• 제목/요약/키워드: Atomic structure

검색결과 1,405건 처리시간 0.026초

X-선과 중성자 회절을 이용한 강유전체 단결정 $LiN(D_xH_{1-x}){_4}SO_4$의 결정구조 연구 (Crystal Structure Analysis of $LiN(D_xH_{1-x}){_4}SO_4$ by X-ray and Neutron Diffraction)

  • 김신애;김성훈;소지용;이정수;이창희
    • 한국광물학회지
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    • 제20권4호
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    • pp.351-356
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    • 2007
  • 수소원자를 포함한 강유전체 $Li(NH_4)SO_4$의 중수소 치환형인 $Li(ND_4)SO_4$ 단결정에 대해 X-선과 중성자 회절법으로 결정구조를 연구하였다. 이 결정은 상온에서 사방정계이고 공간군은 $P2_1nb$이다. 격자상수는 $a=5.2773(5)\;{\AA},\;b=9.1244(23)\;{\AA},\;c=8.7719(11)\;{\AA}$이며 Z=4이다. 한국원자력연구원의 연구용 원자로인 하나로에 설치된 중성자 4축 단결정 회절장치로 중성자데이터를 수집하였으며, X-선 회절데이터는 일본 동북대학교 물리학과에서 측정하였다. X-선 회절법으로 수집한 1450개의 독립 회절반점에 대하여 최소자승법으로 정밀화하여 최종 신뢰도값 R=0.070을 얻었으며, 중성자 회절법으로는 745개의 회절반점에 대하여 R=0.049을 얻었다. X-선 회절데이터 분석 결과 결정구조 내의 수소원자 중 1개의 위치만을 얻었으나, 중성자 회절법으로는 $NH_4$ 사면체의 수소/중수소원자의 위치는 물론 H를 치환해서 들어간 D의 점유율을 정련하여 측정시료의 평균화학식이 $LiND_{3.05}H_{0.95}SO_4$임을 밝혔다.

Synthesis and Analysis of Ge2Sb2Te5 Nanowire Phase Change Memory Devices

  • 이준영;김정현;전덕진;한재현;여종석
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2015년도 제49회 하계 정기학술대회 초록집
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    • pp.222.2-222.2
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    • 2015
  • A $Ge_2Sb_2Te_5$ nanowire (GST NW) phase change memory device is investigated with Joule heating electrodes. GST is the most promising phase change materials, thus has been studied for decades but atomic structure transition in the phase-change area of single crystalline phase-change material has not been clearly investigated. We fabricated a phase change memory (PCM) device consisting of GST NWs connected with WN electrodes. The GST NW has switching performance with the reset/set resistance ratio above $10^3$. We directly observed the changes in atomic structure between the ordered hexagonal close packed (HCP) structure and disordered amorphous phase of a reset-stop GST NW with cross-sectional STEM analysis. Amorphous areas are detected at the center of NW and side areas adjacent to heating electrodes. Direct imaging of phase change area verified the atomic structure transition from the migration and disordering of Ge and Sb atoms. Even with the repeated phase transitions, periodic arrangement of Te atoms is not significantly changed, thus acting as a template for recrystallization. This result provides a novel understanding on the phase-change mechanism in single crystalline phase-change materials.

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SIMULATION OF HIGH BURNUP STRUCTURE IN UO2 USING POTTS MODEL

  • Oh, Jae-Yong;Koo, Yang-Hyun;Lee, Byung-Ho
    • Nuclear Engineering and Technology
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    • 제41권8호
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    • pp.1109-1114
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    • 2009
  • The evolution of a high burnup structure (HBS) in a light water reactor (LWR) $UO_2$ fuel was simulated using the Potts model. A simulation system for the Potts model was defined as a two-dimensional triangular lattice, for which the stored energy was calculated from both the irradiation damage of the $UO_2$ matrix and the formation of a grain boundary in the newly recrystallized small HBS grains. In the simulation, the evolution probability of the HBS is calculated by the system energy difference between before and after the Monte Carlo simulation step. The simulated local threshold burnup for the HBS formation was 62 MWd/kgU, consistent with the observed threshold burnup range of 60-80 MWd/kgU. The simulation revealed that the HBS was heterogeneously nucleated on the intergranular bubbles in the proximity of the threshold burnup and then additionally on the intragranular bubbles for a burnup above 86 MWd/kgU. In addition, the simulation carried out under a condition of no bubbles indicated that the bubbles played an important role in lowering the threshold burnup for the HBS formation, thereby enabling the HBS to be observed in the burnup range of conventional high burnup fuels.

