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Molecular Dynamics Simulations of the Diffusion of Bimetallic Nanoclusters Supported on Graphite
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박준우 Joon Woo Park , 이주성 Ju Seong Lee , 민찬호 Chan Ho Min , 이현석 Hyun Seok Lee , 류지훈 Ji Hoon Ryu , 서동화 Dong Hwa Seo , 이혁모 Hyuck Mo Lee |
KJMM 47(8) 461-465, 2009 |
ABSTRACT
We study the diffusion of Ag based bimetallic nanoclusters supported on graphite. Using a molecular dynamics simulation, we reveal that the Ag clusters show rapid diffusion because of their hexagonal bottom layer. In order to decrease the rate of diffusion, we added Pt and Ni to distort the structure of the alloy cluster (i.e., the alloying method). We expected Pt to provide a stronger force on Ag atoms, and Ni to shorten the bond length and thereby change the structure of Ag cluster. However, the attempt was unsuccessful, because Pt and Ni atoms formed cores inside the Ag clusters. We therefore designed a collision system where large Ag clusters collide with small Pt or Ni clusters. Upon collision with Pt clusters, the diffusion showed little change, because Pt atoms are substituted at the Ag atomic site and form a perfectly ordered structure. The collision with Ni, however, deforms the bottom layer as well as the overall cluster structure and decreases diffusion. This outcome appoints toward the possibility of further application to the manufacture of durable nanocatalysts.
keyword : nanocluster, molecular dynamics simulation, diffusion, bimetal, alloy, collision
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The Effect of Substrate Surface Roughness on In-Situ Intrinsic Stress Behavior in Cu Thin Films
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조무현 Moo Hyun Cho , 황슬기 Seul Gi Hwang , 류상 Sang Ryu , 김영만 Young Man Kim |
KJMM 47(8) 466-473, 2009 |
ABSTRACT
Our group previously observed the intrinsic stress evolution of Cu thin films during deposition by changing the deposition rate. Intrinsic stress of Cu thin films, which show Volmer-Weber growth, is reported to display three unique stress stages, initial compressive, broad tensile, and incremental compressive stress. The mechanisms of the initial compressive stress and incremental compressive stages remain subjects of debate, despite intensive research inquiries. The tensile stress stage may be related to volume contraction through grain growth and coalescence to reduce over-accumulate Cu adatoms on the film surface. The in-situ intrinsic stresses behavior in Cu thin films was investigated in the present study using a multi-beam curvature measurement system attached to a thermal evaporation device. The effect of substrate surface roughness was monitored by observed the in-situ intrinsic stress behavior in Cu thin films during deposition, using 100 μm thick Si(111) wafer substrates with three different levels of surface roughness.
keyword : in-situ stress, intrinsic stress, thin film, evaporation, surface roughness
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Effects of Final Heat Treatment on Corrosion and Mechanical Properties of Zr Alloy Strip Incorporating Nb
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이명호 Myung Ho Lee , 정양일 Yang Il Jung , 최병권 Byoung Kwon Choi , 박상윤 Sang Yoon Park , 김현길 Hyun Gil Kim , 박정용 Jeong Yong Park , 정용환 Yong Hwan Jeong |
KJMM 47(8) 474-481, 2009 |
ABSTRACT
The effects of final heat treatment on the mechanical and corrosion properties of a Zr alloy strip incorporating Nb were investigated. The chemical composition of the strip was Zr-1.49Nb-0.38Sn-0.20Fe-0.11Cr, and strip specimens were subjected to final heat treatment in a temperature range of 580~700℃. Tensile tests at room temperature and 316℃, along with corrosion tests in a simulated PWR loop and a 70 ppm LiOH solution environment at 360℃, were performed on the specimens. The mechanical properties of the strip were saturated when the specimens received final heat treatment at an elevated temperature of more than 640℃. However, the corrosion resistance of the strip in the simulated PWR loop and in the 70 ppm LiOH solution environment was improved with a decrease of the final annealing temperature. It is recommended that the alloy strip be finally heat-treated at a temperature of less than 620℃ for longer than 10 minutes in order to obtain fully recrystallized microstructures, and thereby attain enlarged tensile elongation, and to prevent the precipitation of β-Zr, which is known to deteriorate the corrosion resistance.
