• Title/Summary/Keyword: Semi-empirical Method

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Comparative analysis on uniform designs of female flight attendant among low cost carriers in South Korea and Asian region (한국과 아시아 지역 저가 항공사 여승무원의 유니폼 디자인 비교 분석)

  • Kim, Sun Young
    • The Research Journal of the Costume Culture
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    • v.23 no.2
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    • pp.176-192
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    • 2015
  • This work aims at analyzing the comparative feature about female flight attendant uniform designs of Korean and Asian region low cost carriers and providing some basic materials for development of these airline companies. As a research method, examinations were carried out on attendant's uniform both theoretically and empirically. Comparison of uniforms was made among the five Korean carriers and ten typical Asian carriers for empirical research. Results showed the followings. First, all Korean low cost carriers were characterized as formal style except Jin Air. Unlike this, Asian low cost carriers appeared as diverse including formal, semi formal, and casual styles with a uniquely differentiated image. Second, all carriers applied their own symbolic color to their uniform. Third, logo or symbol was adopted as a pattern on scarf in the two Korean companies but it didn't take effect practically. For those Asian carriers, embroidery was used on jacket, jumper and collar. They utilized even a merchandising character to put emphasis on airline image. Fourth, diverse petty items with a decorative effect were used in the case of Korean low cost carriers. In the changing period of uniform, nothing much was changed and remained almost the same as before. Those in the Asian region were characterized with the smallest number of items and the preclusion of decorative add-ons on uniform.

Experimental and ab initio Computational Studies on Dimethyl-(4-{4-{3-methyl-3-phenyl-cyclobutyl)-thiazol-2-yl]-hydrazonomethyl}-phenyl)-amine

  • Yuksektepe, Cigdem;Saracoglu, Hanife;Caliskan, Nezihe;Yilmaz, Ibrahim;Cukurovali, Alaaddin
    • Bulletin of the Korean Chemical Society
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    • v.31 no.12
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    • pp.3553-3560
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    • 2010
  • A new hydrazone derivative compound has been synthesized and characterized by IR, $^1H$-NMR, $^{13}C$-NMR and UV-vis. spectroscopy techniques, elemental analysis and single-crystal X-ray diffraction (XRD). The new compound crystallizes in monoclinic space group C2/c. In addition to the crystal structure from X-ray experiment, the molecular geometry, vibrational frequencies and frontier molecular orbitals analysis of the title compound in the ground state have been calculated by using the HF/6-31G(d, p), B3LYP/6-311G(d, p) and B3LYP/6-31G(d, p) methods. The computed vibrational frequencies are used to determine the types of molecular motions associated with each of the observed experimental bands. To determine conformational flexibility, molecular energy profile of (1) was obtained by semi-empirical (AM1) calculation with respect to a selected degree of torsional freedom, which was varied from $-180^{\circ}$ to $+180^{\circ}$ in steps of $10^{\circ}$. Molecular electrostatic potential of the compound was also performed by the theoretical method.

An Improved Heat Transfer Prediction Model for Turbulent Falling Liquid Films with or Without Interfacial Shear (계면 전단응력이 있을 때와 없을 때 하강하는 난류액막에 대한 개선된 열전달 예측 모델)

  • Park, Seok-Jeong;Chun, Moon-Hyun
    • Nuclear Engineering and Technology
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    • v.27 no.2
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    • pp.189-202
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    • 1995
  • An improved method is presented for the prediction of heat transfer coefficients in turbulent fall-ing liquid films with or without interfacial shear for both heating or condensation. A modified Mudawwar and El-Masri's semi-empirical turbulence model, particularly to extend its use for the turbulent falling film with high interfacial shear, is used to replace the eddy viscosity model incorporated in the unified approach unposed by Yih and Liu. The liquid film thickness and asymptotic heat transfer coefficients against the film Reynolds number for wide range of interfacial shear predicted by both present and existing methods are compared with experimental data. The results show that in general, predictions of the modified model agee more closely with experimental data than that of existing models.

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Surface Tension of Molten Ag-Sn and Au-Cu Alloys at Different Oxygen Partial Pressures (다양한 산소분압에 따른 용융 Ag-Sn 및 Ag-Cu 합금의 표면장력)

  • Min, Soon-Ki;Lee, Joon-Ho
    • Korean Journal of Materials Research
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    • v.19 no.1
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    • pp.13-17
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    • 2009
  • A semi-empirical method to estimate the surface tension of molten alloys at different oxygen partial pressures is suggested in this study. The surface tension of molten Ag-Sn and Ag-Cu alloys were calculated using the Butler equation with the surface tension value of pure substance at a given oxygen partial pressure. The oxygen partial pressure ranges were $2.86{\times}10^{-12}$$1.24{\times}10^{-9}$ Pa for the Ag-Sn system and $2.27{\times}10^{-11}$$5.68{\times}10^{-4}$ Pa for the Ag-Cu system. In this calculation, the interactions of the adsorbed oxygen with other metallic constituents were ignored. The calculated results of the Ag-Sn alloys were in reasonable accordance with the experimental data within a difference of 8%. For the Ag-Cu alloy system at a higher oxygen partial pressure, the surface tension initially decreased but showed a minimum at $X_{Ag}$ = 0.05 to increase as the silver content increased. This behavior appears to be related to the oxygen adsorption and the corresponding surface segregation of the constituent with a lower surface tension. Nevertheless, the calculated results of the Ag-Cu alloys with the present model were in good agreement with the experimental data within a difference of 10%.

