Thermosonic wire bonding of gold wire onto copper pad using the saturated interfacial phenomena

Science.gov (United States)

Jeng, Yeau-Ren; Aoh, Jong-Hing; Wang, Chang-Ming

2001-12-01

Copper has been used to replace conventional aluminium interconnection to improve the performance of deep submicron integrated circuits. This study used the saturated interfacial phenomena found in thermosonic ball bonding of gold wire onto aluminium pad to investigate thermosonic ball bonding of gold wire onto copper pad. The effects of preheat temperatures and ultrasonic powers on the bonding force were investigated by using a thermosonic bonding machine and a shear tester. This work shows that under proper preheat temperatures, the bonding force of thermosonic wire bonding can be explained based on interfacial microcontact phenomena such as energy intensity, interfacial temperature and real contact area. It is clearly shown that as the energy intensity is increased, the shear force increases, reaches a maximum, and then decreases. After saturation, i.e. the establishment of maximum atomic bonding, any type of additional energy input will damage the bonding, decreasing the shear force. If the preheat temperature is not within the proper range, the interfacial saturation phenomenon does not exist. For a preload of 0.5 N and a welding time of 15 ms in thermosonic wire bonding of gold wire onto copper pads, a maximum shear force of about 0.33 N is found where the interfacial energy intensity equals 1.8×106 J m-2 for preheat temperatures of 150°C and 170°C. Moreover, the corresponding optimal ultrasonic power is about 110 units.

Interfacial area transport of bubbly flow in a small diameter pipe

International Nuclear Information System (INIS)

Hibiki, Takashi; Takamasa, Tomoji; Ishii, Mamoru

2001-01-01

In relation to the development of the interfacial area transport equation, this study focused on modeling of the interfacial area transport mechanism of vertical adiabatic air-water bubbly flows in a relatively small diameter pipe where the bubble size-to-pipe diameter ratio was relatively high and the radial motion of bubbles was restricted by the presence of the pipe wall. The sink term of the interfacial area concentration was modeled by considering wake entrainment as a possible bubble coalescence mechanism, whereas the source term was neglected by assuming negligibly small bubble breakup for low liquid velocity conditions based on visual observation. One-dimensional interfacial area transport equation with the derived sink term was evaluated by using five datasets of vertical adiabatic air-water bubbly flows measured in a 9.0 mm-diameter pipe (superficial gas velocity: 0.013-0.052 m/s, superficial liquid velocity: 0.58-1.0 m/s). The modeled interfacial area transport equation could reproduce the proper trend of the axial interfacial area transport and predict the measured interfacial area concentrations within an average relative deviation of ±11.1%. It was recognized that the present model would be promising for predicting the interfacial area transport of the examined bubbly flows. (author)

Transport phenomena

International Nuclear Information System (INIS)

Kirczenow, G.; Marro, J.

1974-01-01

Some simple remarks on the basis of transport theory. - Entropy, dynamics and scattering theory. - Response, relaxation and fluctuation. - Fluctuating hydrodynamics and renormalization of susceptibilities and transport coefficients. - Irreversibility of the transport equations. - Ergodic theory and statistical mechanics. - Correlation functions in Heisenberg magnets. - On the Enskog hard-sphere kinetic eqquation and the transport phenomena of dense simple gases. - What can one learn from Lorentz models. - Conductivity in a magnetic field. - Transport properties in gases in presence of external fields. - Transport properties of dilute gases with internal structure. (orig.) [de

An Implementation of Interfacial Transport Equation into the CUPID code

Energy Technology Data Exchange (ETDEWEB)

Park, Ik Kyu; Cho, Heong Kyu; Yoon, Han Young; Jeong, Jae Jun

2009-11-15

A component scale thermal hydraulic analysis code, CUPID (Component Unstructured Program for Interfacial Dynamics), is being developed for the analysis of components for a nuclear reactor, such as reactor vessel, steam generator, containment, etc. It adopted a three-dimensional, transient, two phase and three-field model. In order to develop the numerical schemes for the three-field model, various numerical schemes have been examined including the SMAS, semi-implicit ICE, SIMPLE. The governing equations for a 2-phase flow are composed of mass, momentum, and energy conservation equations for each phase. These equation sets are closed by the interfacial transfer rate of mass, momentum, and energy. The interfacial transfer of mass, momentum, and energy occurs through the interfacial area, and this area plays an important role in the transfer rate. The flow regime based correlations are used for calculating the interracial area in the traditional style 2-phase flow model. This is dependent upon the flow regime and is limited to the fully developed 2-phase flow region. Its application to the multi-dimensional 2-phase flow has some limitation because it adopts the measured results of 2-phase flow in the 1-dimensional tube. The interfacial area concentration transport equation had been suggested in order to calculate the interfacial area without the interfacial area correlations. The source terms to close the interfacial area transport equation should be further developed for a wide ranger usage of it. In this study, the one group interfacial area concentration transport equation has been implemented into the CUPID code. This interfacial area concentration transport equation can be used instead of the interfacial area concentration correlations for the bubbly flow region.

An Implementation of Interfacial Transport Equation into the CUPID code

International Nuclear Information System (INIS)

Park, Ik Kyu; Cho, Heong Kyu; Yoon, Han Young; Jeong, Jae Jun

2009-11-01

A component scale thermal hydraulic analysis code, CUPID (Component Unstructured Program for Interfacial Dynamics), is being developed for the analysis of components for a nuclear reactor, such as reactor vessel, steam generator, containment, etc. It adopted a three-dimensional, transient, two phase and three-field model. In order to develop the numerical schemes for the three-field model, various numerical schemes have been examined including the SMAS, semi-implicit ICE, SIMPLE. The governing equations for a 2-phase flow are composed of mass, momentum, and energy conservation equations for each phase. These equation sets are closed by the interfacial transfer rate of mass, momentum, and energy. The interfacial transfer of mass, momentum, and energy occurs through the interfacial area, and this area plays an important role in the transfer rate. The flow regime based correlations are used for calculating the interracial area in the traditional style 2-phase flow model. This is dependent upon the flow regime and is limited to the fully developed 2-phase flow region. Its application to the multi-dimensional 2-phase flow has some limitation because it adopts the measured results of 2-phase flow in the 1-dimensional tube. The interfacial area concentration transport equation had been suggested in order to calculate the interfacial area without the interfacial area correlations. The source terms to close the interfacial area transport equation should be further developed for a wide ranger usage of it. In this study, the one group interfacial area concentration transport equation has been implemented into the CUPID code. This interfacial area concentration transport equation can be used instead of the interfacial area concentration correlations for the bubbly flow region

Fluid Physical and Transport Phenomena Studies aboard the International Space Station: Planned Experiments

Science.gov (United States)

Singh, Bhim S.

1999-01-01

This paper provides an overview of the microgravity fluid physics and transport phenomena experiments planned for the International Spare Station. NASA's Office of Life and Microgravity Science and Applications has established a world-class research program in fluid physics and transport phenomena. This program combines the vast expertise of the world research community with NASA's unique microgravity facilities with the objectives of gaining new insight into fluid phenomena by removing the confounding effect of gravity. Due to its criticality to many terrestrial and space-based processes and phenomena, fluid physics and transport phenomena play a central role in the NASA's Microgravity Program. Through widely publicized research announcement and well established peer-reviews, the program has been able to attract a number of world-class researchers and acquired a critical mass of investigations that is now adding rapidly to this field. Currently there arc a total of 106 ground-based and 20 candidate flight principal investigators conducting research in four major thrust areas in the program: complex flows, multiphase flow and phase change, interfacial phenomena, and dynamics and instabilities. The International Space Station (ISS) to be launched in 1998, provides the microgravity research community with a unprecedented opportunity to conduct long-duration microgravity experiments which can be controlled and operated from the Principal Investigators' own laboratory. Frequent planned shuttle flights to the Station will provide opportunities to conduct many more experiments than were previously possible. NASA Lewis Research Center is in the process of designing a Fluids and Combustion Facility (FCF) to be located in the Laboratory Module of the ISS that will not only accommodate multiple users but, allow a broad range of fluid physics and transport phenomena experiments to be conducted in a cost effective manner.

Basic equations of interfacial area transport in gas-liquid two-phase flow

International Nuclear Information System (INIS)

Kataoka, I.; Yoshida, K.; Naitoh, M.; Okada, H.; Morii, T.

2011-01-01

The rigorous and consistent formulations of basic equations of interfacial area transport were derived using correlation functions of characteristic function of each phase and velocities of each phase. Turbulent transport term of interfacial area concentration was consistently derived and related to the difference between interfacial velocity and averaged velocity of each phase. Constitutive equations of turbulent transport terms of interfacial area concentration were proposed for bubbly flow. New transport model and constitutive equations were developed for churn flow. These models and constitutive equations are validated by experimental data of radial distributions of interfacial area concentration in bubbly and churn flow. (author)

Interfacial structures and area transport in upward and downward two-phase flow

International Nuclear Information System (INIS)

Paranjape, S. S.; Kim, S.; Ishii, M.; Kelly, J.

2003-01-01

An experimental study has been carried out for upward and downward two-phase flow to study local interfacial structures and interfacial area transport. The flow studied, is an adiabatic, air-water, co-current, two-phase flow, in 25.4 mm and 50.8 mm ID test sections. Flow regime map is obtained using the characteristic signals obtained from an impedance void meter, employing neural network based identification methodology. A four sensor conductivity probe is used to measure the local two phase flow parameters, in bubbly flow regime. The local profiles of these parameters as well as their axial development reveal the nature of the interfacial structures and the bubble interaction mechanisms occurring in the flow. Furthermore, this study provides a good database for the development of the interfacial area transport equation, which dynamically models the changes in the interfacial area along a flow field. An interfacial area transport equation is used for downward flow based on that developed for the upward flow, with certain modifications in the bubble interaction terms. The area averaged values of the interfacial area concentration are compared with those predicted by the interfacial area transport model. The differences in the interfacial structures and interfacial area transport in co-current downward and upward two-phase flows are studied

Interfacial area transport of subcooled boiling flow in a vertical annulus

Energy Technology Data Exchange (ETDEWEB)

Brooks, Caleb S.; Ozar, Basar; Hibiki, Takashi; Ishii, Mamoru, E-mail: ishii@purdue.edu

2014-03-15

Highlights: • Discussion of boiling and wall nucleation dataset obtained in a vertical annulus. • Overview of the interfacial area transport equation modeling in boiling flow. • Comparison of bubble departure diameter and frequency with existing models. • Evaluation of the interfacial area transport equation prediction in boiling flow. - Abstract: In an effort to improve the prediction of void fraction and heat transfer characteristics in two-phase systems, the two-group interfacial area transport equation has been developed for use with the two-group two-fluid model. The two-group approach treats spherical/distorted bubbles as Group-1 and cap/slug/churn-turbulent bubbles as Group-2. Therefore, the interfacial area transport of steam-water two-phase flow in a vertical annulus has been investigated experimentally, including bulk flow parameters and wall nucleation characteristics. The theoretical modeling of interfacial area transport equation with phase change terms is introduced and discussed along with the experimental results. Benchmark of the interfacial area transport equation is performed considering the effects of bubble interaction mechanisms such as bubble break-up and coalescence, as well as, effects of phase change mechanisms such as wall nucleation and condensation for subcooled boiling. From the benchmark, sensitivity in the constitutive relations for Group-1 phase change mechanisms, such as wall nucleation and condensation is clear. The Group-2 interfacial area transport is shown to be dominated by the interfacial heat transfer mechanism causing expansion of Group-1 bubbles into Group-2 bubbles in the boiling flow.

Experimental study on interfacial area transport in downward two-phase flow

Science.gov (United States)

Wang, Guanyi

In view of the importance of two group interfacial area transport equations and lack of corresponding accurate downward flow database that can reveal two group interfacial area transport, a systematic database for adiabatic, air-water, vertically downward two-phase flow in a round pipe with inner diameter of 25.4 mm was collected to gain an insight of interfacial structure and provide benchmarking data for two-group interfacial area transport models. A four-sensor conductivity probe was used to measure the local two phase flow parameters and data was collected with data sampling frequency much higher than conventional data sampling frequency to ensure the accuracy. Axial development of local flow parameter profiles including void fraction, interfacial area concentration, and Sauter mean diameter were presented. Drastic inter-group transfer of void fraction and interfacial area was observed at bubbly to slug transition flow. And the wall peaked interfacial area concentration profiles were observed in churn-turbulent flow. The importance of local data about these phenomenon on flow structure prediction and interfacial area transport equation benchmark was analyzed. Bedsides, in order to investigate the effect of inlet conditions, all experiments were repeated after installing the flow straightening facility, and the results were briefly analyzed. In order to check the accuracy of current data, the experiment results were cross-checked with rotameter measurement as well as drift-flux model prediction, the averaged error is less than 15%. Current models for two-group interfacial area transport equation were evaluated using these data. The results show that two-group interfacial area transport equations with current models can predict most flow conditions with error less than 20%, except some bubbly to slug transition flow conditions and some churn-turbulent flow conditions. The disagreement between models and experiments could result from underestimate of inter

Modelling of transport phenomena

International Nuclear Information System (INIS)

Itoh, Kimitaka; Itoh, Sanae; Fukuyama, Atsushi.