keyword : Zirconium alloy, mechanical properties, corrosion, final annealing
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Effects of Intermediate Heat Treatment on the Corrosion and Mechanical Properties of Zr Alloy Strip Incorporating Nb
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이명호 Myung Ho Lee , 정양일 Yang Il Jung , 최병권 Byoung Kwon Choi , 박상윤 Sang Yoon Park , 김현길 Hyun Gil Kim , 박정용 Jeong Yong Park , 정용환 Yong Hwan Jeong |
KJMM 47(8) 482-487, 2009 |
ABSTRACT
In order to investigate the effects of intermediate heat treatment between cold rolling passes on the hardness and corrosion properties of a Zr alloy incorporating Nb (Zr-1.49Nb-0.38Sn-0.20Fe-0.11Cr) strip, three different intermediate heat treatment processes (580℃×4 hrs, 600℃×2 hrs and 620℃×1 hrs) were designed based on a recrystallization map and an accumulated annealing parameter. Test samples from the different processes were investigated by a hardness test, corrosion test, and microstructure analysis and appropriate heat-treatment conditions were thereupon proposed. The sample subjected to an intermediate heat treatment of 580℃×4 hrs was harder than that undergoing 600℃×2 hrs and 620℃×1 hr while the corrosion resistance of the sample that received an intermediate heat treatment of 580℃×4 hrs was superior to that of the other specimens. Considering the trade-off of hardness and corrosion resistance, an intermediate heat treatment process of 600℃×2 hrs is proposed to improve the manufacturing process of the alloy strip.
keyword : Zirconium alloy strip, cold rolling, intermediate heat treatment
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A Study on the Synthesis and Consolidation of Ti3Al by Electro-Discharge
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장형순 Hyung Sun Jang , 조유정 Yu Jung Cho , 강태주 Tae Ju Kang , 김기범 Ki Beom Kim , 이원희 Won Hee Lee |
KJMM 47(8) 488-493, 2009 |
ABSTRACT
Direct syntheses of bulk Ti3Al via electro-discharge-sintering (EDS) of a stoichiometric elemental powder mixture were investigated. A capacitor bank of 450 μF was charged with three input energies, 0.5, 1.0, and 1.5 kJ. The charged capacitor bank was then instantaneously discharged through 0.3 g of a Ti-25.0 at.%Al powder mixture for consolidation. Complete phase transformation occurred in less than 200 μsec by the discharge and a bulk Ti3Al compact was obtained. Compared with consolidated samples fabricated by conventional methods such as high vacuum sintering and casting, the electro-discharge-sintered Ti3Al compact shows a very fine microstructure with a hardness value of 425 Hv. Electro-discharge-sintering under a N2 atmosphere successfully modified the surface Ti oxide of the Ti3Al compact into Ti nitride, which concurred with the synthesis and consolidation of Ti3Al. Complete conversion yielding a single phase Ti3Al is primarily dominated by the fast solid state diffusion reaction.
keyword : Ti3Al, intermetallic compound, electro-discharge-sintering, phase transformation
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A Study on the Roll Forming Characteristics of an Asymmetric Roller with a 6 mm Steel Plate using the Finite Element Method
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김성수 Seong Soo Kim , 이경환 Gyeong Hwan Lee , 정한식 Han Shik Chung , 김동욱 Dong Uk Kim , 이재현 Je Hyun Lee , 최희규 Hee Kyu Choi |
KJMM 47(8) 494-499, 2009 |
ABSTRACT
As a novel method to produce a steel beam with 6mm thickness for buildings, a continuous roll forming process is reported. The roll shape is asymmetric and consists of 6 pairs of rollers to bend the steel plate from 0°to 90°. Results obtained upon application of the roll forming process showed that the angle of the section plate is 90°. However, defects such as bowing and camber as high as 3.2[°/m] were observed. AFEM (Finite Element Method) analysis was applied to investigate the causes of the results for the region between rollers no. 5 and no. 6. The results of a FEM simulation of deformation and stress showed that there are some strong peak stresses on the upper surface and bottom surface of the material. The positions of the peak stresses did not show a correspondence between the upper and bottom surfaces. Thus, the defects in the process of roll forming with a 6 mm thick steel plate occur by the unbalanced stresses between the upper surface and bottom surface of the material in this study.
