scholarly journals Combustion synthesis of metal carbides: Part II. Numerical simulation and comparison with experimental data

2005 ◽  
Vol 20 (5) ◽  
pp. 1269-1277 ◽  
Author(s):  
A.M. Locci ◽  
A. Cincotti ◽  
F. Delogu ◽  
R. Orrù ◽  
G. Cao
Keyword(s):  
Experimental Data ◽  
Combustion Synthesis ◽  
Quantitative Description ◽  
Scale Model ◽  
Metal Carbides ◽  
Fitting Procedure ◽  
High Temperature Synthesis ◽  
Complex Picture ◽  
Model Reliability ◽  
Physical And Chemical

Based on the general theoretical model proposed in Part I of this work [J. Mater. Res. 20, 1257 (2005)], a series of numerical simulations related to the self-propagating high-temperature synthesis in the Ti–C system is presented. A detailed and quantitative description of the various physical and chemical processes that take place during combustion synthesis processes is provided in Part II of this work. In particular, the proposed mathematical description of the system has been discussed by highlighting the relation between system macroscopic behavior obtained experimentally with the modeled phenomena taking place at the microscopic scale. Model reliability is tested by comparison with suitable experimental data being nucleation parameters adopted for the fitting procedure. The complex picture emerging as a result of the model sophistication indicates that the rate of conversion is essentially determined by the rate of nucleation and growth. In addition, comparison between model results and experimental data seems to confirm the occurrence of heterogeneous nucleation in product crystallization.

A micromechanistic model of the combustion synthesis process: Part II. Numerical simulation

1994 ◽  
Vol 9 (10) ◽  
pp. 2605-2619 ◽  
Author(s):  
Yangsheng Zhang ◽  
Gregory C. Stangle
Keyword(s):  
Theoretical Model ◽  
Combustion Synthesis ◽  
Quantitative Description ◽  
Computer Experiments ◽  
The Self ◽  
Synthesis Process ◽  
Energy Redistribution ◽  
Precise Control ◽  
Physical And Chemical ◽  
Proper Balance

A series of computer experiments was conducted for the self-propagating combustion synthesis process in the Nb-C system, based on the general theoretical model that was developed previously.1 A detailed and quantitative description was given for the various physical and chemical processes that take place during the combustion synthesis process. The results are presented at various length scales in order to provide an insight into understanding the mechanisms that are responsible for the self-propagating behavior. It was shown that a fundamental understanding and precise control of the process require a strong emphasis on the joint contributions of the rates of the various mass and energy redistribution processes that occur during the combustion synthesis process. A proper balance of each of the elementary process rates must be achieved to give rise to self-propagating behavior. This paper illustrates some of the capabilities of the general theoretical model in quantitatively describing the self-propagating combustion synthesis process.

scholarly journals Combustion synthesis of metal carbides: Part I. Model development

2005 ◽  
Vol 20 (5) ◽  
pp. 1257-1268 ◽  
Author(s):  
A.M. Locci ◽  
A. Cincotti ◽  
F. Delogu ◽  
R. Orrù ◽  
G. Cao
Keyword(s):  
Mathematical Model ◽  
Combustion Synthesis ◽  
Model Development ◽  
Pure Metal ◽  
Metal Carbides ◽  
Reaction Products ◽  
High Temperature Synthesis ◽  
Suitable Combination ◽  
Definition Of ◽  
Population Balances

The definition of a rigorous theoretical framework for the appropriate physico-chemical description of self-propagating high-temperature synthesis (SHS) processes represents the main goal of this work which is presented in two sequential articles. In this article, a novel mathematical model to simulate SHS processes is proposed. By adopting a heterogeneous approach for the description of mass transfer phenomena, the model is based on appropriate mass and energy conservation equations for each phase present during the system evolution. In particular, it takes microstructural evolution into account using suitable population balances and properly evaluating the differentdriving forces from the relevant phase diagram. The occurrence of phase transitionsis treated on the basis of the so-called enthalpy approach, while a conventional nucleation-and-growth mechanistic scenario is adopted to describe quantitatively the formation of reaction products. The proposed mathematical model may be applied to the case of combustion synthesis processes involving a low melting point reactant and a refractory one, as for the synthesis of transition metal carbides from pure metal and graphite. Thus, the model can be profitably used to gain a deeper insight into the microscopic elementary phenomena involved in combustion synthesis processes through a suitable combination of experimental and modeling investigations, as it may be seen in Part II of this work [J. Mater. Res. 20, 1269 (2005)].

