluate crack growth in three dimensions. In the tension test, Mode I crack growth was observed for a notched metal specimen. In Simulation-I, a 3D reconstructed model of the specimen was created using CT images of the specimen. Using this model, an FE model was constructed, and crack growth was simulated using XFEM. In Simulation-II, an ideal notch FE model of the same geometric size as the actual specimen was created and then used for simulation. Obtained crack growth simulation results were then compared. Crack growth in the metal specimen was evaluated in three dimensions. It was shown that modeling the real shape of a structure with a crack may be essential for accurately evaluating 3D crack growth.

열처리 시간 변화에 따른 유기태양전지의 특성 변화

  • Choe, Cheol-Jun;Yang, Hui-Yeon;Kim, Tae-Hwan
    • Proceedings of the Korean Vacuum Society Conference
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    • 2013.02a
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    • pp.445-445
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    • 2013
  • 유기태양전지는 간단한 제조공정, 낮은 제조단가, 가벼운 무게 및 우수한 유연성의 장점을 가지고 있기 때문에 모바일 기기의 응용에 많은 관심을 가지고 있다. 그러나 이종접합 유기태양전지의 광전 변환효율이 낮기 때문에 유기태양전지를 상용화하기 위해서는 광전변환 효율을 높이기 위한 연구가 필요하다. 본 연구에서는 태양전지의 광전 변환효율을 증진하기 위하여 열처리 시간 변화에 따른 이종접합 유기 태양전지의 특성에 미치는 효과를 조사하였다. 전자 주게 물질인 P3HT와 전자 받게 물질인 PCBM 물질을 특정용매에 녹여 패턴화된 ITO를 코팅한 glass 기판 위에 스핀 코팅 방법을 이용하여 glass/ITO/PEDOT:PSS/P3HT:PCBM/Al 구조를 가진 이종접합 유기태양전지를 제작하였다. UV-Vis 분광학, X-선 광전자 분광학 및 원자힘 현미경 측정을 하여 제작한 소자의 광학적 및 구조적 특성을 분석하였다. 이종접합 유기태양전지의 우수한 광흡수율과 평탄한 표면을 가지는 최적화 조건을 열처리 시간에 따라 비교 분석하였다. 제작한 소자들을 열처리를 하지 않은 소자와 다양한 시간 동안 열처리를 한 소자의 특성을 비교하였다. 제작한 이종접합 태양전지의 전류-전압 측정 결과를 분석하여 최대의 광전 변환효율을 가지는 최적의 열처리 조건을 결정하였다. 열처리를 할 경우 열처리를 하지 않은 소자보다 광전 변환효율이 증가함을 알 수 있었다.

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Synthesis and Characterization of MoN coatings by Arc Ion Plating (MoN 코팅막의 미세구조와 그 특성 연구)

  • Park, Ji-Hun;Kim, Gwang-Ho
    • Proceedings of the Korean Institute of Surface Engineering Conference
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    • 2007.11a
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    • pp.125-127
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    • 2007
  • MoN 코팅막은 Ar과 $N_2$가 섞인 가스 상태 안에서 몰리브덴(Mo) 타겟을 사용해서 아크 이온 플레이팅법을 사용하여 stainless steel 표면 위에 증착을 시켰다. MoN 코팅막의 미세 결정 구조의 특징은 X-선 회절 분석(X-ray Diffractormeter, Phillips co. X'pert)과 XPS를 사용해서 측정하였다. MoN 코팅막은 순수 Mo 코팅막의 13GPa 보다 높은 25 GPa의 미세경도값을 나타냈으며, 또한 Mo 코팅막에 N의 함량이 증가할수록 마찰계수가 낮아지는 것을 알 수 있었다. 이번 연구에서는 MoN 코팅막에서 질소 함량을 변화 시켜 MoN 코팅막의 미세구조와 그 특성에 대하여 연구하였다.

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