• Bulletin of the Korean Chemical Society
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• 제24권11호
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• pp.1649-1654
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• 2003

We have investigated substituent effect on the stabilization energies, and nucleus-independent chemical shifts of pentafulvalenes and on the electronic structures of the corresponding polypentafulvalenes to design environmentally stable semiconductive or conductive polymers. Geometrical optimizations of the molecules were carried out at the density functional level of theory with B3LYP hybrid functional and 6-311+G(d) basis set. Stabilization energies were estimated using isodesmic and homodesmotic reactions. As a criterion of aromaticity nucleus-independent chemical shifts of the molecules were computed using GIAO approach. For the polymers the geometrical parameters were optimized through AM1 band calculations and the electronic structures were obtained through modified extended Huckel band calculations. It is found that strong electronwithdrawing substituents increase isodesmic and homodesmotic stabilization energies of pentafulvalene, though it does not increase the aromaticity. Nitro-substituted pentafulvalene is estimated to have stabilization energy as much as azulene. However, substitution either with electron-donating groups or with electronwithdrawing groups does not significantly affect the electronic structures of polypentafulvalene and poly (vinylenedioxypentafulvalene).

• Steel and Composite Structures
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• 제18권2호
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• pp.325-344
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• 2015

Experimental tests on cellular beams with sinusoidal openings showed two main failure modes around the openings. They concern the formation of four plastic hinges and the local instability of the sinusoidal part of the opening. In parallel, numerical analysis of the sinusoidal part of the opening revealed the existence of an elastic rotational restraint between the intermediate web-post and the adjacent opening panel. The aim of the present study is to present an approach to quantify this rotational restraint. Through the response surface method, a mathematical model is proposed. It shows a great ability to predict the rotational restraint value as a function of the geometrical parameters of the opening. This model can be used to perform an extensive study with various geometrical configurations of beams with the aim to develop a reliable and realistic analytical model predicting the resistance of the sinusoidal openings.

• Structural Engineering and Mechanics
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• 제35권3호
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• pp.349-364
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• 2010

The impact behaviour and the impact-induced damage in laminated composite cylindrical shell subjected to transverse impact by a foreign object are studied using three-dimensional non-linear transient dynamic finite element formulation. A layered version of 20 noded hexahedral element incorporating geometrical non-linearity is developed based on total Langragian approach. Non-linear system of equations resulting from non-linear strain displacement relation and non-linear contact loading are solved using Newton-Raphson incremental-iterative method. Some example problems of graphite/epoxy cylindrical shell panels are considered with variation of impactor and laminate parameters and influence of geometrical non-linear effect on the impact response and the resulting damage is investigated.

• Steel and Composite Structures
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• 제10권2호
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• pp.169-185
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• 2010

The present work describes the experimental tests on steel and lightweight concrete composite beams performed at University of Minho, Portugal. The study involves tests on simply supported composite beams of 4.5 m span, with the same geometrical disposition, supports and materials. The geometrical configuration for the cross section and supports is identical for every beam, varying the shear connectors' distribution and the loading conditions. Headed studs are used to provide the connection between the steel profile and the concrete slab. The parameters in study are the stud disposition and the load distribution. The main objective is to describe the composite beams behaviour, focused on its connection, and to analyse the contribution of the different components to the beams load and deformation capacity. All the tests explored the beams maximum load and deformation capacity and different types of failure were observed.

• 한국가시화정보학회지
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• 제16권3호
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• pp.35-39
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• 2018

In multiphase systems, surface wettability is one of dominant design parameters to enhance system performance. Since surface wettability can be maximized and minimized with micro-textured surfaces, therefore micro-textured surfaces are widely countered in various research and engineering fields. In this study, for better understanding of micrometer scaled surface wettability, spreading phenomena is experimentally investigated on the hydrophilic micro-textured surfaces. By photolithography and conventional dry etching method, there are prepared the surfaces with uniformly arrayed micro-pillars. The interfacial motions of a water droplet on the test sections are visualized by high speed camera in top view. On the basis of visualization data, it is analyzed the relation between dynamic coefficient and geometrical features on micro-textured surfaces.

