• Title/Summary/Keyword: Structural Properties

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Molecular Dynamics Simulation of Liquid Alkanes. Ⅰ. Thermodynamics and Structures of Normal Alkanes : n-butane to n-heptadecane

  • 이송희;이홍;박형석;Jayendran C. Rasaiah
    • Bulletin of the Korean Chemical Society
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    • v.17 no.8
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    • pp.735-744
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    • 1996
  • We present results of molecular dynamic (MD) simulations for the thermodynamic and structural properties of liquid n-alkanes, from n-butane to n-heptadecane, using three different models Ⅰ-Ⅲ. Two of the three classes of models are collapsed atomic models while the third class is an atomistically detailed model. Model Ⅰ is the original Ryckaert and Bellemans' collapsed atomic model [Discuss. Faraday Soc. 1978, 66, 95] and model Ⅱ is the expanded collapsed model which includes C-C bond stretching and C-C-C bond angle bending potentials in addition to Lennard-Jones and torsional potentials of model Ⅰ. In model Ⅲ all the carbon and hydrogen atoms in the monomeric units are represented explicitly for the alkane molecules. Excellent agreement of the results of our MD simulations of model Ⅰ for n-butane with those of Edberg et al.[J. Chem. Phys. 1986, 84, 6933], who used a different algorithm confirms the validity of our algorithms for MD simulations of model Ⅱ for 14 liquid n-alkanes and of models Ⅰ and Ⅲ for liquid n-butane, n-decane, and n-heptadecane. The thermodynamic and structural properties of models Ⅰ and Ⅱ are very similar to each other and the thermodynamic properties of model Ⅲ for the three n-alkanes are not much different from those of models Ⅰ and Ⅱ. However, the structural properties of model Ⅲ are very different from those of models Ⅰ and Ⅱ as observed by comparing the radial distribution functions, the average end-to-end distances and the root-mean-squared radii of gyrations.

Mechanical properties and damage constitutive model of self-compacting rubberized concrete

  • Ke, Xiaojun;Xiang, Wannian;Ye, Chunying
    • Computers and Concrete
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    • v.30 no.4
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    • pp.257-267
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    • 2022
  • Two different types of rubber aggregates (40 mesh rubber powder and 1-4 mm rubber particles respectively) were devised to substitute fine aggregates at 10%, 15%, 20% and 30% by volume in self-compacting concrete to investigate their basic mechanical properties. The results show that with the increase of rubber content, the reduction of compressive strength, splitting tensile strength and static modulus of elasticity gradually increase, and energy dissipation performance gradually increase. The rubber addition significantly reduces brittleness and decelerates damaged process. Whilst, the effect of rubber particles is greater when they are finer. Considering the mechanical properties, the optimal rubber content is 10%. It is recommended that the rubber volume content in rubberized concrete (RC) should not be higher than 20%. In addition, a constitutive model under uniaxial compression was proposed basing on the strain equivalent principle of Lemaitre and the damage theory, which was in good agreement with the test curves.

An efficient C1 beam element via multi-scale material adaptable shape function

  • El-Ashmawy, A.M.;Xu, Yuanming
    • Advances in nano research
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    • v.13 no.4
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    • pp.351-368
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    • 2022
  • Recently, promising structural technologies like multi-function, ultra-load bearing capacity and tailored structures have been put up for discussions. Finite Element (FE) modelling is probably the best-known option capable of treating these superior properties and multi-domain behavior structures. However, advanced materials such as Functionally Graded Material (FGM) and nanocomposites suffer from problems resulting from variable material properties, reinforcement aggregation and mesh generation. Motivated by these factors, this research proposes a unified shape function for FGM, nanocomposites, graded nanocomposites, in addition to traditional isotropic and orthotropic structural materials. It depends not only on element length but also on the beam's material properties and geometric characteristics. The systematic mathematical theory and FE formulations are based on the Timoshenko beam theory for beam structure. Furthermore, the introduced element achieves C1 degree of continuity. The model is proved to be convergent and free-off shear locking. Moreover, numerical results for static and free vibration analysis support the model accuracy and capabilities by validation with different references. The proposed technique overcomes the issue of continuous properties modelling of these promising materials without discarding older ones. Therefore, introduced benchmark improvements on the FE old concept could be extended to help the development of new software features to confront the rapid progress of structural materials.