1993-09-01

In this review article, we discuss key features of the transport phenomena and theoretical modelling to understand them. Experimental observations have revealed the nature of anomalous transport, i.e., the enhancement of the transport coefficients by the gradients of the plasma profiles, the pinch phenomena, the radial profile of the anomalous transport coefficients, the variation of the transport among the Bohm diffusion, Pseudo-classical confinement, L-mode and variety of improved confinement modes, and the sudden jumps such as L-H transition. Starting from the formalism of the transport matrix, the modelling based on the low frequency instabilities are reviewed. Theoretical results in the range of drift wave frequency are examined. Problems in theories based on the quasilinear and mixing-length estimates lead to the renewal of the turbulence theory, and the physics picture of the self-sustained turbulence is discussed. The theory of transport using the fluid equation of plasma is developed, showing that the new approach is very promising in explaining abovementioned characteristics of anomalous transport in both L-mode and improved confinement plasmas. The interference of the fluxes is the key to construct the physics basis of the bifurcation theory for the L-H transition. The present status of theories on the mechanisms of improved confinement is discussed. Modelling on the nonlocal nature of transport is briefly discussed. Finally, the impact of the anomalous transport on disruptive phenomena is also described. (author) 95 refs

Modeling interfacial area transport in multi-fluid systems

Energy Technology Data Exchange (ETDEWEB)

Yarbro, Stephen Lee [Univ. of California, Berkeley, CA (United States)

1996-11-01

Many typical chemical engineering operations are multi-fluid systems. They are carried out in distillation columns (vapor/liquid), liquid-liquid contactors (liquid/liquid) and other similar devices. An important parameter is interfacial area concentration, which determines the rate of interfluid heat, mass and momentum transfer and ultimately, the overall performance of the equipment. In many cases, the models for determining interfacial area concentration are empirical and can only describe the cases for which there is experimental data. In an effort to understand multiphase reactors and the mixing process better, a multi-fluid model has been developed as part of a research effort to calculate interfacial area transport in several different types of in-line static mixers. For this work, the ensemble-averaged property conservation equations have been derived for each fluid and for the mixture. These equations were then combined to derive a transport equation for the interfacial area concentration. The final, one-dimensional model was compared to interfacial area concentration data from two sizes of Kenics in-line mixer, two sizes of concurrent jet and a Tee mixer. In all cases, the calculated and experimental data compared well with the highest scatter being with the Tee mixer comparison.

Computational transport phenomena for engineering analyses

CERN Document Server

Farmer, Richard C; Cheng, Gary C; Chen, Yen-Sen

2009-01-01

Computational Transport PhenomenaOverviewTransport PhenomenaAnalyzing Transport PhenomenaA Computational Tool: The CTP CodeVerification, Validation, and GeneralizationSummaryNomenclatureReferencesThe Equations of ChangeIntroductionDerivation of The Continuity EquationDerivation of The Species Continuity EquationDerivation of The Equation Of MotionDerivation of The General Energy EquationNon-Newtonian FluidsGeneral Property BalanceAnalytical and Approximate Solutions for the Equations of ChangeSummaryNomenclatureReferencesPhysical PropertiesOverviewReal-Fluid ThermodynamicsChemical Equilibrium

Impact of Interfacial Water Transport in PEMFCs on Cell Performance

International Nuclear Information System (INIS)

Kotaka, Toshikazu; Tabuchi, Yuichiro; Pasaogullari, Ugur; Wang, Chao-Yang

2014-01-01

Coupled cell performance evaluation, liquid water visualization by neutron radiography (NRG) and numerical modeling based on multiphase mixture (M2) model were performed with three types of GDMs: Micro Porous Layer (MPL) free; Carbon Paper (CP) with MPL; and CP free to investigate interfacial liquid water transport phenomena in PEMFCs and its effect on cell performance. The visualized results of MPL free GDM with different wettability of bi-polar plates (BPPs) showed hydrophilic BPP improved liquid water transport at the interface between CP and channel. Numerical modeling results indicated that this difference with BPP wettability was caused by the liquid water coverage difference on CP surface. Thus, controlling liquid water coverage is the one of the key strategies for improving cell performance. Additionally, liquid water distributions across the cell for three types of GDMs were compared and significant difference in liquid water content at the interface between Catalyst Layer (CL) and GDM was observed. Numerical modeling suggests this difference is influenced by the gap at the interface and that the MPL could minimize this effect. The CP free cell (i.e. only MPL) showed the best performance and the lowest liquid water content. There were multiple impacts of interfacial liquid water transport both at CL-GDM and GDM-channel interfaces. High hydrophobicity and fine structure of MPLs contributed to enhanced liquid water transport at GDM-channel interface and as a result reduced the liquid water coverage. At the same time, MPL improves contact at the CL-GDM interface in the same manner as seen in CP with MPL case. Thus, the CP free concept showed the best performance. It is suggested that the design of the interface between each component of the PEMFC has a great impact on cell performance and plays a significant role in achievement of high current density operation and cost reduction in FCEVs

Interfacial area transport in a confined Bubbly flow

Energy Technology Data Exchange (ETDEWEB)

Kim, S.; Sun, X.; Ishii, M. [Purdue Univ., Lafayette, IN (United States). School of Nuclear Engineering; Lincoln, F. [Bettis Atomic Power Lab., West Mifflin, Bechtel Bettis, Inc., PA (United States)

2001-07-01

The interfacial area transport equation applicable to the bubbly flow is presented. The model is evaluated against the data acquired in an adiabatic air-water upward two-phase flow loop with a test section of 20 cm in width and 1 cm in gap. In general, a good agreement, within the measurement error of {+-}10%, is observed for a wide range in the bubbly flow regime. The sensitivity analysis on the individual particle interaction mechanisms demonstrates the active interactions between the bubbles and highlights the mechanisms playing the dominant role in interfacial area transport. (author)

Two-group modeling of interfacial area transport in large diameter channels

Energy Technology Data Exchange (ETDEWEB)

Schlegel, J.P., E-mail: schlegelj@mst.edu [Department of Mining and Nuclear Engineering, Missouri University of Science and Technology, 301 W 14th St., Rolla, MO 65409 (United States); Hibiki, T.; Ishii, M. [School of Nuclear Engineering, Purdue University, 400 Central Dr., West Lafayette, IN 47907 (United States)

2015-11-15

Highlights: • Implemented updated constitutive models and benchmarking method for IATE in large pipes. • New model and method with new data improved the overall IATE prediction for large pipes. • Not all conditions well predicted shows that further development is still required. - Abstract: A comparison of the existing two-group interfacial area transport equation source and sink terms for large diameter channels with recently collected interfacial area concentration measurements (Schlegel et al., 2012, 2014. Int. J. Heat Fluid Flow 47, 42) has indicated that the model does not perform well in predicting interfacial area transport outside of the range of flow conditions used in the original benchmarking effort. In order to reduce the error in the prediction of interfacial area concentration by the interfacial area transport equation, several constitutive relations have been updated including the turbulence model and relative velocity correlation. The transport equation utilizing these updated models has been modified by updating the inter-group transfer and Group 2 coalescence and disintegration kernels using an expanded range of experimental conditions extending to pipe sizes of 0.304 m [12 in.], gas velocities of up to nearly 11 m/s [36.1 ft/s] and liquid velocities of up to 2 m/s [6.56 ft/s], as well as conditions with both bubbly flow and cap-bubbly flow injection (Schlegel et al., 2012, 2014). The modifications to the transport equation have resulted in a decrease in the RMS error for void fraction and interfacial area concentration from 17.32% to 12.3% and 21.26% to 19.6%. The combined RMS error, for both void fraction and interfacial area concentration, is below 15% for most of the experiments used in the comparison, a distinct improvement over the previous version of the model.

Development and validation of a new solver based on the interfacial area transport equation for the numerical simulation of sub-cooled boiling with OpenFOAM CFD code for nuclear safety applications

Energy Technology Data Exchange (ETDEWEB)

Alali, Abdullah

2014-02-21

The one-group interfacial area transport equation has been coupled to a wall heat flux partitioning model in the framework of two-phase Eulerian approach using the OpenFOAM CFD code for better prediction of subcooled boiling phenomena which is essential for safety analysis of nuclear reactors. The interfacial area transport equation has been modified to include the effect of bubble nucleation at the wall and condensation by subcooled liquid in the bulk that governs the non-uniform bubble size distribution.

Development and validation of a new solver based on the interfacial area transport equation for the numerical simulation of sub-cooled boiling with OpenFOAM CFD code for nuclear safety applications

International Nuclear Information System (INIS)

Alali, Abdullah

2014-01-01

The one-group interfacial area transport equation has been coupled to a wall heat flux partitioning model in the framework of two-phase Eulerian approach using the OpenFOAM CFD code for better prediction of subcooled boiling phenomena which is essential for safety analysis of nuclear reactors. The interfacial area transport equation has been modified to include the effect of bubble nucleation at the wall and condensation by subcooled liquid in the bulk that governs the non-uniform bubble size distribution.

Interfacial Thermal Transport via One-Dimensional Atomic Junction Model

Directory of Open Access Journals (Sweden)

Guohuan Xiong

2018-03-01

Full Text Available In modern information technology, as integration density increases rapidly and the dimension of materials reduces to nanoscale, interfacial thermal transport (ITT has attracted widespread attention of scientists. This review introduces the latest theoretical development in ITT through one-dimensional (1D atomic junction model to address the thermal transport across an interface. With full consideration of the atomic structures in interfaces, people can apply the 1D atomic junction model to investigate many properties of ITT, such as interfacial (Kapitza resistance, nonlinear interface, interfacial rectification, and phonon interference, and so on. For the ballistic ITT, both the scattering boundary method (SBM and the non-equilibrium Green’s function (NEGF method can be applied, which are exact since atomic details of actual interfaces are considered. For interfacial coupling case, explicit analytical expression of transmission coefficient can be obtained and it is found that the thermal conductance maximizes at certain interfacial coupling (harmonic mean of the spring constants of the two leads and the transmission coefficient is not a monotonic decreasing function of phonon frequency. With nonlinear interaction—phonon–phonon interaction or electron–phonon interaction at interface, the NEGF method provides an efficient way to study the ITT. It is found that at weak linear interfacial coupling, the nonlinearity can improve the ITT, but it depresses the ITT in the case of strong-linear coupling. In addition, the nonlinear interfacial coupling can induce thermal rectification effect. For interfacial materials case which can be simulated by a two-junction atomic chain, phonons show interference effect, and an optimized thermal coupler can be obtained by tuning its spring constant and atomic mass.

Molecular dynamics study of interfacial thermal transport between silicene and substrates.

Science.gov (United States)

Zhang, Jingchao; Hong, Yang; Tong, Zhen; Xiao, Zhihuai; Bao, Hua; Yue, Yanan

2015-10-07

In this work, the interfacial thermal transport across silicene and various substrates, i.e., crystalline silicon (c-Si), amorphous silicon (a-Si), crystalline silica (c-SiO2) and amorphous silica (a-SiO2) are explored by classical molecular dynamics (MD) simulations. A transient pulsed heating technique is applied in this work to characterize the interfacial thermal resistance in all hybrid systems. It is reported that the interfacial thermal resistances between silicene and all substrates decrease nearly 40% with temperature from 100 K to 400 K, which is due to the enhanced phonon couplings from the anharmonicity effect. Analysis of phonon power spectra of all systems is performed to interpret simulation results. Contradictory to the traditional thought that amorphous structures tend to have poor thermal transport capabilities due to the disordered atomic configurations, it is calculated that amorphous silicon and silica substrates facilitate the interfacial thermal transport compared with their crystalline structures. Besides, the coupling effect from substrates can improve the interface thermal transport up to 43.5% for coupling strengths χ from 1.0 to 2.0. Our results provide fundamental knowledge and rational guidelines for the design and development of the next-generation silicene-based nanoelectronics and thermal interface materials.

Transport phenomena an introduction to advanced topics

CERN Document Server

Glasgow, Larry A

2010-01-01

Enables readers to apply transport phenomena principles to solve advanced problems in all areas of engineering and science This book helps readers elevate their understanding of, and their ability to apply, transport phenomena by introducing a broad range of advanced topics as well as analytical and numerical solution techniques. Readers gain the ability to solve complex problems generally not addressed in undergraduate-level courses, including nonlinear, multidimensional transport, and transient molecular and convective transport scenarios. Avoiding rote memorization, the author em

A Connection between Transport Phenomena and Thermodynamics

Science.gov (United States)

Swaney, Ross; Bird, R. Byron

2017-01-01

Although students take courses in transport phenomena and thermodynamics, they probably do not ask whether these two subjects are related. Here we give an answer to that question. Specifically we give relationships between the equations of change for total energy, internal energy, and entropy of transport phenomena and key equations of equilibrium…

Transport phenomena in strongly correlated Fermi liquids

International Nuclear Information System (INIS)

Kontani, Hiroshi

2013-01-01

Comprehensive overview. Written by an expert of this topic. Provides the reader with current developments in the field. In conventional metals, various transport coefficients are scaled according to the quasiparticle relaxation time, τ, which implies that the relaxation time approximation (RTA) holds well. However, such a simple scaling does not hold in many strongly correlated electron systems, reflecting their unique electronic states. The most famous example would be cuprate high-Tc superconductors (HTSCs), where almost all the transport coefficients exhibit a significant deviation from the RTA results. To better understand the origin of this discrepancy, we develop a method for calculating various transport coefficients beyond the RTA by employing field theoretical techniques. Near the magnetic quantum critical point, the current vertex correction (CVC), which describes the electron-electron scattering beyond the relaxation time approximation, gives rise to various anomalous transport phenomena. We explain anomalous transport phenomena in cuprate HTSCs and other metals near their magnetic or orbital quantum critical point using a uniform approach. We also discuss spin related transport phenomena in strongly correlated systems. In many d- and f-electron systems, the spin current induced by the spin Hall effect is considerably greater because of the orbital degrees of freedom. This fact attracts much attention due to its potential application in spintronics. We discuss various novel charge, spin and heat transport phenomena in strongly correlated metals.

Transport phenomena in multiphase flows

CERN Document Server

Mauri, Roberto

2015-01-01

This textbook provides a thorough presentation of the phenomena related to the transport of mass, momentum and energy.  It lays all the basic physical principles, then for the more advanced readers, it offers an in-depth treatment with advanced mathematical derivations and ends with some useful applications of the models and equations in specific settings. The important idea behind the book is to unify all types of transport phenomena, describing them within a common framework in terms of cause and effect, respectively represented by the driving force and the flux of the transported quantity. The approach and presentation are original in that the book starts with a general description of transport processes, providing the macroscopic balance relations of fluid dynamics and heat and mass transfer, before diving into the mathematical realm of continuum mechanics to derive the microscopic governing equations at the microscopic level. The book is a modular teaching tool and can be used either for an introductory...

Transport phenomena in Newtonian fluids a concise primer

CERN Document Server

Olsson, Per

2013-01-01

This short primer provides a concise and tutorial-style introduction to transport phenomena in Newtonian fluids , in particular the transport of mass, energy and momentum.  The reader will find detailed derivations of the transport equations for these phenomena, as well as selected analytical solutions to the transport equations in some simple geometries. After a brief introduction to the basic mathematics used in the text, Chapter 2, which deals with momentum transport, presents a derivation of the Navier-Stokes-Duhem equation describing the basic flow in a Newtonian fluid.  Also provided at

Interface-Induced Phenomena in Magnetism.