• Earthquakes and Structures
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• 제16권1호
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• pp.55-67
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• 2019

The finite solutions of deflection and the corresponding in-plane stress values of the graded sandwich shallow shell structure are computed in this research article via a higher-order polynomial shear deformation kinematics. The shell structural equilibrium equation is derived using the variational principle in association with a nine noded isoprametric element (nine degrees of freedom per node). The deflection values are computed via an own customized MATLAB code including the current formulation. The stability of the current finite element solutions including their accuracies have been demonstrated by solving different kind of numerical examples. Additionally, a few numerical experimentations have been conducted to show the influence of different design input parameters (geometrical and material) on the flexural strength of the graded sandwich shell panel including the geometrical configurations.

• Advances in nano research
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• 제13권3호
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• pp.217-231
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• 2022

This study investigates the geometrical impact on the nanomedicine drug delivery via nanodevices. A nanomotor made of the nanotube carrying the drug as the motor blade is considered in the blood flow. Physical activities change the blood flow, and sports training enhances the blood flow and plays a significant role in the stability of drug delivery devices. This paper studies the impact of geometrical parameters on the nanomotors carrying the nanomedicine. The effect of physical exercise on the dynamic response regarding the stability of drug delivery devices is discussed in detail.

• Steel and Composite Structures
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• 제49권1호
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• pp.31-45
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• 2023

The network theory studies interconnection between discrete objects to find about the behavior of a collection of objects. Also, nanomaterials are a collection of discrete atoms interconnected together to perform a specific task of mechanical or/and electrical type. Therefore, it is reasonable to use the network theory in the study of behavior of super-molecule in sport nano-scale. In the current study, we aim to examine vibrational behavior of spherical nanostructured composite with different geometrical and materials properties. In this regard, a specific shear deformation displacement theory, classical elasticity theory and analytical solution to find the natural frequency of the spherical nano-composite sport structure equipment. The analytical results are validated by comparison to finite element (FE). Further, a detail comprehensive results of frequency variations are presented in terms of different parameters. It is revealed that the current methodology provides accurate results in comparison to FE results. On the other hand, different geometrical and weight fraction have influential role in determining frequency of the structure.

• Geomechanics and Engineering
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• 제16권1호
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• pp.21-34
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• 2018

Discontinuities considerably affect the mechanical and hydraulic properties of rock mass. These properties of the rock mass are influenced by the geometry of the discontinuities to a great extent. This paper aims to render an account of the geometrical parameters of several discontinuity sets related to the surrounding rock mass of Rudbar Lorestan Pumped Storage Power Plant powerhouse cavern making use of the linear and areal (circular and rectangular) sampling methods. Taking into consideration quite a large quantity of scanline and the window samplings used in this research, it was realized that the areal sampling methods are more time consuming and cost-effective than the linear methods. Having corrected the biases of the geometrical properties of the discontinuities, density (areal and volumetric) as well as the linear, areal and volumetric intensity accompanied by the other properties related to four sets of discontinuities were computed. There is an acceptable difference among the mean trace lengths measured using two linear and areal methods for the two joint sets. A 3D discrete fracture network generation code (3DFAM) has been developed to model the fracture network based on the mapped data. The code has been validated on the basis of numerous geometrical characteristics computed by use of the linear, areal sampling methods and volumetric method. Results of the linear sampling method have significant variations. So, the areal and volumetric methods are more efficient than the linear method and they are more appropriate for validation of 3D DFN (Discrete Fracture Network) codes.

• Structural Engineering and Mechanics
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• 제50권5호
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• pp.697-708
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• 2014

The intentional buckling design of micro-films has various potential applications in engineering. The buckling amplitude and critical strain of micro-films are the crucial parameters for the buckling design. In the reported studies, the film parameters were regarded as deterministic. However, the geometrical and physical parameters uncertainty of micro-films due to manufacturing becomes prominent and needs to be considered. In the present paper, the probabilistic nonlinear buckling analysis of micro-films with uncertain parameters is proposed for design accuracy and reliability. The nonlinear differential equation and its asymptotic solution for the buckling micro-film with nominal parameters are firstly established. The mean values, standard deviations and variation coefficients of the buckling amplitude and critical strain are calculated by using the probability densities of uncertain parameters such as the film span length, thickness, elastic modulus and compressive force, to reveal the effects of the film parameter uncertainty on the buckling deformation. The results obtained illustrate the probabilistic relation between buckling deformation and uncertain parameters, and are useful for accurate and reliable buckling design in terms of probability.