Structural Model Test for Strength Performance Evaluation of Fairlead Chain Stopper Installed on MW Class Floating Type Offshore Wind Turbine (메가와트급 부유식 해상풍력발전기용 페어리드 체인 스토퍼의 강도 성능평가를 위한 구조 모형 시험)

  • Chang-Yong Song
    • Journal of the Korean Society of Industry Convergence
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    • v.26 no.3
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    • pp.421-431
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    • 2023
  • Recently, the destructive power of typhoons is continuously increasing due to the influence of global warming. In a situation where the installation of floating wind turbines is increasing around the world, concerns about the huge loss and collapse of floating offshore wind turbines due to strong typhoons are deepening. Regarding to the safe operation of the floating offshore wind turbine, the development of a new type of disconnectable mooring system is required. A new fairlead chain stopper considered in this study is devised to more easily attach or detach the floating offshore wind turbine with mooring lines comparing to other disconnectable mooring apparatuses. In order to investigate the structural safety of the initial design of fairlead chain stopper that can be applied to MW-class floating type offshore wind turbine, scale-down structural models were produced using a 3-D printer and structural tests were performed on the models. For the structural tests of the scale-down models, tensile specimens of acrylonitrile butadiene styrene material that was used in the 3-D printing were prepared, and the material properties were evaluated by performing the tensile tests. The finite element analysis of fairlead chain stopper was performed by applying the material properties obtained from the tensile tests and the same load and boundary conditions as in the scale-down model structural tests. Through the finite element analysis, the structural weak parts on the fairlead chain stopper were reviewed. The structural model tests were performed considering the main load conditions of fairlead chain stopper, and the test results were compared to the finite element analysis. Through the results of this study, it was possible to experimentally verify the structural safety of the initial design of fairlead chain stopper. It is also judged that the study results can be usefully used to improve the structural strength of fairlead chain stopper in a detailed design stage.

Determination of structural behavior of Bosporus suspension bridge considering construction stages and different soil conditions

  • Gunaydin, Murat;Adanur, Suleyman;Altunisik, Ahmet Can;Sevim, Baris;Turker, Emel
    • Steel and Composite Structures
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    • v.17 no.4
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    • pp.405-429
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    • 2014
  • In this paper, it is aimed to determine the structural behavior of suspension bridges considering construction stages and different soil conditions. Bosporus Suspension Bridge connecting the Europe and Asia in Istanbul is selected as an example. Finite element model of the bridge is constituted using SAP2000 program considering existing drawings. Geometric nonlinearities are taken into consideration in the analysis using P-Delta large displacement criterion. The time dependent material strength of steel and concrete and geometric variations is included in the analysis. Time dependent material properties are considered as compressive strength, aging, shrinkage and creep for concrete, and relaxation for steel. To emphases the soil condition effect on the structural behavior of suspension bridges, each of hard, medium and soft soils are considered in the analysis. The structural behavior of the bridge at different construction stages and different soil conditions has been examined. Two different finite element analyses with and without construction stages are carried out and results are compared with each other. At the end of the analyses, variation of the displacement and internal forces such as bending moment, axial forces and shear forces for bridge deck and towers are given in detail. Also, displacement and stresses for bridge foundation are given with detail. It can be seen from the analyses that there are some differences between both analyses (with and without construction stages) and the results obtained from the construction stages are bigger. It can be stated that the analysis without construction stages cannot give the reliable solutions. In addition, soil condition have effect on the structural behavior of the bridge. So, it is thought that construction stage analysis using time dependent material properties, geometric nonlinearity and soil conditions effects should be considered in order to obtain more realistic structural behavior of suspension bridges.

Molecular Characterization of the Recombinant A-chain of a Type II Ribosome-Inactivating Protein (RIP) from Viscum album coloratum and Structural Basis on its Ribosome-Inactivating Activity and the Sugar-binding Properties of the B-chain

  • Ye, Wenhui;Nanga, Ravi Prakash Reddy;Kang, Cong Bao;Song, Joo-Hye;Song, Seong-Kyu;Yoon, Ho-Sup
    • BMB Reports
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    • v.39 no.5
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    • pp.560-570
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    • 2006
  • Mistletoe (Viscum album) lectins, which are classified as a type II ribosome-inactivating protein (RIP) due to their unique biological function and the potential medical and therapeutic application in cancer cells, receive a rising attention. The heterodimeric glycoproteins contain the A-chain with catalytic activity and the B-chain with sugar binding properties. In recent years, studies involving the lectins from the white berry European mistletoe (Viscum album) and the yellow berry Korean mistletoe (Viscum album coloratum) have been described. However, the detailed mechanism in exerting unique cytotoxic effect on cancer cells still remains unclear. Here, we aim to understand and define the molecular basis and biological effects of the type II RIPs, through the studies of the recombinant Korean mistletoe lectin. To this end, we expressed, purified the recombinant Korean mistletoe lectin (rKML), and investigated its molecular characteristics in vitro, its cytotoxicity and ability to induce apoptotic cell death in cancer cells. To gain structural basis for its catalytic activity and sugar binding properties, we performed homology modeling studies based on the high degree of sequence identity and conserved secondary structure prediction between Korean and European, Himalayan mistletoe lectins, and Ricin.

