DFT Prediction of Factors Affecting the Structural Characteristics, the Transition Temperature and the Electronic Density of Some New Conjugated Polymers.

Conjugated polymers are promising materials for various cutting-edge technologies, especially for organic conducting materials and in the energy field. In this work, we have synthesized a new conjugated polymer and investigated the effect of distance between bond layers, side-chain functional groups (H, Br, OH, OCH and OCH) on structural characteristics, phase transition temperature (T), and electrical structure of CHOS using Density Functional Theory (DFT). The structural characteristics were determined by the shape, network constant (a, b and c), bond length (C-C, C-H, C-O, C-S, C-Br and O-H), phase transition temperatures, and the total energy (E) on a base cell.

A Refined Simple First-Order Shear Deformation Theory for Static Bending and Free Vibration Analysis of Advanced Composite Plates.

A refined simple first-order shear deformation theory is developed to investigate the static bending and free vibration of advanced composite plates such as functionally graded plates. By introducing the new distribution shape function, the transverse shear strain and shear stress have a parabolic distribution across the thickness of the plates, and they equal zero at the surfaces of the plates. Hence, the new refined theory needs no shear correction factor.

An Efficient Beam Element Based on Quasi-3D Theory for Static Bending Analysis of Functionally Graded Beams.

In this paper, a 2-node beam element is developed based on Quasi-3D beam theory and mixed formulation for static bending of functionally graded (FG) beams. The transverse shear strains and stresses of the proposed beam element are parabolic distributions through the thickness of the beam and the transverse shear stresses on the top and bottom surfaces of the beam vanish. The proposed beam element is free of shear-looking without selective or reduced integration.

A New Beam Model for Simulation of the Mechanical Behaviour of Variable Thickness Functionally Graded Material Beams Based on Modified First Order Shear Deformation Theory.

There are many beam models to simulate the variable thickness functionally graded material (FGM) beam, each model has advantages and disadvantages in computer aided engineering of the mechanical behavior of this beam. In this work, a new model of beam is presented to study the mechanical static bending, free vibration, and buckling behavior of the variable thickness functionally graded material beams. The formulations are based on modified first order shear deformation theory and interpolating polynomials.