Science.gov (United States)

Hellman, Frances; Hoffmann, Axel; Tserkovnyak, Yaroslav; Beach, Geoffrey S D; Fullerton, Eric E; Leighton, Chris; MacDonald, Allan H; Ralph, Daniel C; Arena, Dario A; Dürr, Hermann A; Fischer, Peter; Grollier, Julie; Heremans, Joseph P; Jungwirth, Tomas; Kimel, Alexey V; Koopmans, Bert; Krivorotov, Ilya N; May, Steven J; Petford-Long, Amanda K; Rondinelli, James M; Samarth, Nitin; Schuller, Ivan K; Slavin, Andrei N; Stiles, Mark D; Tchernyshyov, Oleg; Thiaville, André; Zink, Barry L

2017-01-01

This article reviews static and dynamic interfacial effects in magnetism, focusing on interfacially-driven magnetic effects and phenomena associated with spin-orbit coupling and intrinsic symmetry breaking at interfaces. It provides a historical background and literature survey, but focuses on recent progress, identifying the most exciting new scientific results and pointing to promising future research directions. It starts with an introduction and overview of how basic magnetic properties are affected by interfaces, then turns to a discussion of charge and spin transport through and near interfaces and how these can be used to control the properties of the magnetic layer. Important concepts include spin accumulation, spin currents, spin transfer torque, and spin pumping. An overview is provided to the current state of knowledge and existing review literature on interfacial effects such as exchange bias, exchange spring magnets, spin Hall effect, oxide heterostructures, and topological insulators. The article highlights recent discoveries of interface-induced magnetism and non-collinear spin textures, non-linear dynamics including spin torque transfer and magnetization reversal induced by interfaces, and interfacial effects in ultrafast magnetization processes.

Micro transport phenomena during boiling

CERN Document Server

Peng, Xiaofeng

2011-01-01

"Micro Transport Phenomena During Boiling" reviews the new achievements and contributions in recent investigations at microscale. It presents some original research results and discusses topics at the frontier of thermal and fluid sciences.

Implementation of a one-group interfacial area transport equation in a CFD code for the simulation of upward adiabatic bubbly flow

International Nuclear Information System (INIS)

Pellacani, F.; Macian, R.; Chiva, S.; Pena, C.

2011-01-01

In this paper upward, isothermal and turbulent bubbly flow in tubes is numerically modeled by using ANSYS CFX 12.1 with the aim of creating a basis for the reliable simulation of the flow along a vertical channel in a nuclear reactor as long term goal. Two approaches based on the mono-dispersed model and on the one-group Interfacial Area Transport Equation (IATE) model are used in order to maintain the computational effort as low as possible. This work represents the necessary step to implement a two-group interfacial area transport equation that will be able to dynamically represent the changes in interfacial structure in the transition region from bubbly to slug flow. The drag coefficient is calculated using the Grace model and the interfacial non-drag forces are also included. The Antal model is used for the calculation of the wall lubrication force coefficient. The lift force coefficient is obtained from the Tomiyama model. The turbulent dispersion force is taken into account and is modeled using the FAD (Favre averaged drag) approach, while the turbulence transfer is simulated with the Sato's model. The liquid velocity is in the range between 0.5 and 2 m/s and the average void fraction varies between 5 and 15%.The source and sink terms for break-up and coalescence needed for the calculation of the implemented Interfacial Area Density are those proposed by Yao and Morel. The model has been checked using experimental results by Mendez. Radial profile distributions of void fraction, interfacial area density and bubble mean diameter are shown at the axial position equivalent to z/D=56. The results obtained by the simulations have a good agreement with the experimental data but show also the need of a better study of the coalescence and breakup phenomena to develop more accurate interaction models. (author)

Numerical and experimental analysis of thermosonic bond strength considering interfacial contact phenomena

International Nuclear Information System (INIS)

He Jun; Guo Yongjin; Lin Zhongqin

2008-01-01

The theoretical equation of thermosonic bond strength involving interfacial deformation and microcontact phenomena is presented in this study. The constitutive equation of gold considering the ultrasonic softening mechanism was developed based on the thermosonic bonding experiments and coded into the FE software. The numerical model of bonding was established to estimate the surface exposure and the effective normal pressure. The real contact area was calculated by a microcontact model. Accordingly, the nominal bond strength can be obtained and verified by the experimental data. It is found that a better conjunction exists at the edge of the contact area because large surface exposure is produced there, which is also proved by the SEM image of a sheared ball bond. Increasing the bonding force or the ultrasonic power will increase the interfacial plastic deformation, the nominal and real contact areas, but decreases the effective normal pressure. The contact ratio increases to a maximum with the increase in the bonding force, and then decreases while it continues to decrease with the increase in the ultrasonic power. In addition, both the stress analysis and experimental result show that cratering and damage to the pad structure are easily produced below the edge region of the contact area under an excessive bonding force or ultrasonic power

Mathematical modeling of liquid/liquid hollow fiber membrane contactor accounting for interfacial transport phenomena: Extraction of lanthanides as a surrogate for actinides

International Nuclear Information System (INIS)

Rogers, J.D.

1994-01-01

This report is divided into two parts. The second part is divided into the following sections: experimental protocol; modeling the hollow fiber extractor using film theory; Graetz model of the hollow fiber membrane process; fundamental diffusive-kinetic model; and diffusive liquid membrane device-a rigorous model. The first part is divided into: membrane and membrane process-a concept; metal extraction; kinetics of metal extraction; modeling the membrane contactor; and interfacial phenomenon-boundary conditions-applied to membrane transport

Transport phenomena in strongly correlated Fermi liquids

CERN Document Server

Kontani, Hiroshi

2013-01-01

In conventional metals, various transport coefficients are scaled according to the quasiparticle relaxation time, \\tau, which implies that the relaxation time approximation (RTA) holds well. However, such a simple scaling does not hold in many strongly correlated electron systems, reflecting their unique electronic states. The most famous example would be cuprate high-Tc superconductors (HTSCs), where almost all the transport coefficients exhibit a significant deviation from the RTA results. To better understand the origin of this discrepancy, we develop a method for calculating various transport coefficients beyond the RTA by employing field theoretical techniques. Near the magnetic quantum critical point, the current vertex correction (CVC), which describes the electron-electron scattering beyond the relaxation time approximation, gives rise to various anomalous transport phenomena. We explain anomalous transport phenomena in cuprate HTSCs and other metals near their magnetic or orbital quantum critical poi...

Modified two-fluid model for the two-group interfacial area transport equation

International Nuclear Information System (INIS)

Sun Xiaodong; Ishii, Mamoru; Kelly, Joseph M.

2003-01-01

This paper presents a modified two-fluid model that is ready to be applied in the approach of the two-group interfacial area transport equation. The two-group interfacial area transport equation was developed to provide a mechanistic constitutive relation for the interfacial area concentration in the two-fluid model. In the two-group transport equation, bubbles are categorized into two groups: spherical/distorted bubbles as Group 1 while cap/slug/churn-turbulent bubbles as Group 2. Therefore, this transport equation can be employed in the flow regimes spanning from bubbly, cap bubbly, slug to churn-turbulent flows. However, the introduction of the two groups of bubbles requires two gas velocity fields. Yet it is not practical to solve two momentum equations for the gas phase alone. In the current modified two-fluid model, a simplified approach is proposed. The momentum equation for the averaged velocity of both Group-1 and Group-2 bubbles is retained. By doing so, the velocity difference between Group-1 and Group-2 bubbles needs to be determined. This may be made either based on simplified momentum equations for both Group-1 and Group-2 bubbles or by a modified drift-flux model

Coupled Transport Phenomena in the Opalinus Clay: Implications for Radionuclide Transport

International Nuclear Information System (INIS)

Soler, J.M.

1999-09-01

Coupled phenomena (thermal and chemical osmosis, hyperfiltration, coupled diffusion, thermal diffusion, thermal filtration, Dufour effect) may play an important role in fluid, solute and heat transport in clay-rich formations, such as the Opalinus Clay (OPA), which are being considered as potential hosts for radioactive waste repositories. In this study, the potential effects of coupled phenomena on radionuclide transport in the vicinity of a repository for vitrified high-level radioactive waste (HLW) and spent nuclear fuel (SF) hosted by the Opalinus Clay, at times equal to or greater than the expected lifetime of the waste canisters (about 1000 years), have been addressed. Firstly, estimates of the solute fluxes associated with chemical osmosis, hyperfiltration, thermal diffusion and thermal osmosis have been calculated. Available experimental data concerning coupled transport phenomena in compacted clays, and the hydrogeological and geochemical conditions to which the Opalinus Clay is subject, have been used for these estimates. These estimates suggest that thermal osmosis is the only coupled transport mechanism that could have a strong impact on solute and fluid transport in the vicinity of the repository. Secondly, estimates of the heat fluxes associated with thermal filtration and the Dufour effect in the vicinity of the repository have been calculated. The calculated heat fluxes are absolutely negligible compared to the heat flux caused by thermal conduction. As a further step to obtain additional insight into the effects of coupled phenomena on solute transport, the solute fluxes associated with advection, chemical diffusion, thermal and chemical osmosis, hyperfiltration and thermal diffusion have been incorporated into a simple one-dimensional transport equation. The analytical solution of this equation, with appropriate parameters, shows again that thermal osmosis is the only coupled transport mechanism that could have a strong effect on repository

Coupled Transport Phenomena in the Opalinus Clay: Implications for Radionuclide Transport

Energy Technology Data Exchange (ETDEWEB)

Soler, J.M.

1999-09-01

Coupled phenomena (thermal and chemical osmosis, hyperfiltration, coupled diffusion, thermal diffusion, thermal filtration, Dufour effect) may play an important role in fluid, solute and heat transport in clay-rich formations, such as the Opalinus Clay (OPA), which are being considered as potential hosts for radioactive waste repositories. In this study, the potential effects of coupled phenomena on radionuclide transport in the vicinity of a repository for vitrified high-level radioactive waste (HLW) and spent nuclear fuel (SF) hosted by the Opalinus Clay, at times equal to or greater than the expected lifetime of the waste canisters (about 1000 years), have been addressed. Firstly, estimates of the solute fluxes associated with chemical osmosis, hyperfiltration, thermal diffusion and thermal osmosis have been calculated. Available experimental data concerning coupled transport phenomena in compacted clays, and the hydrogeological and geochemical conditions to which the Opalinus Clay is subject, have been used for these estimates. These estimates suggest that thermal osmosis is the only coupled transport mechanism that could have a strong impact on solute and fluid transport in the vicinity of the repository. Secondly, estimates of the heat fluxes associated with thermal filtration and the Dufour effect in the vicinity of the repository have been calculated. The calculated heat fluxes are absolutely negligible compared to the heat flux caused by thermal conduction. As a further step to obtain additional insight into the effects of coupled phenomena on solute transport, the solute fluxes associated with advection, chemical diffusion, thermal and chemical osmosis, hyperfiltration and thermal diffusion have been incorporated into a simple one-dimensional transport equation. The analytical solution of this equation, with appropriate parameters, shows again that thermal osmosis is the only coupled transport mechanism that could have a strong effect on repository

Transport phenomena in particulate systems

CERN Document Server

Freire, José Teixeira; Ferreira, Maria do Carmo

2012-01-01

This volume spans 10 chapters covering different aspects of transport phenomena including fixed and fluidized systems, spouted beds, electrochemical and wastewater treatment reactors. This e-book will be valuable for students, engineers and researchers aiming to keep updated on the latest developments on particulate systems.

Gravitational Anomaly and Transport Phenomena

International Nuclear Information System (INIS)

Landsteiner, Karl; Megias, Eugenio; Pena-Benitez, Francisco

2011-01-01

Quantum anomalies give rise to new transport phenomena. In particular, a magnetic field can induce an anomalous current via the chiral magnetic effect and a vortex in the relativistic fluid can also induce a current via the chiral vortical effect. The related transport coefficients can be calculated via Kubo formulas. We evaluate the Kubo formula for the anomalous vortical conductivity at weak coupling and show that it receives contributions proportional to the gravitational anomaly coefficient. The gravitational anomaly gives rise to an anomalous vortical effect even for an uncharged fluid.

Uncertainty analysis of an interfacial area reconstruction algorithm and its application to two group interfacial area transport equation validation

International Nuclear Information System (INIS)

Dave, A.J.; Manera, A.; Beyer, M.; Lucas, D.; Prasser, H.-M.

