• Title/Summary/Keyword: partial coordination number

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Analysis of the thresholds of granular mixtures using the discrete element method

  • Jian, Gong;Jun, Liu
    • Geomechanics and Engineering
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    • v.12 no.4
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    • pp.639-655
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    • 2017
  • The binary mixture consists of two types of granular media with different physical attributes and sizes, which can be characterized by the percentage of large granules by weight (P) and the particle size ratio (${\alpha}$). Researchers determine that two thresholds ($P_S$ and $P_L$) exist for the peak shear strength of binary mixtures, i.e., at $P{\leq}P_S$, the peak shear strength is controlled by the small granules; at $P{\leq}P_L$, the peak shear strength is controlled by the large granules; at $P_S{\leq}P{\leq}P_L$, the peak shear strength is governed by both the large and small granules. However, the thresholds of binary mixtures with different ${\alpha}$ values, and the explanation related to the inner details of binary mixtures to account for why these thresholds exist, require further confirmation. This paper considers the mechanical behavior of binary mixtures with DEM analysis. The thresholds of binary mixtures are found to be strongly related to their coordination numbers $Z_L$ for all values of ${\alpha}$, where $Z_L$ denotes the partial coordination number only between the large particles. The arrangement structure of the large particles is examined when P approaches the thresholds, and a similar arrangement structure of large particles is formed in both 2D and 3D particle systems.

On The performance of Coordinated Random Beamforming Schemes in A Two-Cell Symmetric Interference Channel (두 셀 대칭적 간섭 채널환경에서 협력적 불규칙 빔형성 방법의 성능에 대한 연구)

  • Yang, Jang-Hoon;Chae, Hyun-Jin;Kim, Yo-Han;Kim, Dong-Ku
    • The Journal of Korean Institute of Communications and Information Sciences
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    • v.36 no.4A
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    • pp.318-324
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    • 2011
  • In this paper, three coordinated random beamforming (CRBF) schemes are analyzed in a two-cell symmetric interference channel. A simple partial coordination of RBF with base station selection (BSS) is shown to achieve the same average sum rate performance of CRBF with joint encoding (JE). To improve the sum rate performance further, we also propose a transmission mode selection (TMS) between the BSS and JE which is shown to have additional sum rate gain for the large number of users. Simulation results verify the eectiveness of the proposed CRBF schemes and accuracy of the proposed analysis.

MICROSTRUCTURAL STUDY OF $Fe_{1-x}Ti_x$ ALLOYS FORMED BY ION BEAM MIXING

  • Jeon, Y.;Lee, Y.S.;Choi, B.S.;Woo, J.J.;Whang, C.N.
    • Journal of the Korean Vacuum Society
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    • v.6 no.S1
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    • pp.127-132
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    • 1997
  • Microstructure of the Fe-Ti system by ion beam mixing of multilayers at 300 K and 77 K has been studied in a wide composition range. The ion bombardment was carried out using $Ar^+$ ions at 80 keV. Using grazing angle x-ray diffraction we find that the lattice parameters of these bcc solid solutions are very close to that of $\alpha$-Fe. Extended x-ray absorption fine-structure spectroscopy have been performed to investgate the short-range order in the ion-beam-mixed state. The structure parameters, such as the interatomic distance and the coordination number are estmated from the Fe K-edge Fourier filtered EXAFS spectra. The interatomic distance is independent of the alloy concentration and it is almost constant. The study of x-ray absorption near-edge structure gives information on the individual $\rho$components of the partial densityof states of the conduction band of the Fe and Ti We also find that a charge transfer from Ti to Fe atoms takes place.

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Quantum Chemical Calculations of the Effect of Si-O Bond Length on X-ray Raman Scattering Features for MgSiO3 Perovskite (양자화학계산을 이용한 Si-O 결합길이가 MgSiO3 페로브스카이트의 X-선 Raman 산란 스펙트럼에 미치는 영향에 대한 연구)

  • Yi, Yoo Soo;Lee, Sung Keun
    • Journal of the Mineralogical Society of Korea
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    • v.27 no.1
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    • pp.1-15
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    • 2014
  • Probing the electronic structures of crystalline Mg-silicates at high pressure is essential for understanding the various macroscopic properties of mantle materials in Earth's interior. Quantum chemical calculations based on the density functional theory are used to explore the atomic configuration and electronic structures of Earth materials at high pressure. Here, we calculate the partial density of states (PDOS) and O K-edge energy-loss near-edge structure (ELNES) spectra for $MgSiO_3$ perovskite at 25 GPa and 120 GPa using the WIEN2k program based on the full-potential linearized projected augmented wave (FP-LPAW) method. The calculated PDOS and O K-edge ELNES spectra for $MgSiO_3$ Pv show significant pressure-induced changes in their characteristic spectral features and relative peak intensity. These changes in spectral features of $MgSiO_3$ Pv indicate that the pressure-induced changes in local atomic configuration around O atoms such as Si-O, O-O, and Mg-O length can induce the significant changes on the local electronic structures around O atoms. The result also indicates that the significant changes in O K-edge features can results from the topological densification at constant Si coordination number. This study can provide a unique opportunity to understand the atomistic origins of pressure-induced changes in local electronic structures of crystalline and amorphous $MgSiO_3$ at high pressure more systematically.

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.