Seeking the Good Fitting Procedure of PALS Polymer Spectra

2008 ◽  
Vol 607 ◽  
pp. 64-66
Author(s):  
Nicolas Laforest ◽  
Jérémie De Baerdemaeker ◽  
Corine Bas ◽  
Charles Dauwe
Keyword(s):  
Experimental Data ◽  
Low Temperature ◽  
Positron Annihilation ◽  
Physical Meaning ◽  
Lifetime Measurements ◽  
Positron Annihilation Lifetime ◽  
Fitting Procedure ◽  
Fitting Procedures ◽  
Blob Model

Positron annihilation lifetime measurements on polymethylmethacrylate (PMMA) at low temperature were performed. Different discrete fitting procedures have been used to analyze the experimental data. It shows that the extracted parameters depend strongly on the fitting procedure. The physical meaning of the results is discussed. The blob model seems to give the best annihilation parameters.

Dual percolations of electrical conductivity and electromagnetic interference shielding in progressively agglomerated CNT/polymer nanocomposites

2021 ◽  
pp. 108128652110214
Author(s):  
Xiaodong Xia ◽  
George J. Weng
Keyword(s):  
Experimental Data ◽  
Electrical Conductivity ◽  
Carbon Nanotube ◽  
Percolation Threshold ◽  
Polymer Nanocomposites ◽  
Electromagnetic Interference ◽  
Effective Medium Theory ◽  
Scale Model ◽  
Shielding Effectiveness ◽  
Emi Shielding

Recent experiments have revealed two distinct percolation phenomena in carbon nanotube (CNT)/polymer nanocomposites: one is associated with the electrical conductivity and the other is with the electromagnetic interference (EMI) shielding. At present, however, no theories seem to exist that can simultaneously predict their percolation thresholds and the associated conductivity and EMI curves. In this work, we present an effective-medium theory with electrical and magnetic interface effects to calculate the overall conductivity of a generally agglomerated nanocomposite and invoke a solution to Maxwell’s equations to calculate the EMI shielding effectiveness. In this process, two complex quantities, the complex electrical conductivity and complex magnetic permeability, are adopted as the homogenization parameters, and a two-scale model with CNT-rich and CNT-poor regions is utilized to depict the progressive formation of CNT agglomeration. We demonstrated that there is indeed a clear existence of two separate percolative behaviors and showed that, consistent with the experimental data of poly-L-lactic acid (PLLA)/multi-walled carbon nanotube (MWCNT) nanocomposites, the electrical percolation threshold is lower than the EMI shielding percolation threshold. The predicted conductivity and EMI shielding curves are also in close agreement with experimental data. We further disclosed that the percolative behavior of EMI shielding in the overall CNT/polymer nanocomposite can be illustrated by the establishment of connective filler networks in the CNT-poor region. It is believed that the present research can provide directions for the design of CNT/polymer nanocomposites in the EMI shielding components.

Validating Numerical CFD Simulations With Experimental Data for Turbulence Phenomena in Axial Flow Gas Turbine Diffusers

2009 ◽  
Author(s):  
Farrokh Zarifi-Rad ◽  
Hamid Vajihollahi ◽  
James O’Brien
Keyword(s):  
Experimental Data ◽  
Gas Turbine ◽  
Turbine Blades ◽  
Axial Flow ◽  
Experimental Results ◽  
Scale Model ◽  
Data Set ◽  
Pressure Profiles ◽  
Scale Models ◽  
Inlet Conditions

Scale models give engineers an excellent understanding of the aerodynamic behavior behind their design; nevertheless, scale models are time consuming and expensive. Therefore computer simulations such as Computational Fluid Dynamics (CFD) are an excellent alternative to scale models. One must ask the question, how close are the CFD results to the actual fluid behavior of the scale model? In order to answer this question the engineering team investigated the performance of a large industrial Gas Turbine (GT) exhaust diffuser scale model with performance predicted by commercially available CFD software. The experimental results were obtained from a 1:12 scale model of a GT exhaust diffuser with a fixed row of blades to simulate the swirl generated by the last row of turbine blades five blade configurations. This work is to validate the effect of the turbulent inlet conditions on an axial diffuser, both on the experimental front and on the numerical analysis approach. The object of this work is to bring forward a better understanding of velocity and static pressure profiles along the gas turbine diffusers and to provide an accurate experimental data set to validate the CFD prediction. For the CFD aspect, ANSYS CFX software was chosen as the solver. Two different types of mesh (hexagonal and tetrahedral) will be compared to the experimental results. It is understood that hexagonal (HEX) meshes are more time consuming and more computationally demanding, they are less prone to mesh sensitivity and have the tendancy to converge at a faster rate than the tetrahedral (TET) mesh. It was found that the HEX mesh was able to generate more consistent results and had less error than TET mesh.