2016-01-01

Wire mesh sensors (WMS) are state of the art devices that allow high resolution (in space and time) measurement of 2D void fraction distribution over a wide range of two-phase flow regimes, from bubbly to annular. Data using WMS have been recorded at the Helmholtz-Zentrum Dresden-Rossendorf (HZDR) (Lucas et al., 2010; Beyer et al., 2008; Prasser et al., 2003) for a wide combination of superficial gas and liquid velocities, providing an excellent database for advances in two-phase flow modeling. In two-phase flow, the interfacial area plays an integral role in coupling the mass, momentum and energy transport equations of the liquid and gas phase. While current models used in best-estimate thermal-hydraulic codes (e.g. RELAP5, TRACE, TRACG, etc.) are still based on algebraic correlations for the estimation of the interfacial area in different flow regimes, interfacial area transport equations (IATE) have been proposed to predict the dynamic propagation in space and time of interfacial area (Ishii and Hibiki, 2010). IATE models are still under development and the HZDR WMS experimental data provide an excellent basis for the validation and further advance of these models. The current paper is focused on the uncertainty analysis of algorithms used to reconstruct interfacial area densities from the void-fraction voxel data measured using WMS and their application towards validation efforts of two-group IATE models. In previous research efforts, a surface triangularization algorithm has been developed in order to estimate the surface area of individual bubbles recorded with the WMS, and estimate the interfacial area in the given flow condition. In the present paper, synthetically generated bubbles are used to assess the algorithm’s accuracy. As the interfacial area of the synthetic bubbles are defined by user inputs, the error introduced by the algorithm can be quantitatively obtained. The accuracy of interfacial area measurements is characterized for different bubbles

Uncertainty analysis of an interfacial area reconstruction algorithm and its application to two group interfacial area transport equation validation

Energy Technology Data Exchange (ETDEWEB)

Dave, A.J., E-mail: akshayjd@umich.edu [Department of Nuclear Engineering and Rad. Sciences, University of Michigan, Ann Arbor, MI 48105 (United States); Manera, A. [Department of Nuclear Engineering and Rad. Sciences, University of Michigan, Ann Arbor, MI 48105 (United States); Beyer, M.; Lucas, D. [Helmholtz-Zentrum Dresden-Rossendorf, Institute of Fluid Dynamics, 01314 Dresden (Germany); Prasser, H.-M. [Department of Mechanical and Process Engineering, ETH Zurich, 8092 Zurich (Switzerland)

2016-12-15

Wire mesh sensors (WMS) are state of the art devices that allow high resolution (in space and time) measurement of 2D void fraction distribution over a wide range of two-phase flow regimes, from bubbly to annular. Data using WMS have been recorded at the Helmholtz-Zentrum Dresden-Rossendorf (HZDR) (Lucas et al., 2010; Beyer et al., 2008; Prasser et al., 2003) for a wide combination of superficial gas and liquid velocities, providing an excellent database for advances in two-phase flow modeling. In two-phase flow, the interfacial area plays an integral role in coupling the mass, momentum and energy transport equations of the liquid and gas phase. While current models used in best-estimate thermal-hydraulic codes (e.g. RELAP5, TRACE, TRACG, etc.) are still based on algebraic correlations for the estimation of the interfacial area in different flow regimes, interfacial area transport equations (IATE) have been proposed to predict the dynamic propagation in space and time of interfacial area (Ishii and Hibiki, 2010). IATE models are still under development and the HZDR WMS experimental data provide an excellent basis for the validation and further advance of these models. The current paper is focused on the uncertainty analysis of algorithms used to reconstruct interfacial area densities from the void-fraction voxel data measured using WMS and their application towards validation efforts of two-group IATE models. In previous research efforts, a surface triangularization algorithm has been developed in order to estimate the surface area of individual bubbles recorded with the WMS, and estimate the interfacial area in the given flow condition. In the present paper, synthetically generated bubbles are used to assess the algorithm’s accuracy. As the interfacial area of the synthetic bubbles are defined by user inputs, the error introduced by the algorithm can be quantitatively obtained. The accuracy of interfacial area measurements is characterized for different bubbles

Interfacial structures - Thermodynamical and experimental studies of the interfacial mass transfer

International Nuclear Information System (INIS)

Morel, Jean-Emile

1972-01-01

In the first section, we put forward hypotheses concerning the structure of the interfacial regions between two immiscible liquid phases. It appears that the longitudinal structure is comparable with that of a crystallized solid and that the transversal structure is nearest of that of a liquid. In the second section, we present a thermodynamical treatment of the irreversible phenomena in the interfacial region. The equation of evolution of a system consisting of two immiscible liquid phases are deduced. The third part allows an experimental verification of the theoretical relations. We also make clear, in certain cases, the appearance of a great 'interfacial resistance' which slows down the interfacial mass transfer. (author) [fr

Electrocapillary Phenomena at Edible Oil/Saline Interfaces.

Science.gov (United States)

Nishimura, Satoshi; Ohzono, Takuya; Shoji, Kohei; Yagihara, Shin; Hayashi, Masafumi; Tanaka, Hisao

2017-03-01

Interfacial tension between edible oil and saline was measured under applied electric fields to understand the electrocapillary phenomena at the edible oil/saline interfaces. The electric responses of saline droplets in edible oil were also observed microscopically to examine the relationship between the electrocapillary phenomena and interfacial polarization. When sodium oleate (SO) was added to edible oil (SO-oil), the interfacial tension between SO-oil and saline decreased. However, no decrease was observed for additive-free oil or oleic acid (OA)-added oil (OA-oil). Microscopic observations suggested that the magnitude of interfacial polarization increased in the order of additive-free oil oil oil. The difference in electrocapillary phenomena between OA- and SO-oils was closely related to the polarization magnitude. In the case of SO-oil, the decrease in interfacial tension was remarkably larger for saline (pH 5.4~5.6) than that for phosphate-buffered saline (PBS, pH 7.2~7.4). However, no difference was observed between the electric responses of PBS and saline droplets in SO-oil. The difference in electrocapillary phenomena for PBS and saline could not be simply explained in terms of polarization magnitude. The ratio of ionized and non-ionized OA at the interfaces changed with the saline pH, possibly leading to the above difference.

Development of two-group interfacial area transport equation for confined flow-2. Model evaluation

International Nuclear Information System (INIS)

Sun, Xiaodong; Kim, Seungjin; Ishii, Mamoru; Beus, Stephen G.

2003-01-01

The bubble interaction mechanisms have been analytically modeled in the first paper of this series to provide mechanistic constitutive relations for the two-group interfacial area transport equation (IATE), which was proposed to dynamically solve the interfacial area concentration in the two-fluid model. This paper presents the evaluation approach and results of the two-group IATE based on available experimental data obtained in confined flow, namely, 11 data sets in or near bubbly flow and 13 sets in cap-turbulent and churn-turbulent flow. The two-group IATE is evaluated in steady state, one-dimensional form. Also, since the experiments were performed under adiabatic, air-water two-phase flow conditions, the phase change effect is omitted in the evaluation. To account for the inter-group bubble transport, the void fraction transport equation for Group-2 bubbles is also used to predict the void fraction for Group-2 bubbles. Agreement between the data and the model predictions is reasonably good and the average relative difference for the total interfacial area concentration between the 24 data sets and predictions is within 7%. The model evaluation demonstrates the capability of the two-group IATE focused on the current confined flow to predict the interfacial area concentration over a wide range of flow regimes. (author)

Interfacial polarization phenomena in organic molecular films

International Nuclear Information System (INIS)

Iwamoto, Mitsumasa; Manaka, Takaaki

2006-01-01

Electrostatic phenomena occurring at the interface between metal/organic and organic/organic materials are discussed from the viewpoint of dielectrics physics. Focusing on two important origins of surface polarization phenomena, orientational ordering of polar molecules and displacement of excess charges at the interface, surface polarization phenomena of organic thin films are discussed. To define the orientational order of polar molecules, orientational order parameters are introduced, and surface polarization due to the alignment of dipoles is expressed. The generation of Maxwell displacement current (MDC) and optical second harmonic generation (SHG) that are specific for surface organic monomolecular films are discussed, and some experimental evidence are shown. As an extension of the concept of surface Fermi level introduced to discuss the electrostatic phenomena due to electron transfer at the interface between metal-organic insulators, the surface Fermi level is extended to the discussion on the electrostatic phenomena of organic semiconductor materials on metals. In this paper, some experimental evidence of surface polarization originating from polar molecules and displacement of excess charges are shown. After that, with consideration of these surface phenomena, single electron tunneling of organic films are briefly discussed in association with surface polarization phenomena

Interface-induced phenomena in magnetism

NARCIS (Netherlands)

Hellman, Frances; Hoffmann, A.; Tserkovnyak, Yaroslav; Beach, Geoffrey S.D.; Fullerton, Eric E.; Leighton, Chris; Macdonald, Allan H.; Ralph, Daniel C.; Arena, Dario A.; Dürr, Hermann A.; Fischer, Peter; Grollier, Julie; Heremans, Joseph P.; Jungwirth, Tomas; Kimel, Alexey V.; Koopmans, B.; Krivorotov, Ilya N.; May, Steven J.; Petford-Long, Amanda K.; Rondinelli, James M.; Samarth, Nitin; Schuller, Ivan K.; Slavin, Andrei N.; Stiles, Mark D.; Tchernyshyov, Oleg; Thiaville, André; Zink, Barry L.

2017-01-01

This article reviews static and dynamic interfacial effects in magnetism, focusing on interfacially driven magnetic effects and phenomena associated with spin-orbit coupling and intrinsic symmetry breaking at interfaces. It provides a historical background and literature survey, but focuses on

Basic transport phenomena in materials engineering

CERN Document Server

Iguchi, Manabu

2014-01-01

This book presents the basic theory and experimental techniques of transport phenomena in materials processing operations. Such fundamental knowledge is highly useful for researchers and engineers in the field to improve the efficiency of conventional processes or develop novel technology. Divided into four parts, the book comprises 11 chapters describing the principles of momentum transfer, heat transfer, and mass transfer in single phase and multiphase systems. Each chapter includes examples with solutions and exercises to facilitate students’ learning. Diagnostic problems are also provided at the end of each part to assess students’ comprehension of the material.  The book is aimed primarily at students in materials science and engineering. However, it can also serve as a useful reference text in chemical engineering as well as an introductory transport phenomena text in mechanical engineering. In addition, researchers and engineers engaged in materials processing operations will find the material use...

Transport phenomena II essentials

CERN Document Server

REA, The Editors of

2012-01-01

REA's Essentials provide quick and easy access to critical information in a variety of different fields, ranging from the most basic to the most advanced. As its name implies, these concise, comprehensive study guides summarize the essentials of the field covered. Essentials are helpful when preparing for exams, doing homework and will remain a lasting reference source for students, teachers, and professionals. Transport Phenomena II covers forced convention, temperature distribution, free convection, diffusitivity and the mechanism of mass transfer, convective mass transfer, concentration

Anomalous transport phenomena in Fermi liquids with strong magnetic fluctuations

International Nuclear Information System (INIS)

Kontani, Hiroshi

2008-01-01

In this paper, we present recent developments in the theory of transport phenomena based on the Fermi liquid theory. In conventional metals, various transport coefficients are scaled according to the quasiparticles relaxation time, τ, which implies that the relaxation time approximation (RTA) holds well. However, such a simple scaling does not hold in many strongly correlated electron systems. The most famous example would be high-T c superconductors (HTSCs), where almost all the transport coefficients exhibit a significant deviation from the RTA results. This issue has been one of the most significant unresolved problems in HTSCs for a long time. Similar anomalous transport phenomena have been observed in metals near their antiferromagnetic (AF) quantum critical point (QCP). The main goal of this study is to demonstrate whether the anomalous transport phenomena in HTSC is evidence of a non-Fermi liquid ground state, or just RTA violation in strongly correlated Fermi liquids. Another goal is to establish a unified theory of anomalous transport phenomena in metals with strong magnetic fluctuations. For these purposes, we develop a method for calculating various transport coefficients beyond the RTA by employing field theoretical techniques. In a Fermi liquid, an excited quasiparticle induces other excited quasiparticles by collision, and current due to these excitations is called a current vertex correction (CVC). Landau noticed the existence of CVC first, which is indispensable for calculating transport coefficients in accord with the conservation laws. Here, we develop a transport theory involving resistivity and the Hall coefficient on the basis of the microscopic Fermi liquid theory, by considering the CVC. In nearly AF Fermi liquids, we find that the strong backward scattering due to AF fluctuations induces the CVC with prominent momentum dependence. This feature of the CVC can account for the significant enhancement in the Hall coefficient, magnetoresistance

Thermal transport phenomena in nanoparticle suspensions

International Nuclear Information System (INIS)

Cardellini, Annalisa; Fasano, Matteo; Bozorg Bigdeli, Masoud; Chiavazzo, Eliodoro; Asinari, Pietro

2016-01-01

Nanoparticle suspensions in liquids have received great attention, as they may offer an approach to enhance thermophysical properties of base fluids. A good variety of applications in engineering and biomedicine has been investigated with the aim of exploiting the above potential. However, the multiscale nature of nanosuspensions raises several issues in defining a comprehensive modelling framework, incorporating relevant molecular details and much larger scale phenomena, such as particle aggregation and their dynamics. The objectives of the present topical review is to report and discuss the main heat and mass transport phenomena ruling macroscopic behaviour of nanosuspensions, arising from molecular details. Relevant experimental results are included and properly put in the context of recent observations and theoretical studies, which solved long-standing debates about thermophysical properties enhancement. Major transport phenomena are discussed and in-depth analysis is carried out for highlighting the role of geometrical (nanoparticle shape, size, aggregation, concentration), chemical (pH, surfactants, functionalization) and physical parameters (temperature, density). We finally overview several computational techniques available at different scales with the aim of drawing the attention on the need for truly multiscale predictive models. This may help the development of next-generation nanoparticle suspensions and their rational use in thermal applications. (topical review)

Coupled electric and transport phenomena in porous media

NARCIS (Netherlands)

Li, Shuai

2014-01-01

The coupled electrical and transport properties of clay-containing porous media are the topics of interest in this study. Both experimental and numerical (pore network modeling) techniques are employed to gain insight into the macro-scale interaction between electrical and solute transport phenomena

Transport phenomena I essentials

CERN Document Server

REA, The Editors of

2012-01-01

REA's Essentials provide quick and easy access to critical information in a variety of different fields, ranging from the most basic to the most advanced. As its name implies, these concise, comprehensive study guides summarize the essentials of the field covered. Essentials are helpful when preparing for exams, doing homework and will remain a lasting reference source for students, teachers, and professionals. Transport Phenomena I includes viscosity, flow of Newtonian fluids, velocity distribution in laminar flow, velocity distributions with more than one independent variable, thermal con

Interfacial Phonon Transport Through Si/Ge Multilayer Film Using Monte Carlo Scheme With Spectral Transmissivity

Directory of Open Access Journals (Sweden)

Xin Ran

2018-05-01

Full Text Available The knowledge of interfacial phonon transport accounting for detailed phonon spectral properties is desired because of its importance for design of nanoscale energy systems. In this work, we investigate the interfacial phonon transport through Si/Ge multilayer films using an efficient Monte Carlo scheme with spectral transmissivity, which is validated for cross-plane phonon transport through both Si/Ge single-layer and Si/Ge bi-layer thin films by comparing with the discrete-ordinates solution. Different thermal boundary conductances between even the same material pair are declared at different interfaces within the multilayer system. Furthermore, the thermal boundary conductances at different interfaces show different trends with varying total system size, with the variation slope, very different as well. The results are much different from those in the bi-layer thin film or periodic superlattice. These unusual behaviors can be attributed to the combined interfacial local non-equilibrium effect and constraint effect from other interfaces.