Finite element model calibration of a steel railway bridge via ambient vibration test

  • Arisoy, Bengi;Erol, Osman
    • Steel and Composite Structures
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    • v.27 no.3
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    • pp.327-335
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    • 2018
  • This paper presents structural assessment of a steel railway bridge for current condition using modal parameter to upgrade finite element modeling in order to gather accurate result. An adequate monitoring, such as acceleration, displacement, strain monitoring, is important tool to understand behavior and to assess structural performance of the structure under surround vibration by means of the dynamic analysis. Evaluation of conditions of an existing steel railway bridge consist of 4 decks, three of them are 14 m, one of them is 9.7 m, was performed with a numerical analysis and a series of dynamic tests. Numerical analysis was performed implementing finite element model of the bridge using SAP2000 software. Dynamic tests were performed by collecting acceleration data caused by surrounding vibrations and dynamic analysis is performed by Operational Modal Analysis (OMA) using collected acceleration data. The acceleration response of the steel bridge is assumed to be governing response quantity for structural assessment and provide valuable information about the current statute of the structure. Modal identification determined based on response of the structure play significant role for upgrading finite element model of the structure and helping structural evaluation. Numerical and experimental dynamic properties are compared and finite element model of the bridge is updated by changing of material properties to reduce the differences between the results. In this paper, an existing steel railway bridge with four spans is evaluated by finite element model improved using operational modal analysis. Structural analysis performed for the bridge both for original and calibrated models, and results are compared. It is demonstrated that differences in natural frequencies are reduced between 0.2% to 5% by calibrating finite element modeling and stiffness properties.

Structural and electrical properties of ZnO:Al, In thin film (ZnO:Al,In 박막의 구조적 및 전기적 특성)

  • 박경일;서무룡;홍범표;김정규;전춘배;박기철
    • Proceedings of the IEEK Conference
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    • 1998.06a
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    • pp.395-397
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    • 1998
  • NH$_{3}$ gas sensitive ZnO:Al, In thin films were prepared by the heat treatment following continuous deposition of very thin In layer and ZnO:Al layer to obtain the modified surface morphology for good sensitivity. Dependence of the structural electrical and optical properties of them on heat treatment temperature was investigated by x-ray diffraction, SEM, 4-point probe method and spectrophotometer.

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Polarized Raman Spectroscopy of Graphene

  • Cheong, Hyeon-Sik
    • Proceedings of the Korean Vacuum Society Conference
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    • 2011.02a
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    • pp.5-5
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    • 2011
  • Raman spectroscopy has become one of the most widely used tools in graphene research. The resonant Raman scattering process that gives rise to the observed strong Raman signal carries information regarding the electronic structure as well as the structural properties. When polarization of the incident excitation laser light or the scattered signal is carefully controlled, more information on the electronic and structural properties becomes available. In this tutorial, the basics of polarized Raman scattering experiments will be introduced first. Then several examples from real research will be highlighted to illustrate the application of polarized Raman spectroscopy in graphene research.

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Measurement of Thickness of Still Air Layer above Fabrics (직물의 표면 정지 공기층의 두께 측정)

  • 나영주
    • Journal of the Korean Society of Clothing and Textiles
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    • v.21 no.7
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    • pp.1117-1123
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    • 1997
  • This paper describes the measurement of thickness of still air layer above fabrics and its relationship to structural properties of fabrics. Rayon fabrics - of both filament and spun - and wool nylon blended fabrics varied in terms of surface hairiness were used. Temperature and relative humidity above fabrics were measured at the various distances from the fabric surface. Increase in the thickness of fabric, fabric weight, yarn count, and crimp resulted increase in thickness of still air layer above fabric. Surface hairiness of fabrics as well as the structural properties were found to be related with the thickness of still air layer above fabrics.

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