Study on Defects in 2D Materials using Atomic Resolution TEM

  • 류경희;박효주;김정화;김나연;이종영;이종훈
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2016년도 제50회 동계 정기학술대회 초록집
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    • pp.87.1-87.1
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    • 2016
  • The unique properties of 2D materials significantly rely on the atomic structure and defects. Thus study at atomic scale is crucial for in-depth understanding of 2D materials and provides insights into its future applications. Using aberration-corrected transmission electron microscopes, atomic resolution imaging of individual atoms has been achieved even at a low kV. Ongoing optimization of aberration correction improves the spatial resolution better than angstrom and moreover boosts the contrast of light atoms. I present the recent progress of the study on the atomic structure and defects of monolayer and multilayer graphene, hBN and MoS2. Furthermore, the defect formation mechanisms of graphene, hexagonal boron nitride and MoS2 are discussed.

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Failure Evaluation Plan of a Reactor Internal Components of a Decommissioned Plant

  • Hwang, Seong Sik;Kim, Sung Woo;Choi, Min Jae;Cho, Sung Hwan;Kim, Dong Jin
    • Corrosion Science and Technology
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    • 제20권4호
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    • pp.189-195
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    • 2021
  • A technology for designing and licensing a dedicated radiation shielding facility needs to be developed for safe and efficient operation an R&D center. Technology development is important for smooth operation of such facilities. Causes of damage to internal structures (such as baffle former bolt (BFB) of pressurized water reactor) of a nuclear power reactor should be analyzed along with prevention and countermeasures for similar cases of other plants. It is important to develop technologies that can comprehensively analyze various characteristics of internal structures of long term operated reactors. In high-temperature, high-pressure operating environment of nuclear power plants, cases of BFB cracks caused by irradiated assisted stress corrosion cracks (IASCC) have been reported overseas. The integrity of a reactor's internal structure has emerged as an important issue. Identifying the cause of the defect is requested by the Korean regulatory agency. It is also important to secure a foundation for testing technology to demonstrate the operating environment for medium-level irradiated testing materials. The demonstration testing facility can be used for research on material utilization of the plant, which might have highest fluence on the internal structure of a reactor globally.

감마선 이용 친수성 PLLA 시트 기능화 및 특성 평가 (Functionalization of PLLA Sheet Using Gamma-ray Irradiation)

  • 권희정;정진오;정성린;박종석;임윤묵
    • 방사선산업학회지
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    • 제12권4호
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    • pp.343-348
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    • 2018
  • Preliminary study was perfomed to develop a biocompatible filter material using radiation energy. Electrosppined PLLA nano sheets were surface-modificated with hydrophilic groups(acrylic group) by using radiation. The physico-chemical and morphological characteristics of modified PLLA sheets were measured by ATR, SEM, contact angle, and hydrophilic (acryl group) introduction rate (TBO). As a result, there was no morphological(fiber structure) structure change due to radiation, and it was confirmed that an acrylic group was successfully introduced onto PLLA fiber sheet by radiation.