keyword : 6 mm steel plate, roll forming, asymmetric roller, FEM
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The Interfacial Reactions and Reliability of SnAgCu Solder Joints under Thermal Shock Cycles
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오철민 Chul Min Oh , 박노창 No Chang Park , 한창운 Chang Woon Han , 방만수 Man Soo Bang , 홍원식 Won Sik Hong |
KJMM 47(8) 500-507, 2009 |
ABSTRACT
Pb-free solder has recently been used in electronics in efforts to meet environmental regulations, and a number of Pb-free solder alloy choices beyond the near-eutectic SnAgCu solder are now available. With increased demand for thin and portable electronics, the high cost of alloys containing significant amounts of silver and their poor mechanical shock performance have spurred the development of low Ag SnAgCu solder, which provides improved mechanical performance at a reasonable cost. Although low Ag SnAgCu solder exhibits significantly higher fracture resistance under high-strain rates, little thermal fatigue data exist for this solder. Therefore, it is necessary to investigate thermal fatigue reliability of low Ag SnAgCu solder under variation of thermal stress in order to allow its implementation in electronic products with high reliability requirements. In this study, the reliability of Sn0.3Ag0.7Cu(SAC0307), a low Ag solder alloy, is discussed and compared with that of Sn3Ag0.5Cu(SAC305). Three sample types and six samples size are evaluated. Mechanical properties and microstructure of the solder joint are investigated under thermal shock cycles. It was observed that the mechanical strength of SAC0307 dropped slightly with thermal cycling relative to that of SAC305. This reveals that the failure mode of SAC0307 is different from that SAC305 under this critical condition.
keyword : Pb-free solder joint, reliability, Low Ag solder, thermal shock, failure mode
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Fabrication and Properties of Ti-HA Composites Produced by Pulsed Current Activated Sintering for Biomaterials
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우기도 Kee Do Woo , 강덕수 Duck Soo Kang , 권의표 Eui Pyo Kwon , 문민석 Min Seok Moon , 손인진 In Jin Shon , Zhi Guang Liu |
KJMM 47(8) 508-515, 2009 |
ABSTRACT
Ti-6Al-4V biomaterial is widely used as a bone alternative. However, Ti-6Al-4V ELI alloy suffers from numerous problems such as a high elastic modulus and high toxicity. Therefore, non-toxic biomaterials with low elastic moduli need to be developed. Ti-HA(hydroxyapatite) composites were fabricated in the present work by pulsed current activated sintering (PCAS) at 1000℃ under 60 MPa using mixed Ti and HA powders. The effects of HA content on the physical and mechanical properties of the sintered Ti-HA composites have been investigated. X-ray diffraction(XRD) analysis of the Ti-HA composites, including Ti-40 wt%HA in particular, revealed new phases, Ti2O, CaO, CaTiO3, and TixPy, formed by chemical reactions between Ti and HA during sintering. The hardness of the Ti-HA composites decreased with an increase in HA content. The corrosion resistance of these composites was observed to be an excellent candidate as a commercial Ti-6Al-4 V ELI alloy. A Ti-5 wt%HA composite fabricated by PCAS is recommended as a new biomaterial, because it offers good corrosion resistance, compressive strength, wear resistance, and biocompatibility, and a low Young`s modulus.
keyword : biomaterial, Ti-HA composite, powder metallurgy, PCAS, hydoxyapatite
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Nanoporous Organo-functional Silica Synthesis Based on a Purely Inorganic Precursor
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Chang Sup Oh , Kyung Wan Koo , Chang Suk Han , Jang Woo Kim , Heon Chang Kim , Yong Sang Lee , Young Tai Choi , Yong Ha Kim |
KJMM 47(8) 516-521, 2009 |
ABSTRACT
In this study we report a rapid synthesis of nanoporous organo-functional silica (OFS) with unimodal and bimodal pore structures encompassing pores ranging from meso-to macroscale. The problems of tediousness and high production cost in the conventional syntheses are overcome by co-condensation of an inexpensive inorganic precursor, sodium silicate with an organosilane containing trimethyl groups. The in-situ covalent anchoring of the non-polar trimethyl groups to the inner pore walls prohibits irreversible shrinkage of the wet-gel during microwave drying at ambient pressure and thus larger size pores (from ca. 20 to ca. 100 nm) can be retained in the dried silica. The drying process of the silylated wet-gels at an ambient pressure can be greatly accelerated upon microwave exposure instead of drying in an oven or furnace. Using this approach, nanoporous and superhydrophobic silicas showing a wide variation in texture and morphology can be readily synthesized in roughly two hours. The effects of various sol-gel parameters solely on the textural properties of the organo-functional silica (OFS) have been investigated and discussed.
keyword : Organo-functional silica, meso/macroporous, co-condensation, sodium silicate, microwave drying
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