Modeling strategy of the source and sink terms in the two-group interfacial area transport equation

International Nuclear Information System (INIS)

Ishii, Mamoru; Sun Xiaodong; Kim, Seungjin

2003-01-01

This paper presents the general strategy for modeling the source and sink terms in the two-group interfacial area transport equation. The two-group transport equation is applicable in bubbly, cap bubbly, slug, and churn-turbulent flow regimes to predict the change of the interfacial area concentration. This dynamic approach has an advantage of flow regime-independence over the conventional empirical correlation approach for the interfacial area concentration in the applications with the two-fluid model. In the two-group interfacial area transport equation, bubbles are categorized into two groups: spherical/distorted bubbles as Group 1 and cap/slug/churn-turbulent bubbles as Group 2. Thus, two sets of equations are used to describe the generation and destruction rates of bubble number density, void fraction, and interfacial area concentration for the two groups of bubbles due to bubble expansion and compression, coalescence and disintegration, and phase change. Based upon a detailed literature review of the research on the bubble interactions, five major bubble interaction mechanisms are identified for the gas-liquid two-phase flow of interest. A systematic integral approach, in which the significant variations of bubble volume and shape are accounted for, is suggested for the modeling of two-group bubble interactions. To obtain analytical forms for the various bubble interactions, a simplification is made for the bubble number density distribution function

Investigation of one-dimensional interfacial area transport for vertical upward air–water two-phase flow in an annular channel at elevated pressures

International Nuclear Information System (INIS)

Ozar, B.; Brooks, C.S.; Euh, D.J.; Hibiki, T.; Ishii, M.

2013-01-01

Highlights: • Interfacial area transport equation (IATE) for a rectangular duct is modified for an annulus. • IATE predicts interfacial area transport in bubbly-to-churn flow. • Scalability of IATE to elevated pressure conditions is validated. • Detailed 1D interfacial area transport data are presented. • Detailed interfacial area transport mechanisms are discussed. -- Abstract: The interfacial area transport of vertical, upward, air–water two-phase flows in an annular channel has been investigated at different system pressures. The inner and outer diameters of the annular channel were 19.1 mm and 38.1 mm, respectively. Twenty three inlet flow conditions were selected, which covered bubbly, cap-bubbly, and churn-turbulent flows. These flow conditions also overlapped with twelve conditions of a previous study for comparison. The local flow parameters, such as void fractions, interfacial area concentrations (IAC), and bubble interface velocities, were measured at nine radial positions for the three axial locations and converted into area-averaged parameters. The axial evolutions of local flow structure were interpreted in terms of bubble coalescence, breakup, expansion of the gas-phase due to pressure drop and system pressure. An assessment of interfacial area transport equation (IATE) was made and compared with the experimental data. A discussion of the comparison between model prediction and the experimental results were made

Investigation of one-dimensional interfacial area transport for vertical upward air–water two-phase flow in an annular channel at elevated pressures

Energy Technology Data Exchange (ETDEWEB)

Ozar, B., E-mail: ozar@fauske.com [School of Nuclear Engineering, Purdue University, 400 Central Drive, West Lafayette, IN 47907-2017 (United States); Brooks, C.S. [School of Nuclear Engineering, Purdue University, 400 Central Drive, West Lafayette, IN 47907-2017 (United States); Euh, D.J. [Korea Atomic Energy Research Institute, 150 Deokjin, Yuseong, Daejeon 305-353 (Korea, Republic of); Hibiki, T.; Ishii, M. [School of Nuclear Engineering, Purdue University, 400 Central Drive, West Lafayette, IN 47907-2017 (United States)

2013-10-15

Highlights: • Interfacial area transport equation (IATE) for a rectangular duct is modified for an annulus. • IATE predicts interfacial area transport in bubbly-to-churn flow. • Scalability of IATE to elevated pressure conditions is validated. • Detailed 1D interfacial area transport data are presented. • Detailed interfacial area transport mechanisms are discussed. -- Abstract: The interfacial area transport of vertical, upward, air–water two-phase flows in an annular channel has been investigated at different system pressures. The inner and outer diameters of the annular channel were 19.1 mm and 38.1 mm, respectively. Twenty three inlet flow conditions were selected, which covered bubbly, cap-bubbly, and churn-turbulent flows. These flow conditions also overlapped with twelve conditions of a previous study for comparison. The local flow parameters, such as void fractions, interfacial area concentrations (IAC), and bubble interface velocities, were measured at nine radial positions for the three axial locations and converted into area-averaged parameters. The axial evolutions of local flow structure were interpreted in terms of bubble coalescence, breakup, expansion of the gas-phase due to pressure drop and system pressure. An assessment of interfacial area transport equation (IATE) was made and compared with the experimental data. A discussion of the comparison between model prediction and the experimental results were made.

A modified two-fluid model for the application of two-group interfacial area transport equation

International Nuclear Information System (INIS)

Sun, X.; Ishii, M.; Kelly, J.

2003-01-01

This paper presents the modified two-fluid model that is ready to be applied in the approach of the two-group interfacial area transport equation. The two-group interfacial area transport equation was developed to provide a mechanistic constitutive relation for the interfacial area concentration in the two-fluid model. In the two-group transport equation, bubbles are categorized into two groups: spherical/distorted bubbles as Group 1 while cap/slug/churn-turbulent bubbles as Group 2. Therefore, this transport equation can be employed in the flow regimes spanning from bubbly, cap bubbly, slug to churn-turbulent flows. However, the introduction of the two groups of bubbles requires two gas velocity fields. Yet it is not desirable to solve two momentum equations for the gas phase alone. In the current modified two-fluid model, a simplified approach is proposed. The momentum equation for the averaged velocity of both Group-1 and Group-2 bubbles is retained. By doing so, the velocity difference between Group-1 and Group-2 bubbles needs to be determined. This may be made either based on simplified momentum equations for both Group-1 and Group-2 bubbles or by a modified drift-flux model

The effect of interfacial layers on charge transport in organic solar cell

Energy Technology Data Exchange (ETDEWEB)

Mbuyise, Xolani G.; Tonui, Patrick; Mola, Genene Tessema, E-mail: mola@ukzn.ac.za

2016-09-01

The effect of interfacial buffer layers in organic photovoltaic cell (OPV) whose active layer is composed of poly(3 hexylthiophene) (P3HT) and [6,6]-phenyl-C61-butyric acid methyl ester (PCBM) blend was studied. The electrical properties of OPV devices produced with and without interfacial layers are compared and discussed in terms of measured parameters of the cells. The charge transport properties showed significant difference on the mobility and activation factor between the two types of device structures. The life time measurements in the unprotected conditions are also presented and discussed.

Interfacial Phenomena in Fe/Stainless Steel-TiC Systems and the Effect of Mo

Science.gov (United States)

Kiviö, Miia; Holappa, Lauri; Yoshikawa, Takeshi; Tanaka, Toshihiro

2014-12-01

Titanium carbide is used as reinforcement particles in composites due to its hardness, wear resistance and stability. This work is a part of the study in which titanium carbides are formed in stainless steel castings in the mold to improve the wear resistance of a certain surface of the casting. Such local reinforcement is a very potential method but it is a quite demanding task requiring profound knowledge of interfacial phenomena in the system, wettability, stability, dissolution and precipitation of new phases in production of these materials. Good wetting between different constituents in the material is a key factor to attain maximal positive effects. Mo is used with TiC or Ti(C,N) reinforcement in composites to improve wettability. In this work the effect of Mo on the phenomena in Fe/stainless steel-TiC systems was examined by wetting experiments between the substrate and the alloy. Wetting was not significantly improved by adding Mo to the systems. Core-rim type carbides as well as more homogenous carbide particles were observed. Overall the carbide particles are very complex regarding to their chemistry, size and shape which aspects have to be taken into account in the development of these materials and manufacturing processes.

Interfacial Phenomena of Magnetic Fluid with Permanent Magnet in a Longitudinally Excited Container

International Nuclear Information System (INIS)

Sudo, Seiichi; Wakuda, Hirofumi; Yano, Tetsuya

2008-01-01

This paper describes the magnetic fluid sloshing in a longitudinally excited container. Liquid responses of magnetic fluid with a permanent magnet in a circular cylindrical container subject to vertical vibration are investigated. Experiments are performed on a vibration- testing system which provided longitudinal excitation. A cylindrical container made with the acrylic plastic is used in the experiment. A permanent magnet is in the state of floating in a magnetic fluid. The disk-shaped and ring-shaped magnets are examined. The different interfacial phenomena from the usual longitudinal liquid sloshing are observed. It is found that the wave motion frequency of magnetic fluid with a disk-shaped magnet in the container subject to vertical vibration is exactly same that of the excitation. In the case of ring-shaped magnet, the first symmetrical mode of one-half subharmonic response is dominant at lower excitation frequencies. The magnetic fluid disintegration of the free surface was also observed by a high-speed video camera system

Interfacial Phenomena of Magnetic Fluid with Permanent Magnet in a Longitudinally Excited Container

Science.gov (United States)

Sudo, Seiichi; Wakuda, Hirofumi; Yano, Tetsuya

2008-02-01

This paper describes the magnetic fluid sloshing in a longitudinally excited container. Liquid responses of magnetic fluid with a permanent magnet in a circular cylindrical container subject to vertical vibration are investigated. Experiments are performed on a vibration- testing system which provided longitudinal excitation. A cylindrical container made with the acrylic plastic is used in the experiment. A permanent magnet is in the state of floating in a magnetic fluid. The disk-shaped and ring-shaped magnets are examined. The different interfacial phenomena from the usual longitudinal liquid sloshing are observed. It is found that the wave motion frequency of magnetic fluid with a disk-shaped magnet in the container subject to vertical vibration is exactly same that of the excitation. In the case of ring-shaped magnet, the first symmetrical mode of one-half subharmonic response is dominant at lower excitation frequencies. The magnetic fluid disintegration of the free surface was also observed by a high-speed video camera system.

Computational transport phenomena of fluid-particle systems

CERN Document Server

Arastoopour, Hamid; Abbasi, Emad

2017-01-01

This book concerns the most up-to-date advances in computational transport phenomena (CTP), an emerging tool for the design of gas-solid processes such as fluidized bed systems. The authors examine recent work in kinetic theory and CTP and illustrate gas-solid processes’ many applications in the energy, chemical, pharmaceutical, and food industries. They also discuss the kinetic theory approach in developing constitutive equations for gas-solid flow systems and how it has advanced over the last decade as well as the possibility of obtaining innovative designs for multiphase reactors, such as those needed to capture CO2 from flue gases. Suitable as a concise reference and a textbook supplement for graduate courses, Computational Transport Phenomena of Gas-Solid Systems is ideal for practitioners in industries involved with the design and operation of processes based on fluid/particle mixtures, such as the energy, chemicals, pharmaceuticals, and food processing. Explains how to couple the population balance e...

Fluid mechanics phenomena in microgravity; ASME Winter Annual Meeting, Anaheim, CA, Nov. 8-13, 1992

Science.gov (United States)

Siginer, Dennis A. (Editor); Weislogel, Mark M. (Editor)

1992-01-01

This paper is the first in a series of symposia presenting research activity in microgravity fluid mechanics. General topics addressed include two-phase flow and transport phenomena, thermo-capillary flow, and interfacial stability. Papers present mathmatical models of fluid dynamics in the microgravity environment. Applications suggested include space manufacturing and storage of liquids in low gravity.

Transport phenomena and drying of solids and particulate materials

CERN Document Server

Lima, AG

2014-01-01

The purpose of this book, Transport Phenomena and Drying of Solids and Particulate Materials, is to provide a collection of recent contributions in the field of heat and mass transfer, transport phenomena, drying and wetting of solids and particulate materials. The main benefit of the book is that it discusses some of the most important topics related to the heat and mass transfer in solids and particulate materials. It includes a set of new developments in the field of basic and applied research work on the physical and chemical aspects of heat and mass transfer phenomena, drying and wetting processes, namely, innovations and trends in drying science and technology, drying mechanism and theory, equipment, advanced modelling, complex simulation and experimentation. At the same time, these topics will be going to the encounter of a variety of scientific and engineering disciplines. The book is divided in several chapters that intend to be a resume of the current state of knowledge for benefit of professional c...

Scaling of interfacial jump conditions; Escalamiento de condiciones de salto interfacial

Energy Technology Data Exchange (ETDEWEB)

Quezada G, S.; Vazquez R, A.; Espinosa P, G., E-mail: sequga@gmail.com [Universidad Autonoma Metropolitana, Unidad Iztapalapa, Area de Ingenieria en Recursos Energeticos, Apdo. Postal 55-535, 09340 Ciudad de Mexico (Mexico)

2015-09-15

To model the behavior of a nuclear reactor accurately is needed to have balance models that take into account the different phenomena occurring in the reactor. These balances have to be coupled together through boundary conditions. The boundary conditions have been studied and different treatments have been given to the interface. In this paper is a brief description of some of the interfacial jump conditions that have been proposed in recent years. Also, the scaling of an interfacial jump condition is proposed, for coupling the different materials that are in contact within a nuclear reactor. (Author)

8th International symposium on transport phenomena in combustion

Energy Technology Data Exchange (ETDEWEB)

NONE

1995-12-31

The 8th International Symposium on Transport Phenomena in Combustion will be held in San Francisco, California, U.S.A., July 16-20, 1995, under the auspices of the Pacific Center of Thermal-Fluids Engineering. The purpose of the Symposium is to provide a forum for researchers and practitioners from around the world to present new developments and discuss the state of the art and future directions and priorities in the areas of transport phenomena in combustion. The Symposium is the eighth in a series; previous venues were Honolulu 1985, Tokyo 1987, Taipei 1988, Sydney 1991, Beijing 1992, Seoul 1993 and Acapulco 1994, with emphasis on various aspects of transport phenomena. The current Symposium theme is combustion. The Symposium has assembled a balanced program with topics ranging from fundamental research to contemporary applications of combustion theory. Invited keynote lecturers will provide extensive reviews of topics of great interest in combustion. Colloquia will stress recent advances and innovations in fire spread and suppression, and in low NO{sub x} burners, furnaces, boilers, internal combustion engines, and other practical combustion systems. Finally, numerous papers will contribute to the fundamental understanding of complex processes in combustion. This document contains abstracts of papers to be presented at the Symposium.

