Prediction of liquid crystalline properties of poly(1,4-phenylene sebacate-oxybenzoate) by Monte Carlo simulation

Polymer ◽  
2005 ◽  
Vol 46 (6) ◽  
pp. 2003-2010 ◽  
Author(s):  
Dumitru Pavel ◽  
Irene Yarovsky ◽  
Robert Shanks
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Liquid Crystalline

Modelling Microstructiure in Materials that Contain Anisotropic Particles

1989 ◽  
Vol 175 ◽  
Author(s):  
Christopher Viney ◽  
Larry A. Chick
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Phase Separation ◽  
Thermodynamic Analysis ◽  
Crystalline Phase ◽  
Lattice Model ◽  
Liquid Crystalline ◽  
Anisotropic Particles ◽  
Starting Point ◽  
Evolution Of Microstructure

AbstractThe spontaneous alignment of molecules in liquid crystalline solutions is characteristic of other materials that contain rodlike particles. We are developing a model to predict the evolution of microstructure in these systems. Its starting point is Flory's thermodynamic analysis of liquid crystalline phase separation. Our preferred method dispenses with the traditional lattice model in favor of a Monte Carlo simulation to calculate entropy. Some advantages and consequences of our approach are explored in this paper

Monte Carlo Simulation of the Liquid-Crystalline Ordering of Semiflexible Polymers

1985 ◽  
Vol 130 (1-2) ◽  
pp. 195-202 ◽  
Author(s):  
P. G. Khalatur ◽  
Yu. G. Papulov ◽  
Svetlana G. Pletneva
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Liquid Crystalline ◽  
Semiflexible Polymers

Electron Scattering in Solids

1990 ◽  
Vol 48 (2) ◽  
pp. 4-5
Author(s):  
Ryuichi Shimizu ◽  
Ze-Jun Ding
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Angular Distribution ◽  
Elastic Scattering ◽  
Electron Scattering ◽  
Cross Sections ◽  
Expansion Method ◽  
Electron Excitation ◽  
Partial Wave Expansion ◽  
Backscattered Electrons

Monte Carlo simulation has been becoming most powerful tool to describe the electron scattering in solids, leading to more comprehensive understanding of the complicated mechanism of generation of various types of signals for microbeam analysis.The present paper proposes a practical model for the Monte Carlo simulation of scattering processes of a penetrating electron and the generation of the slow secondaries in solids. The model is based on the combined use of Gryzinski’s inner-shell electron excitation function and the dielectric function for taking into account the valence electron contribution in inelastic scattering processes, while the cross-sections derived by partial wave expansion method are used for describing elastic scattering processes. An improvement of the use of this elastic scattering cross-section can be seen in the success to describe the anisotropy of angular distribution of elastically backscattered electrons from Au in low energy region, shown in Fig.l. Fig.l(a) shows the elastic cross-sections of 600 eV electron for single Au-atom, clearly indicating that the angular distribution is no more smooth as expected from Rutherford scattering formula, but has the socalled lobes appearing at the large scattering angle.

Determination of Stoichiometry of GaAs Component in (Gaas)Ge Epitaxially Grown Thin Films by Electron Microprobe X-Ray Analysis

1990 ◽  
Vol 48 (2) ◽  
pp. 264-265
Author(s):  
D. R. Liu ◽  
S. S. Shinozaki ◽  
R. J. Baird
Keyword(s):  
Thin Film ◽  
Thin Films ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Compound Semiconductors ◽  
Energy Dispersive Analysis ◽  
X Ray ◽  
Metastable Alloys ◽  
Lower Voltage

The epitaxially grown (GaAs)Ge thin film has been arousing much interest because it is one of metastable alloys of III-V compound semiconductors with germanium and a possible candidate in optoelectronic applications. It is important to be able to accurately determine the composition of the film, particularly whether or not the GaAs component is in stoichiometry, but x-ray energy dispersive analysis (EDS) cannot meet this need. The thickness of the film is usually about 0.5-1.5 μm. If Kα peaks are used for quantification, the accelerating voltage must be more than 10 kV in order for these peaks to be excited. Under this voltage, the generation depth of x-ray photons approaches 1 μm, as evidenced by a Monte Carlo simulation and actual x-ray intensity measurement as discussed below. If a lower voltage is used to reduce the generation depth, their L peaks have to be used. But these L peaks actually are merged as one big hump simply because the atomic numbers of these three elements are relatively small and close together, and the EDS energy resolution is limited.

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