Atomic Structure Analysis of BaO Layers on the Si(100) Surface by Impact-Collision ion Scattering Spectroscopy

  • Hwang, Yeon
    • 한국결정학회지
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    • 제17권2호
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    • pp.51-54
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    • 2006
  • BaO layers were formed on the Si(100) surface by thermal evaporation of barium metal with simultaneous oxidation. The atomic structure of BaO layers at the initial stage of the deposition was investigated by the scattering intensity variation of $He^+$ions on time-of-flight (TOF) impact-collision ion scattering (ICISS). The results show that several number of BaO layers are formed on the Si(100) surface with the lattice parameter of bulk phase, and the occupation of oxygen atoms of the BaO layers is on-top site of silicon atoms.

Determination of energetically preferable Au-S contact atomic structure in stretched single-molecule junctions

  • Ko, Kwan Ho
    • EDISON SW 활용 경진대회 논문집
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    • 제3회(2014년)
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    • pp.409-411
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    • 2014
  • Based on the first-principles computations, the nature of the microscopic geometry of the molecule-electrode contacts was addressed. The single-molecule junction was prepared by connecting hexanediothiolate (HDT) to Au(111) electrodes via one, two, and three Au adatoms having coordination number of one (CN1), two (CN2), and, three (CN3), respectively. The contact atomic structure and energy of the stretched Au-HDT-Au junction was observed. The analysis revealed that the contact geometry with lowest coordination number (CN1) is energetically more stable than CN2 and CN3.

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Effect of Gamma Irradiation on the Structural and Physiological Properties of Silk Fibroin

  • Sung, Nak-Yun;Byun, Eui-Baek;Kwon, Sun-Kyu;Kim, Jae-Hun;Song, Beom-Seok;Choi, Jong-Il;Kim, Jin-Kyu;Yoon, Yo-Han;Byun, Myung-Woo;Kim, Mee-Ree;Yoo, Hong-Sun;Lee, Ju-Woon
    • Food Science and Biotechnology
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    • 제18권1호
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    • pp.228-233
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    • 2009
  • This study was conducted to examine the changes in the molecular structure and physiological activities of silk fibroin by gamma irradiation. The results of gel permeation chromatography and sodium dodecyl sulfate-polyacrylamide gel electrophoresis showed that the molecular weight of fibroin was increased depending upon the irradiation dose. Secondary structure of fibroin determined by using circular dichroism revealed that the ratio of $\alpha$-helix was increased up to 10 kGy and then decreased depending upon the irradiation dose. Whereas, the ratio of $\beta$-sheet, $\beta$-turn, and random coil were decreased and then increased with an alteration in the $\alpha$-helix secondary conformation. The 2.2-diphenyl-1-picryl-hydrazil (DPPH) radical scavenging activity of fibroin was increased by gamma irradiation at 5 kGy, but was decreased above 10 kGy depending upon the irradiation dose. Also, the inhibition activities of tyrosinase and melanin synthesis of fibroin were increased by gamma irradiation. These results indicated that gamma irradiation could be used as an efficient method to make fibroin more suitable for the development of functional foods and cosmetics.

Electrochemical corrosion behavior of atmospheric-plasma-sprayed copper as a coating material for deep geological disposal canisters

  • Sung-Wook Kim;Gha-Young Kim;Young-Ho Lee;Jun-Hyuk Jang;Chung-Won Lee;Jeong-Hyun Woo;Seok Yoon
    • Nuclear Engineering and Technology
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    • 제55권11호
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    • pp.4032-4038
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    • 2023
  • Cu, which exhibits excellent corrosion resistance in underground environments, has been investigated as a canister material for use in the deep geological disposal of spent nuclear fuels. In this study, the technical viability of atmospheric plasma spraying for producing Cu-coated canisters was investigated. A high-purity Cu film (millimeter scale) was deposited onto a stainless-steel substrate using a plasma gun with a shroud structure. Potentiodynamic polarization studies revealed that the Cu film exhibited a sufficiently low corrosion rate in the groundwater electrolyte. In addition, no pitting corrosion was observed on the Cu film surface after accelerated corrosion studies. A prototype cylindrical Cu film was fabricated on a 1/20 scale on a stainless-steel tube to demonstrate the scalability of atmospheric plasma spraying in producing Cu-coated canisters.