What Controls Thermo-osmosis? Molecular Simulations Show the Critical Role of Interfacial Hydrodynamics

Science.gov (United States)

Fu, Li; Merabia, Samy; Joly, Laurent

2017-11-01

Thermo-osmotic and related thermophoretic phenomena can be found in many situations from biology to colloid science, but the underlying molecular mechanisms remain largely unexplored. Using molecular dynamics simulations, we measure the thermo-osmosis coefficient by both mechanocaloric and thermo-osmotic routes, for different solid-liquid interfacial energies. The simulations reveal, in particular, the crucial role of nanoscale interfacial hydrodynamics. For nonwetting surfaces, thermo-osmotic transport is largely amplified by hydrodynamic slip at the interface. For wetting surfaces, the position of the hydrodynamic shear plane plays a key role in determining the amplitude and sign of the thermo-osmosis coefficient. Finally, we measure a giant thermo-osmotic response of the water-graphene interface, which we relate to the very low interfacial friction displayed by this system. These results open new perspectives for the design of efficient functional interfaces for, e.g., waste-heat harvesting.

What Controls Thermo-osmosis? Molecular Simulations Show the Critical Role of Interfacial Hydrodynamics.

Science.gov (United States)

Fu, Li; Merabia, Samy; Joly, Laurent

2017-11-24

Thermo-osmotic and related thermophoretic phenomena can be found in many situations from biology to colloid science, but the underlying molecular mechanisms remain largely unexplored. Using molecular dynamics simulations, we measure the thermo-osmosis coefficient by both mechanocaloric and thermo-osmotic routes, for different solid-liquid interfacial energies. The simulations reveal, in particular, the crucial role of nanoscale interfacial hydrodynamics. For nonwetting surfaces, thermo-osmotic transport is largely amplified by hydrodynamic slip at the interface. For wetting surfaces, the position of the hydrodynamic shear plane plays a key role in determining the amplitude and sign of the thermo-osmosis coefficient. Finally, we measure a giant thermo-osmotic response of the water-graphene interface, which we relate to the very low interfacial friction displayed by this system. These results open new perspectives for the design of efficient functional interfaces for, e.g., waste-heat harvesting.

Enhanced transport phenomena in CO2 sequestration and CO2 EOR

NARCIS (Netherlands)

Farajzadeh, R.

2009-01-01

The results of this thesis give insight into the (mass)-transfer during flow of gases, especially CO2, in various gas-liquid systems. A number of experiments was performed to investigate the transport phenomena through interfaces with and without surfactant monolayers. The observed phenomena have

Interfacial Fluid Mechanics A Mathematical Modeling Approach

CERN Document Server

Ajaev, Vladimir S

2012-01-01

Interfacial Fluid Mechanics: A Mathematical Modeling Approach provides an introduction to mathematical models of viscous flow used in rapidly developing fields of microfluidics and microscale heat transfer. The basic physical effects are first introduced in the context of simple configurations and their relative importance in typical microscale applications is discussed. Then,several configurations of importance to microfluidics, most notably thin films/droplets on substrates and confined bubbles, are discussed in detail.  Topics from current research on electrokinetic phenomena, liquid flow near structured solid surfaces, evaporation/condensation, and surfactant phenomena are discussed in the later chapters. This book also:  Discusses mathematical models in the context of actual applications such as electrowetting Includes unique material on fluid flow near structured surfaces and phase change phenomena Shows readers how to solve modeling problems related to microscale multiphase flows Interfacial Fluid Me...

Stability of interfacial waves in two-phase flows

Energy Technology Data Exchange (ETDEWEB)

Liu, W S [Ontario Hydro, Toronto, ON (Canada)

1996-12-31

The influence of the interfacial pressure and the flow distribution in the one-dimensional two-fluid model on the stability problems of interfacial waves is discussed. With a proper formulation of the interfacial pressure, the following two-phase phenomena can be predicted from the stability and stationary criteria of the interfacial waves: onset of slug flow, stationary hydraulic jump in a stratified flow, flooding in a vertical pipe, and the critical void fraction of a bubbly flow. It can be concluded that the interfacial pressure plays an important role in the interfacial wave propagation of the two-fluid model. The flow distribution parameter may enhance the flow stability range, but only plays a minor role in the two-phase characteristics. (author). 20 refs., 3 tabs., 4 figs.

Prediction of interfacial area transport in a scaled 8×8 BWR rod bundle

Energy Technology Data Exchange (ETDEWEB)

Yang, X.; Schlegel, J.P.; Liu, Y.; Paranjape, S.; Hibiki, T.; Ishii, M. [School of Nuclear Engineering, Purdue University, 400 Central Dr., West Lafayette, IN 47907-2017 (United States); Bajorek, S.; Ireland, A. [U.S. Nuclear Regulatory Commission, Washington, DC 20555-0001 (United States)

2016-12-15

In the two-fluid model, it is important to give an accurate prediction for the interfacial area concentration. In order to achieve this goal, the interfacial area transport equation has been developed. This study focuses on the benchmark of IATE performance in a rod bundle geometry. A set of interfacial area concentration source and sink term models are proposed for a rod bundle geometry based on the confined channel IATE model. This model was selected as a basis because of the relative similarity of the two geometries. Benchmarking of the new model with interfacial area concentration data in an 8×8 rod bundle test section which has been scaled from an actual BWR fuel bundle is performed. The model shows good agreement in bubbly and cap-bubbly flows, which are similar in many types of geometries, while it shows some discrepancy in churn-turbulent flow regime. This discrepancy may be due to the geometrical differences between the actual rod bundle test facility and the facility used to collect the data which benchmarked the original source and sink models.

Nanoscale and microscale phenomena fundamentals and applications

CERN Document Server

Khandekar, Sameer

2015-01-01

The book is an outcome of research work in the areas of nanotechnology, interfacial science, nano- and micro-fluidics and manufacturing, soft matter, and transport phenomena at nano- and micro-scales. The contributing authors represent prominent research groups from Indian Institute of Technology Bombay, Indian Institute of Technology Kanpur and Indian Institute of Science, Bangalore. The book has 13 chapters and the entire work presented in the chapters is based on research carried out over past three years. The chapters are designed with number of coloured illustrations, figures and tables. The book will be highly beneficial to academicians as well as industrial professionals working in the mentioned areas.

Interfacial behaviour of biopolymer multilayers

NARCIS (Netherlands)

Corstens, Meinou N.; Osorio Caltenco, Lilia A.; Vries, de Renko; Schroën, Karin; Berton-Carabin, Claire C.

2017-01-01

Although multilayered emulsions have been related to reduced lipolysis, the involved interfacial phenomena have never been studied directly. In this work, we systematically built multilayers of whey protein and pectin, which we further subjected to digestive conditions, using two different

Transport phenomena of nanoparticles in plants and animals/humans.

Science.gov (United States)

Anjum, Naser A; Rodrigo, Miguel Angel Merlos; Moulick, Amitava; Heger, Zbynek; Kopel, Pavel; Zítka, Ondřej; Adam, Vojtech; Lukatkin, Alexander S; Duarte, Armando C; Pereira, Eduarda; Kizek, Rene

2016-11-01

The interaction of a plethora nanoparticles with major biota such as plants and animals/humans has been the subject of various multidisciplinary studies with special emphasis on toxicity aspects. However, reports are meager on the transport phenomena of nanoparticles in the plant-animal/human system. Since plants and animals/humans are closely linked via food chain, discussion is imperative on the main processes and mechanisms underlying the transport phenomena of nanoparticles in the plant-animal/human system, which is the main objective of this paper. Based on the literature appraised herein, it is recommended to perform an exhaustive exploration of so far least explored aspects such as reproducibility, predictability, and compliance risks of nanoparticles, and insights into underlying mechanisms in context with their transport phenomenon in the plant-animal/human system. The outcomes of the suggested studies can provide important clues for fetching significant benefits of rapidly expanding nanotechnology to the plant-animal/human health-improvements and protection as well. Copyright © 2016 Elsevier Inc. All rights reserved.

Interfacial area transport in two-phase flows in a scaled 8X8 rod bundle geometry at elevated pressures

International Nuclear Information System (INIS)

Yang, X; Schlegel, J.P.; Paranjape, S.; Liu, Y.; Chen, S.W.; Hibiki, T.; Ishii, M.

2011-01-01

To improve the prediction accuracy and robustness of the next-generation thermal-hydraulics system analysis code, analytical and experimental research has been undertaken to develop the Interfacial Area Transport Equation (IATE) in a scaled 8x8 rod bundle geometry at elevated pressure conditions. The experiments performed include local measurements of void fraction, interfacial area concentration, and gas velocity at several axial locations using the innovative four-sensor conductivity probe. The test conditions cover a wide range of flow regimes from bubbly, cap-bubbly, cap-turbulent to churn-turbulent at 100 kPa and 300 kPa pressure conditions and the obtained data indicates some spacer effects on the flow parameters. The bubble groups are classified into two groups (Group-1: spherical and distorted bubbles, Group-2: cap and churn turbulent bubbles) based on the bubble transport characteristics. The area-averaged interfacial area transport data have been compared to the prediction by the one-dimensional two-group IATE with mechanistically modeled IAC source and sink terms. The one-group IATE is able to predict the bubbly-flow interfacial area within ±15% error under two pressure conditions. The two-group IATE performance is also very promising in the cap-bubbly flow and churn-turbulent flow regimes, with average error of about ±20%. (author)

Prediction of transport phenomena in near and far field: interaction solid phase/fluid phase

International Nuclear Information System (INIS)

Mingarro, E.

1995-01-01

The prediction of transport phenomena in near and far field is presented in the present report. The study begins with the analysis of solid phases stability: solubility of storage waste: UO 2 and solubility of radionuclides the redox and sorption-desorption conditions are the last aspects studied to predict the transport phenomena

New methods for analyzing transport phenomena in supersonic ejectors

International Nuclear Information System (INIS)

Lamberts, Olivier; Chatelain, Philippe; Bartosiewicz, Yann

2017-01-01

Highlights: • Simulation of a supersonic ejector with the open source software for CFD OpenFOAM. • Validation of the numerical tool based on flow structures obtained by schlieren. • Application of the momentum and energy tube analysis tools to a supersonic ejector. • Extension of this framework to exergy to construct exergy transport tubes. • Quantification of local transfers and losses of exergy within the ejector. - Abstract: This work aims at providing novel insights into the quantification and the location of the transfers and the irreversibilities within supersonic ejectors, and their connection with the entrainment. In this study, we propose two different and complementary approaches. First of all, recent analysis tools based on momentum and energy tubes (Meyers and Meneveau (2013)) are extended to the present compressible flow context and applied to the mean-flow structure of turbulent flow within the ejector. Furthermore, the transport equation for the mean-flow total exergy is derived and exergy transport tubes are proposed as a tool for the investigation of transport phenomena within supersonic ejectors. In addition to this topological approach, an analysis based on classical stream tubes is performed in order to quantitatively investigate transfers between the primary and the secondary streams all along the ejector. Finally, the present work identifies the location of exergy losses and their origins. Throughout this analysis, new local and cumulative parameters related to transfers and irreversibilities are introduced. The proposed methodology sheds light on the complex phenomena at play and may serve as a basis for the analysis of transport phenomena within supersonic ejectors. For the ejector under consideration, although global transfers are more important in on-design conditions, it is shown that the net gain in exergy of the secondary stream is maximum for a value of the back pressure that is close to the critical back pressure, as

Spin-related transport phenomena in HgTe-based quantum well structures

International Nuclear Information System (INIS)

Koenig, Markus

2007-12-01

Within the scope of this thesis, spin related transport phenomena have been investigated in HgTe/Hg 0.3 Cd 0.7 Te quantum well structures. In our experiments, the existence of the quantum spin Hall (QSH) state was successfully demonstrated for the first time and the presented results provide clear evidence for the charge transport properties of the QSH state. Our experiments provide the first direct observation of the Aharonov-Casher (AC) effect in semiconductor structures. In conclusion, HgTe quantum well structures have proven to be an excellent template for studying spin-related transport phenomena: The QSH relies on the peculiar band structure of the material and the existence of both the spin Hall effect and the AC effect is a consequence of the substantial spin-orbit interaction. (orig.)

Spin-related transport phenomena in HgTe-based quantum well structures

Energy Technology Data Exchange (ETDEWEB)

Koenig, Markus

2007-12-15

Within the scope of this thesis, spin related transport phenomena have been investigated in HgTe/Hg{sub 0.3}Cd{sub 0.7}Te quantum well structures. In our experiments, the existence of the quantum spin Hall (QSH) state was successfully demonstrated for the first time and the presented results provide clear evidence for the charge transport properties of the QSH state. Our experiments provide the first direct observation of the Aharonov-Casher (AC) effect in semiconductor structures. In conclusion, HgTe quantum well structures have proven to be an excellent template for studying spin-related transport phenomena: The QSH relies on the peculiar band structure of the material and the existence of both the spin Hall effect and the AC effect is a consequence of the substantial spin-orbit interaction. (orig.)

Interfacial area transport of vertical upward air-water two-phase flow in an annulus at elevated pressures

International Nuclear Information System (INIS)

Ozar, Basar; Hibiki, Takashi; Ishii, Mamoru; Euh, Dong-Jin

2009-01-01

The interfacial area transport of vertical, upward, air-water two-phase flows in an annular channel has been investigated at different system pressures. The inner and outer diameters of the annular channel were 19.1 mm and 38.1 mm, respectively. Twenty three inlet flow conditions were selected, which coverED bubbly, cap-slug, and churn-turbulent flows. These flow conditions also overlapped with twelve conditions of our previous study for comparison. The local flow parameters, such as void fractions, interfacial area concentrations (IAC), and bubble interface velocities, were measured at nine radial positions for the three axial locations (z/D h =52, 149 and 230) and converted into area-averaged parameters. The axial evolutions of local flow structure was interpreted in terms of bubble coalescence, breakup, expansion of the gas-phase due to pressure drop and system pressure. An assessment of interfacial area transport equation (IATE) was made and compared with the experimental data. A discussion of the comparison between model prediction and the experimental results were made. (author)

PREFACE: Transport phenomena in proton conducting media Transport phenomena in proton conducting media

Science.gov (United States)

Eikerling, Michael

2011-06-01

Proton transport phenomena are of paramount importance for acid-base chemistry, energy transduction in biological organisms, corrosion processes, and energy conversion in electrochemical systems such as polymer electrolyte fuel cells. The relevance for such a plethora of materials and systems, and the ever-lasting fascination with the highly concerted nature of underlying processes drive research across disciplines in chemistry, biology, physics and chemical engineering. A proton never travels alone. Proton motion is strongly correlated with its environment, usually comprised of an electrolyte and a solid or soft host material. For the transport in nature's most benign proton solvent and shuttle, water that is, insights from ab initio simulations, matured over the last 15 years, have furnished molecular details of the structural diffusion mechanism of protons. Excess proton movement in water consists of sequences of Eigen-Zundel-Eigen transitions, triggered by hydrogen bond breaking and making in the surrounding water network. Nowadays, there is little debate about the validity of this mechanism in water, which bears a stunning resemblance to the basic mechanistic picture put forward by de Grotthuss in 1806. While strong coupling of an excess proton with degrees of freedom of solvent and host materials facilitates proton motion, this coupling also creates negative synergies. In general, proton mobility in biomaterials and electrochemical proton conducting media is highly sensitive to the abundance and structure of the proton solvent. In polymer electrolyte membranes, in which protons are bound to move in nano-sized water-channels, evaporation of water or local membrane dehydration due to electro-osmotic coupling are well-known phenomena that could dramatically diminish proton conductivity. Contributions in this special issue address various vital aspects of the concerted nature of proton motion and they elucidate important structural and dynamic effects of solvent

Scaling of interfacial jump conditions

International Nuclear Information System (INIS)

Quezada G, S.; Vazquez R, A.; Espinosa P, G.