Multi-scale model of a top-fired steam methane reforming reactor and validation with industrial experimental data

2022 ◽  
Vol 428 ◽  
pp. 131492
Author(s):  
Valeria Tacchino ◽  
Paola Costamagna ◽  
Silvia Rosellini ◽  
Valter Mantelli ◽  
Alberto Servida
Keyword(s):  
Experimental Data ◽  
Scale Model ◽  
Methane Reforming ◽  
Steam Methane Reforming ◽  
Multi Scale ◽  
Steam Methane

Development and Assessment of a Total Resistance Optimized Bow for the AE 36

1994 ◽  
Vol 31 (02) ◽  
pp. 149-160
Author(s):  
Donald C. Wyatt ◽  
Peter A. Chang
Keyword(s):  
Experimental Data ◽  
Optimization Procedure ◽  
Wave Resistance ◽  
Scale Model ◽  
Optimization Approach ◽  
Nonlinear Constraints ◽  
Total Resistance ◽  
Hull Form ◽  
Final Design ◽  
Resistance Data

A numerically optimized bow design is developed to reduce the total resistance of a 23 000 ton ammunition ship (AE 36) at a speed of 22 knots. An optimization approach using slender-ship theory for the prediction of wave resistance is developed and applied. The new optimization procedure is an improvement over previous optimization methodologies in that it allows the use of nonlinear constraints which assure that the final design remains within practical limits from construction and operational perspectives. Analytic predictions indicate that the AE 36 optimized with this procedure will achieve a 40% reduction in wave resistance and a 33% reduction in total resistance at 22 knots relative to a Kracht elliptical bulb bow design. The optimization success is assessed by the analysis of 25th scale model resistance data collected at the David Taylor Research Center deepwater towing basin. The experimental data indicate that the optimized hull form yields a 51% reduction in wave resistance and a 12% reduction in total resistance for the vessel at 22 knots relative to the Kracht bulb bow design. Similarly encouraging results are also observed when comparisons are made with data collected on two other conventionally designed AE 36 designs.

scholarly journals A thermodynamic description of metastable c-TiAlZrN coatings with triple spinodally decomposed domains

2017 ◽  
Vol 53 (2) ◽  
pp. 85-93 ◽  
Author(s):  
J. Zhou ◽  
L. Zhang ◽  
L. Chen ◽  
Y. Du ◽  
Z.K. Liu
Keyword(s):  
Experimental Data ◽  
Phase Equilibria ◽  
First Principles ◽  
Thermodynamic Description ◽  
Quantitative Description ◽  
Experimental Phase Equilibria ◽  
Free Energies ◽  
Calphad Technique ◽  
Important Input ◽  
Good Agreement

A critical thermodynamic assessment of the metastable c-TiAlZrN coatings, which are reported to spinodally decompose into triple domains, i.e., c-TiN, c-AlN, and c-ZrN, was performed via the CALculation of PHAse Diagram (CALPHAD) technique based on the limited experimental data as well as the first-principles computed free energies. The metastable c-TiAlZrN coatings were modeled as a pseudo-ternary phase consisting of c-TiN, c-AlN and c-ZrN species, and described using the substitutional solution model. The thermodynamic descriptions for the three boundary binaries were directly taken from either the CALPHAD assessment or the first-principles results available in the literature except for a re-adjustment of the pseudo-binary c-AlN/c-ZrN system based on the experimental phase equilibria in the pseudo-ternary system. The good agreement between the calculated phase equilibria and the experimental data over the wide temperature range was obtained, validating the reliability of the presently obtained thermodynamic descriptions for the c-TiAlZrN system. Based on the present thermodynamic description, different phase diagrams and thermodynamic properties can be easily predicted. It is anticipated that the present thermodynamic description of the metastable c-TiAlZrN coatings can serve as the important input for the later quantitative description of the microstructure evolution during service life.

scholarly journals Gene conversion: observations on the DNA hybrid models

1970 ◽  
Vol 15 (1) ◽  
pp. 55-64 ◽  
Author(s):  
Andrzej Paszewski
Keyword(s):  
Experimental Data ◽  
Gene Conversion ◽  
Hybrid Models ◽  
Crossing Over ◽  
Meiotic Segregation ◽  
Tetrad Analysis ◽  
Dna Models ◽  
Complex Picture ◽  
New Hypothesis ◽  
Hybrid Dna

SUMMARYSome features of gene conversion in fungi and their bearing on the hybrid DNA models are discussed. Available experimental data from tetrad analysis seem to give a more complex picture of polarity in intra-genic recombination and of the relations between conversion and post-meiotic segregation, and between conversion and crossing-over, than predicted by the models.A new hypothesis of the mechanism of gene conversion with special attention given to the aspect of asymmetry in this phenomenon is proposed as an alternative to the mechanism suggested by the DNA hybrid models.

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