Quantum-chemical Study of Effects of Alkoxy Substitution on the Conformations and Electronic Properties of Poly(p-phenylenevinylenes)

  • Hong, Sung Y.
    • Bulletin of the Korean Chemical Society
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    • v.20 no.1
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    • pp.42-48
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    • 1999
  • We have performed a quantum-chemical investigation on the conformations and electronic properties of a variety of methoxy-substituted poly(p-phenylenevinylenes) (PPVs) to elucidate the effects of alkoxy substitution. Geometrical parameters for the polymers were fully optimized through Austin Model I (AM I) semi-empirical Hartree-Fock (HF) band calculations. Electronic properties of the polymers were obtained by applying the AM I optimized structures to the modified extended Huckel method. To confirm validity of the AM I conformational results, we also carried out ab initio HF calculations with the 6-31G (d) basis set for a variety of methoxy-substituted divinylbenzenes. It is found that the potential energy surfaces of alkoxy-substituted PPVs are quite shallow around the planar conformations, suggesting that the prepared films possess a variety of conformations with different torsion angle in the solid state, depending on the synthetic conditions. When two alkoxy groups are concurrently substituted at the adjacent sites in the phenylene ring, these groups are subject to rotating around the C(sp2)-O bonds by 70-80° to avoid the strong steric repulsion between them. Consequently, the overlap between the π-type p orbital of oxygen and the π molecular orbitals of the polymer decreases. This leads to a wide gap and a high oxidation potential for tetramethoxy-substituted PPV, compared to those of dialkoxy-substituted PPV.

Synthesis, spectral, thermal, structural study and theoretical treatment of new complexes of mannich base with Ni(II) and study of cytotoxicity effect on (Hepa-2) cell line and antimicrobial activity

  • Omar H. Al-Obaidi
    • Analytical Science and Technology
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    • v.36 no.2
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    • pp.70-79
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    • 2023
  • The synthesis of the Mannich base as a ligand (L) N-(morpholino (phenyl) methyl) acetamide is the subject of this study. Elemental analyses, FT-IR spectra, UV-vis, 1H-NMR, and magnetic measurements were used to confirm the synthesis of the [Ni(L)2]Cl2 complex, thermal analysis (TG/DTG), atomic absorption, and scanning, and structurally explained as electron microscopy (SEM), and X-ray powder diffraction (XRD) methods. The melting point of the complex and its molar conductivity were also measured. The suggested geometries of the complexes formed have a tetrahedral structure, according to the data acquired using various techniques. Theoretical approaches to the complex formation have been investigated. For molecular mechanics and semi-empirical calculations, the HYPERCHEM6 program had been used. The effect of the novel Ni(II) complex on the cancer cell Hepa-2 (human hepatocellular ademocarcinoma), that is the human laryngeal cancer, was studied. It has been found that these ligand and complex have potent effects on the cancer cell. The antibacterial activity of the free ligand and its complex was evaluated against two kinds of human pathogenic bacteria. The first category is Gram-positive (Staphylococcus aureas, epiderimids), whereas the second group is Gram-negative (Psedamonas aeruginosa, Escherichia coli) (from the diffusion method). Finally, it was discovered that various chemicals had varied growth-inhibiting effects on bacteria.

An Experimental Study on Ventilated Supercavitation of the Disk Cavitator (원판 캐비테이터의 환기 초공동에 대한 실험적 연구)

  • Kim, Byeung-Jin;Choi, Jung-Kyu;Kim, Hyoung-Tae
    • Journal of the Society of Naval Architects of Korea
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    • v.52 no.3
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    • pp.236-247
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    • 2015
  • In this paper, the experimental equipments for ventilated supercavitation in cavitation tunnel is constructed and the basic data of ventilated supercavitation regard to the entrainment coefficient and Froude number is fulfilled. The experiments are conducted for the disk cavitator with injecting air and the pressure inside cavity and the shape of cavity are measured. As the entrainment coefficient increases while the Froude number is kept constant, the ventilated cavitation number decreases to a minimum value which decreases no more even with increasing the air entrainment. The minimum value of ventilated cavitation number, caused by the blockage effect, decreases according to increasing the diameter ratio of test section to cavitator. The cavity length is rapidly enlarged near the minimum cavitation number. In low Froude numbers, the cavity tail is floating up due to buoyancy and the air inside the cavity is evacuated from its rear end with twin-vortex hollow tubes. However, in high Froude numbers, the buoyancy effect is almost negligible and there is no more twin-vortex tubes so that the cavity shape becomes close to axisymmetric. In order to measure the cavity length and width, the two methods, which are to be based on the cavity shapes and the maximum width of cavity, are applied. As the entrainment coefficient increases after the ventilated cavitation number gets down to the minimum cavitation number, the cavity length still increases gradually. These phenomenon can be confirmed by the measurement using the method based on the cavity shapes. On the other hand, when the method based on the maximum width of cavity is used, the length and width of the cavity agree well with a semi-empirical formular of natural cavity. So the method based on the maximum width of cavity can be a valid method for cavitator design.