2015-09-01

To model the behavior of a nuclear reactor accurately is needed to have balance models that take into account the different phenomena occurring in the reactor. These balances have to be coupled together through boundary conditions. The boundary conditions have been studied and different treatments have been given to the interface. In this paper is a brief description of some of the interfacial jump conditions that have been proposed in recent years. Also, the scaling of an interfacial jump condition is proposed, for coupling the different materials that are in contact within a nuclear reactor. (Author)

Phenomena of charged particles transport in variable magnetic fields

International Nuclear Information System (INIS)

Savane, Sy Y.; Faza Barry, M.; Vladmir, L.; Diaby, I.

2002-11-01

This present work is dedicated to the study of the dynamical phenomena for the transport of ions in the presence of variable magnetic fields in front of the Jupiter wave shock. We obtain the spectrum of the accelerated ions and we study the conditions of acceleration by solving the transport equation in the planetocentric system. We discuss the theoretical results obtained and make a comparison with the experimental parameters in the region of acceleration behind the Jupiter wave shock. (author)

Decreased Charge Transport Barrier and Recombination of Organic Solar Cells by Constructing Interfacial Nanojunction with Annealing-Free ZnO and Al Layers.

Science.gov (United States)

Liu, Chunyu; Zhang, Dezhong; Li, Zhiqi; Zhang, Xinyuan; Guo, Wenbin; Zhang, Liu; Ruan, Shengping; Long, Yongbing

2017-07-05

To overcome drawbacks of the electron transport layer, such as complex surface defects and unmatched energy levels, we successfully employed a smart semiconductor-metal interfacial nanojunciton in organic solar cells by evaporating an ultrathin Al interlayer onto annealing-free ZnO electron transport layer, resulting in a high fill factor of 73.68% and power conversion efficiency of 9.81%. The construction of ZnO-Al nanojunction could effectively fill the surface defects of ZnO and reduce its work function because of the electron transfer from Al to ZnO by Fermi level equilibrium. The filling of surface defects decreased the interfacial carrier recombination in midgap trap states. The reduced surface work function of ZnO-Al remodulated the interfacial characteristics between ZnO and [6,6]-phenyl C71-butyric acid methyl ester (PC 71 BM), decreasing or even eliminating the interfacial barrier against the electron transport, which is beneficial to improve the electron extraction capacity. The filled surface defects and reduced interfacial barrier were realistically observed by photoluminescence measurements of ZnO film and the performance of electron injection devices, respectively. This work provides a simple and effective method to simultaneously solve the problems of surface defects and unmatched energy level for the annealing-free ZnO or other metal oxide semiconductors, paving a way for the future popularization in photovoltaic devices.

Study of interfacial phenomena for bio/chemical sensing applications

Science.gov (United States)

Min, Hwall

This work presents the fundamental study of biological and chemical interfacial phenomena and (bio)chemical sensing applications using high frequency resonator arrays. To realize a versatile (bio)chemical sensing system for the fundamental study as well as their practical applications, the following three distinct components were studied and developed: i) detection platforms with high sensitivity, ii) novel innovative sensing materials with high selectivity, iii) analytical model for data interpretation. 8-pixel micromachined quartz crystal resonator (muQCR) arrays with a fundamental resonance frequency of 60 ¡V 90 MHz have been used to provide a reliable detection platform with high sensitivity. Room temperature ionic liquid (RTIL) has been explored and integrated into the sensing system as a smart chemical sensing material. The use of nanoporous gold (np-Au) enables the combination of the resonator and surface-enhanced Raman spectroscopy for both quantitative and qualitative measurement. A statistical model for the characterization of resonator behavior to study the protein adsorption kinetics is developed by random sequential adsorption (RSA) approach with the integration of an effective surface depletion theory. The investigation of the adsorption kinetics of blood proteins is reported as the fundamental study of biological phenomena using the proposed sensing system. The aim of this work is to study different aspects of protein adsorption and kinetics of adsorption process with blood proteins on different surfaces. We specifically focus on surface depletion effect in conjunction with the RSA model to explain the observed adsorption isotherm characteristics. A number of case studies on protein adsorption conducted using the proposed sensing system has been discussed. Effort is specifically made to understand adsorption kinetics, and the effect of surface on the adsorption process as well as the properties of the adsorbed protein layer. The second half of the

Interfacial transport characteristics in a gas-liquid or an immiscible liquid-liquid stratified flow

International Nuclear Information System (INIS)

Inoue, A.; Aoki, S.; Aritomi, M.; Kozawa, Y.

1982-01-01

This paper is a review for an interfacial transport characteristics of mass, momentum and energy in a gas-liquid or a immiscible liquid-liquid stratified flow with wavy interface which have been studied in our division. In the experiment, a characteristic of wave motion and its effect to the turbulence near the interface as well as overall flow characteristics like pressure drop, position of the interface were investigated in an air-water, an air-mercury and a water-liquid metal stratified flow. On the other hand, several models based on the mixing length model and a two-equation model of turbulence, with special interfacial boundary conditions in which the wavy surface was regarded as a rough surface correspond to the wavy height, a source of turbulent energy equal to the wave energy and a damped-turbulence due to the surface tension, were proposed to predict the flow characteristics and the interfacial heat transfer in a fully developed and an undeveloped stratified flow and examined by the experimental data. (author)

Modeling in transport phenomena a conceptual approach

CERN Document Server

Tosun, Ismail

2007-01-01

Modeling in Transport Phenomena, Second Edition presents and clearly explains with example problems the basic concepts and their applications to fluid flow, heat transfer, mass transfer, chemical reaction engineering and thermodynamics. A balanced approach is presented between analysis and synthesis, students will understand how to use the solution in engineering analysis. Systematic derivations of the equations and the physical significance of each term are given in detail, for students to easily understand and follow up the material. There is a strong incentive in science and engineering to

Numerical simulations of air–water cap-bubbly flows using two-group interfacial area transport equation

International Nuclear Information System (INIS)

Wang, Xia; Sun, Xiaodong

2014-01-01

Highlights: • Two-group interfacial area transport equation was implemented into a three-field two-fluid model in Fluent. • Numerical model was developed for cap-bubbly flows in a narrow rectangular flow channel. • Numerical simulations were performed for cap-bubbly flows with uniform void inlets and with central peaked void inlets. • Code simulations showed a significant improve over the conventional two-fluid model. - Abstract: Knowledge of cap-bubbly flows is of great interest due to its role in understanding of the flow regime transition from bubbly to slug or churn-turbulent flows. One of the key characteristics of such flows is the existence of bubbles in different sizes and shapes associated with their distinctive dynamic natures. This important feature is, however, generally not well captured by many available two-phase flow modeling approaches. In this study, a modified two-fluid model, namely a three-field, two-fluid model, is proposed. In this model, bubbles are categorized into two groups, i.e., spherical/distorted bubbles as Group-1 while cap/churn-turbulent bubbles as Group-2. A two-group interfacial area transport equation (IATE) is implemented to describe dynamic changes of interfacial structure in each bubble group, resulting from intra- and inter-group interactions and phase changes due to evaporation and condensation. Attention is also paid to appropriate constitutive relations of the interfacial transfers due to mechanical and thermal non-equilibrium between the different fields. The proposed three-field, two-fluid model is used to predict the phase distributions of adiabatic air–water flows in a confined rectangular duct. Good agreement between the simulation results from the proposed model and relevant experimental data indicates that the proposed model is promising as an improved computational tool for two-phase cap-bubbly flow simulations in rectangular flow ducts

Lattice Boltzmann modeling of transport phenomena in fuel cells and flow batteries

Science.gov (United States)

Xu, Ao; Shyy, Wei; Zhao, Tianshou

2017-06-01

Fuel cells and flow batteries are promising technologies to address climate change and air pollution problems. An understanding of the complex multiscale and multiphysics transport phenomena occurring in these electrochemical systems requires powerful numerical tools. Over the past decades, the lattice Boltzmann (LB) method has attracted broad interest in the computational fluid dynamics and the numerical heat transfer communities, primarily due to its kinetic nature making it appropriate for modeling complex multiphase transport phenomena. More importantly, the LB method fits well with parallel computing due to its locality feature, which is required for large-scale engineering applications. In this article, we review the LB method for gas-liquid two-phase flows, coupled fluid flow and mass transport in porous media, and particulate flows. Examples of applications are provided in fuel cells and flow batteries. Further developments of the LB method are also outlined.

Fundamental study on interfacial area transport model (I) (contract research)

International Nuclear Information System (INIS)

Mishima, Kaichiro; Nakamura, Hideo

2001-03-01

Recently, improvement in the best-estimate (BE) code predictive capability is attempted by incorporating the interfacial area transport model (IATM) into a one-dimensional two-fluid model to represent gas-liquid two-phase flows in detail with less uncertainty in the flow predictions. Internationally, the nuclear regulatory commission (NRC) and Purdue University in the U.S.A. and CEA in France have promoted the renewal of their BE codes such as TRAC, RELAP5 and CATHARE, by introducing the IATM in cooperative manner. In Japan, JAERI is underway to develop a one-dimensional code based primarily on the IATM against the licensing procedures of next-generation nuclear reactors. The IATM has a possibility to correctly predict flow transient along flow path for such flows as developing flows, multi-dimensional flows, transitional flows, boiling flows, which are difficult to accurately predict by the two-fluid models employed in the current BE codes. The newly developed code with the IATM would dramatically improve the accuracy in the flow prediction. The model, however, is under development and needs great effort to overcome many difficulties with plenty of theoretical considerations based on much of data bases to be acquired further. This study attempts to measure interfacial area in air-water two-phase flows in a large-diameter tube to understand the characteristic of multi-dimensional flows that usually appear in large-diameter tube flows, and provide data bases, to contribute the development of the IATM. The results obtained by such institutes as Purdue University and CEA France were reviewed first. Clarified are the current status and problems of the IATM, basics and practical methods to measure the interfacial area using multi-sensor miniature local probes; metal needle electro-resistance probe and fiber-optic probe. It was found that the applicability of the IATM is limited mostly to a one-dimensional bubbly flow, and is far from satisfactory for multi

Numerical simulation of the transport phenomena due to sudden heating in porous media

Energy Technology Data Exchange (ETDEWEB)

Lei, S.Y.; Zheng, G.Y.; Wang, B.X.; Yang, R.G.; Xia, C.M.

1997-07-01

Such process as wet porous media suddenly heated by hot fluids frequently occurs in nature and in industrial applications. The three-variable simulation model was developed to predict violent transport phenomena due to sudden heating in porous media. Two sets of independent variables were applied to different regions in porous media in the simulation. For the wet zone, temperature, wet saturation and air pressure were used as the independent variables. For the dry zone, the independent variables were temperature, vapor pressure and air pressure. The model simulated two complicated transport processes in wet unsaturated porous media which is suddenly heated by melting metal or boiling water. The effect of the gas pressure is also investigated on the overall transport phenomena.

Modelling transport phenomena in a multi-physics context

Energy Technology Data Exchange (ETDEWEB)

Marra, Francesco [Dipartimento di Ingegneria Chimica e Alimentare - Università degli studi di Salerno Via Ponte Don Melillo - 84084 Fisciano SA (Italy)

2015-01-22

Innovative heating research on cooking, pasteurization/sterilization, defrosting, thawing and drying, often focuses on areas which include the assessment of processing time, evaluation of heating uniformity, studying the impact on quality attributes of the final product as well as considering the energy efficiency of these heating processes. During the last twenty years, so-called electro-heating-processes (radio-frequency - RF, microwaves - MW and ohmic - OH) gained a wide interest in industrial food processing and many applications using the above mentioned technologies have been developed with the aim of reducing processing time, improving process efficiency and, in many cases, the heating uniformity. In the area of innovative heating, electro-heating accounts for a considerable portion of both the scientific literature and commercial applications, which can be subdivided into either direct electro-heating (as in the case of OH heating) where electrical current is applied directly to the food or indirect electro-heating (e.g. MW and RF heating) where the electrical energy is firstly converted to electromagnetic radiation which subsequently generates heat within a product. New software packages, which make easier solution of PDEs based mathematical models, and new computers, capable of larger RAM and more efficient CPU performances, allowed an increasing interest about modelling transport phenomena in systems and processes - as the ones encountered in food processing - that can be complex in terms of geometry, composition, boundary conditions but also - as in the case of electro-heating assisted applications - in terms of interaction with other physical phenomena such as displacement of electric or magnetic field. This paper deals with the description of approaches used in modelling transport phenomena in a multi-physics context such as RF, MW and OH assisted heating.