Direct Strength Evaluation of the CVD SiC Coating of TRISO Coated Fuel Particle with Micro Hemi Spherical Shell Configuration (마이크로 반구 쉘 형상의 화학증착 탄화규소 TRISO 코팅층의 파괴강도 직접평가)

  • Lee, Hyeon-Keun;Kim, Do-Kyung
    • Journal of the Korean Ceramic Society
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    • v.44 no.7
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    • pp.368-374
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    • 2007
  • CVD-SiC coating has been introduced as a protective layer in TRISO nuclear fuel particle of high temperature gas cooled reactor (HTGR) due to its excellent mechanical stability at high temperature. In order to prevent the failure of the TRISO particles, it is important to evaluate the fracture strength of the SiC coating layer. It is needed to develop a new simple characterization technique to evaluate the mechanical properties of the coating layer as a pre-irradiation step. In present work, direct strength measurement method with the specimen of hem i-spherical shell configuration was suggested. The indentation experiment on a hemisphere shell with a plate indenter was conducted. The fracture strength of the coating layer is related with the critical load for radial cracking of the shell. The finite element analysis was used to drive the semi-empirical equation for the strength measurement. The SiC hemispherical shells were successfully recovered from the section-grinding of TRISO coated particle and successive heat treatment in air. The strength of CVD-SiC coating layer was evaluated from the experimentally measured critical load during the indentation on SiC hemisphere shell. Weibull diagram of fracture strength was also constructed. This study suggested a new strength equation and experimental method to measure the fracture strength of CVD-SiC coating of TRISO coated fuel particles.

An External Shape Optimization Study to Maximize the Range of a Guided Missile in Atmospheric Flight (대기권을 비행하는 유도 미사일의 최대 사거리 구현을 위한 외형 형상 최적화 시스템 연구)

  • Yang, Young-Rok;Hu, Sang-Bum;Je, So-Yeong;Park, Chan-Woo;Myong, Rho-Shin;Cho, Tae-Hwan;Hwang, Ui-Chang;Je, Sang-Eon
    • Journal of the Korean Society for Aeronautical & Space Sciences
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    • v.37 no.6
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    • pp.519-526
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    • 2009
  • This paper describes a research result of a external shape optimization study to maximize the range of the guided missile with canards and tailfins in atmospheric flight. For this purpose, the external shape optimization program which can enhance the range of a missile was developed, incorporated with the trajectory analysis and the optimization technique. In the trajectory analysis part, Missile DATCOM which utilizes the semi-empirical method was directly connected to the trajectory code to supply the aerodynamic coefficients efficiently at every time step. In the gliding flight trajectory after apogee, a maximum $C_L/C_D$ trim condition calculation module was attached under the assumption of the missile continuously flying at maximum $C_L/C_D$ condition. In the optimization part, a Response Surface Method(RSM) was adopted to reduce the computing time.

Prediction of Wave Breaking Using Machine Learning Open Source Platform (머신러닝 오픈소스 플랫폼을 활용한 쇄파 예측)

  • Lee, Kwang-Ho;Kim, Tag-Gyeom;Kim, Do-Sam
    • Journal of Korean Society of Coastal and Ocean Engineers
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    • v.32 no.4
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    • pp.262-272
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    • 2020
  • A large number of studies on wave breaking have been carried out, and many experimental data have been documented. Moreover, on the basis of various experimental data set, many empirical or semi-empirical formulas based primarily on regression analysis have been proposed to quantitatively estimate wave breaking for engineering applications. However, wave breaking has an inherent variability, which imply that a linear statistical approach such as linear regression analysis might be inadequate. This study presents an alternative nonlinear method using an neural network, one of the machine learning methods, to estimate breaking wave height and breaking depth. The neural network is modeled using Tensorflow, a machine learning open source platform distributed by Google. The neural network is trained by randomly selecting the collected experimental data, and the trained neural network is evaluated using data not used for learning process. The results for wave breaking height and depth predicted by fully trained neural network are more accurate than those obtained by existing empirical formulas. These results show that neural network is an useful tool for the prediction of wave breaking.