Modelling transport phenomena in a multi-physics context

Science.gov (United States)

Marra, Francesco

2015-01-01

Innovative heating research on cooking, pasteurization/sterilization, defrosting, thawing and drying, often focuses on areas which include the assessment of processing time, evaluation of heating uniformity, studying the impact on quality attributes of the final product as well as considering the energy efficiency of these heating processes. During the last twenty years, so-called electro-heating-processes (radio-frequency - RF, microwaves - MW and ohmic - OH) gained a wide interest in industrial food processing and many applications using the above mentioned technologies have been developed with the aim of reducing processing time, improving process efficiency and, in many cases, the heating uniformity. In the area of innovative heating, electro-heating accounts for a considerable portion of both the scientific literature and commercial applications, which can be subdivided into either direct electro-heating (as in the case of OH heating) where electrical current is applied directly to the food or indirect electro-heating (e.g. MW and RF heating) where the electrical energy is firstly converted to electromagnetic radiation which subsequently generates heat within a product. New software packages, which make easier solution of PDEs based mathematical models, and new computers, capable of larger RAM and more efficient CPU performances, allowed an increasing interest about modelling transport phenomena in systems and processes - as the ones encountered in food processing - that can be complex in terms of geometry, composition, boundary conditions but also - as in the case of electro-heating assisted applications - in terms of interaction with other physical phenomena such as displacement of electric or magnetic field. This paper deals with the description of approaches used in modelling transport phenomena in a multi-physics context such as RF, MW and OH assisted heating.

Modelling transport phenomena in a multi-physics context

International Nuclear Information System (INIS)

Marra, Francesco

2015-01-01

Innovative heating research on cooking, pasteurization/sterilization, defrosting, thawing and drying, often focuses on areas which include the assessment of processing time, evaluation of heating uniformity, studying the impact on quality attributes of the final product as well as considering the energy efficiency of these heating processes. During the last twenty years, so-called electro-heating-processes (radio-frequency - RF, microwaves - MW and ohmic - OH) gained a wide interest in industrial food processing and many applications using the above mentioned technologies have been developed with the aim of reducing processing time, improving process efficiency and, in many cases, the heating uniformity. In the area of innovative heating, electro-heating accounts for a considerable portion of both the scientific literature and commercial applications, which can be subdivided into either direct electro-heating (as in the case of OH heating) where electrical current is applied directly to the food or indirect electro-heating (e.g. MW and RF heating) where the electrical energy is firstly converted to electromagnetic radiation which subsequently generates heat within a product. New software packages, which make easier solution of PDEs based mathematical models, and new computers, capable of larger RAM and more efficient CPU performances, allowed an increasing interest about modelling transport phenomena in systems and processes - as the ones encountered in food processing - that can be complex in terms of geometry, composition, boundary conditions but also - as in the case of electro-heating assisted applications - in terms of interaction with other physical phenomena such as displacement of electric or magnetic field. This paper deals with the description of approaches used in modelling transport phenomena in a multi-physics context such as RF, MW and OH assisted heating

Interfacial structures in downward two-phase bubbly flow

International Nuclear Information System (INIS)

Paranjape, S.S.; Kim, S.; Ishii, M.; Kelly, J.

2003-01-01

Downward two-phase flow was studied considering its significance in view of Light Water Reactor Accidents (LWR) such as Loss of Heat Sink (LOHS) by feed water loss or secondary pipe break. The flow studied, was an adiabatic, air-water, co-current, vertically downward two-phase flow. The experimental test sections had internal hydraulic diameters of 25.4 mm and 50.8 mm. Flow regime map was obtained using the characteristic signals obtained from an impedance void meter, employing neural network based identification methodology to minimize the subjective judgment in determining the flow regimes. A four sensor conductivity probe was used to measure the local two phase flow parameters, which characterize the interfacial structures. The local time averaged two-phase flow parameters measured were: void fraction (α), interfacial area concentration (a i ), bubble velocity (v g ), and Sauter mean diameter (D Sm ). The flow conditions were from the bubbly flow regime. The local profiles of these parameters as well as their axial development revealed the nature of the interfacial structures and the bubble interaction mechanisms occurring in the flow. Furthermore, this study provided a good database for the development of the interfacial area transport equation, which dynamically models the changes in the interfacial area along the flow field. An interfacial area transport equation was developed for downward flow based on that developed for the upward flow, with certain modifications in the bubble interaction terms. The area averaged values of the interfacial area concentration were compared with those predicted by the interfacial area transport model. (author)

Development of two-group interfacial area transport equation for confined flow-1. Modeling of bubble interactions

International Nuclear Information System (INIS)

Sun, Xiaodong; Kim, Seungjin; Ishii, Mamoru; Beus, Stephen G.

2003-01-01

This paper presents the modeling of bubble interaction mechanisms in the two-group interfacial area transport equation (IATE) for confined gas-liquid two-phase flow. The transport equation is applicable to bubbly, cap-turbulent, and churn-turbulent flow regimes. In the two-group IATE, bubbles are categorized into two groups: spherical/distorted bubbles as Group 1 and cap/slug/churn-turbulent bubbles as Group 2. Thus, two sets of equations are used to describe the generation and destruction rates of bubble number density, void fraction, and interfacial area concentration for the two groups of bubbles due to bubble expansion and compression, coalescence and disintegration, and phase change. Five major bubble interaction mechanisms are identified for the gas-liquid two-phase flow of interest, and are analytically modeled as the source/sink terms for the transport equations based on certain assumptions for the confined flow. These models include both intra-group (within a certain group) and inter-group (between two groups) bubble interactions. The comparisons of the prediction by the one-dimensional two-group IATE with experimental data are presented in the second paper of this series. (author)

Transport phenomena in porous media

CERN Document Server

Ingham, Derek B

1998-01-01

Research into thermal convection in porous media has substantially increased during recent years due to its numerous practical applications. These problems have attracted the attention of industrialists, engineers and scientists from many very diversified disciplines, such as applied mathematics, chemical, civil, environmental, mechanical and nuclear engineering, geothermal physics and food science. Thus, there is a wealth of information now available on convective processes in porous media and it is therefore appropriate and timely to undertake a new critical evaluation of this contemporary information. Transport Phenomena in Porous Media contains 17 chapters and represents the collective work of 27 of the world's leading experts, from 12 countries, in heat transfer in porous media. The recent intensive research in this area has substantially raised the expectations for numerous new practical applications and this makes the book a most timely addition to the existing literature. It includes recent major deve...

Modeling and measurement of interfacial area concentration in two-phase flow

International Nuclear Information System (INIS)

Paranjape, Sidharth; Ishii, Mamoru; Hibiki, Takashi

2010-01-01

This paper presents experimental and modeling approaches in characterizing interfacial structures in gas-liquid two-phase flow. For the modeling of the interfacial structure characterization, the interfacial area transport equation proposed earlier has been studied to provide a dynamic and mechanistic prediction tool for two-phase flow analysis. A state-of-the-art four-sensor conductivity probe technique has been developed to obtain detailed local interfacial structure information in a wide range of flow regimes spanning from bubbly to churn-turbulent flows. Newly obtained interfacial area data in 8 x 8 rod-bundle test section are also presented. This paper also reviews available models of the interfacial area sink and source terms and existing databases. The interfacial area transport equation has been benchmarked using condensation bubbly flow data.

Final report, BWR drywell debris transport Phenomena Identification and Ranking Tables (PIRTs)

International Nuclear Information System (INIS)

Wilson, G.E.; Boyack, B.E.; Leonard, M.T.; Williams, K.A.; Wolf, L.T.

1997-09-01

The Nuclear Regulatory Commission has issued a Regulatory Bulletin and accompanying Regulatory Guide (1.82, Rev. 2) which requires licensees of boiling water reactors to develop a specific plan of action (including hardware backfits, if necessary) to preclude the possibility of early emergency core cooling system strainer blockage following a postulated loss-of-coolant-accident. The postulated mechanism for strainer blockage is destruction of piping insulation in the vicinity of the break and subsequent transport of fragmented insulation to the wetwell. In the absence of more definitive information, the Regulatory Guide recommends that licensees assume a drywell debris transport fraction of 1.0. Accordingly, the Nuclear Regulatory Commission initiated research focused toward developing a technical basis to provide insights useful to regulatory oversight of licensee submittals associated with resolution of the postulated strainer blockage issue. Part of this program was directed towards experimental and analytical research leading to a more realistic specification of the debris transport through the drywell to the wetwell. To help focus this development into a cost effective effort, a panel, with broad based knowledge and experience, was formed to address the relative importance of the various phenomena that can be expected in plant response to postulated accidents that may produce strainer blockage. The resulting phenomena identification and ranking tables reported herein were used to help guide research. The phenomena occurring in boiling water reactors drywells was the specific focus of the panel, although supporting experimental data and calculations of debris transport fractions were considered

Interfacial effects in a multistage mixer-settler operation

International Nuclear Information System (INIS)

Jiinshiung Horng; Daluh Lu; Yingchu Hoh

1988-01-01

A pilot-scale mixer-settler with twenty-one stages was used to investigate the interfacial tension change during extraction cycle for the complicated system: NdCl 3 -SmCl 3 -EuCl 3 -GdCl 3 -TbCl 3 -DyCl 3 -HCl- 1 M D2EHPA-kerosene. Interfacial tension, total rare earth (TRE) concentrations in both phases, aqueous acidities, and organic entrainment in the raffinate, etc., were measured for each stage. Murphree stage efficiencies based on organic phase were calculated and related to the interfacial tension profiles. In general, the lower the interfacial tension, the higher the stage efficiency observed. For the extraction section, the stage efficiency ranged from 80% - 100%, but for stripping (including scrubbing) section, it varied from 100% - 15%. For high acidic stripping agent, 5 M HCl, the relatively lower stage efficiency might be due to the protonation of the acidic extractant, therefore the interfacial resistance increased significantly. From the information of stage efficiency, mass transfer direction, and interfacial tension versus solute concentration etc., the Marangoni effect could be used to explain the interfacial phenomena of this complicated extraction system. The results of real stream tests in this investigation will be useful in future plant design. (author)

Comparison of crude oil interfacial behavior

Energy Technology Data Exchange (ETDEWEB)

Beetge, J.H.; Panchev, N. [Champion Technologies Inc., Fresno, TX (United States)

2008-07-01

The bulk properties of crude oil are used to predict its behaviour with regards to treatment, transport and processing. Surface active components, such as asphaltenes, are often used to study or explain critical interfacial behaviour of crude oil. This study investigated the differences and similarities in the interfacial behaviour of the collective surface active component in various crude oils from different sources. The properties of interfaces between crude oil and water were compared using a Teclis drop shape tensiometer. A portion of a crude oil sample was diluted in toluene and contacted with water in a rising drop configuration. Dynamic surface tension and interfacial rheology was examined as a function of time from the early stages of interface formation. Sinusoidal oscillation of the drop volume allowed for the evaluation of visco-elastic behaviour of the crude oil/water interface as it developed with time. The Gibbs elastic modulus, as well as its elastic and viscose components were calculated from the drop shape. The interfacial behaviour was expressed in terms of concentration, oscillation frequency and interface age. It was concluded that knowledge of crude oil interfacial character could be of value in the treatment, transport and processing of crude oils because the its behaviour may play a significant role in crude oil production and processing.

Tokamak fuelling with pellets: Effect of transport phenomena on the injection requirements

International Nuclear Information System (INIS)

Lengyel, L.L.

1979-01-01

Results of calculations on pellet-plasma interaction that take into account transport phenomena inherent in tokamak plasmas are analyzed. It is shown that the results obtained by different authors on the optimum pellet penetration depth and required pellet injection frequencies, which are partly contradictory, can be explained by means of the different transport processes taken into account or neglected in the calculations concerned. (orig.)

Finite-orbit-width effect and the radial electric field in neoclassical transport phenomena

International Nuclear Information System (INIS)

Satake, S.; Okamoto, M.; Nakajima, N.; Sugama, H.; Yokoyama, M.; Beidler, C.D.

2005-01-01

Modeling and detailed simulation of neoclassical transport phenomena both in 2D and 3D toroidal configurations are shown. The emphasis is put on the effect of finiteness of the drift-orbit width, which brings a non-local nature to neoclassical transport phenomena. Evolution of the self-consistent radial electric field in the framework of neoclassical transport is also investigated. The combination of Monte-Carlo calculation for ion transport and numerical solver of ripple-averaged kinetic equation for electrons makes it possible to calculate neoclassical fluxes and the time evolution of the radial electric field in the whole plasma region, including the finite-orbit-width (FOW) effects and global evolution of geodesic acoustic mode (GAM). The simulation results show that the heat conductivity around the magnetic axis is smaller than that obtained from standard neoclassical theory and that the evolution of GAM oscillation on each flux surface is coupled with other surfaces if the FOW effect is significant. A global simulation of radial electric field evolution in a non-axisymmetric plasma is also shown. (author)

Development and validation of bubble breakup and coalescence constitutive models for the one-group interfacial area transport equation

International Nuclear Information System (INIS)

Pellacani, Filippo

2012-01-01

A local mechanistic model for bubble coalescence and breakup for the one-group interfacial area transport equation has been developed, in agreement and within the limits of the current understanding, based on an exhaustive survey of the theory and of the state of the art models for bubble dynamics simulation. The new model has been tested using the commercial 3D CFD code ANSYS CFX. Upward adiabatic turbulent air-water bubbly flow has been simulated and the results have been compared with the data obtained in the experimental facility PUMA. The range of the experimental data available spans between 0.5 to 2 m/s liquid velocity and 5 to 15 % volume fraction. For the implementation of the models, both the monodispersed and the interfacial area transport equation approaches have been used. The first one to perform a detailed analysis of the forces and models to reproduce the dynamic of the dispersed phase adequately and to be used in the next phases of the work. Also two different bubble induced turbulence models have been tested to consider the effect of the presence of the gas phase on the turbulence of the liquid phase. The interfacial area transport equation has been successfully implemented into the CFD code and the state of the art breakup and coalescence models have been used for simulation. The limitations of the actual theory have been shown and a new bubble interactions model has been developed. The simulations showed that a considerable improvement is achieved if compared to the state of the art closure models. Limits in the implementation derive from the actual understanding and formulation of the bubbly dynamics. A strong dependency on the interfacial non-drag force models and coefficients have been shown. More experimental and theory work needs to be done in this field to increase the prediction capability of the simulation tools regarding the distribution of the phases along the pipe radius.

Transport phenomena in alkaline direct ethanol fuel cells for sustainable energy production

Science.gov (United States)

An, L.; Zhao, T. S.

2017-02-01

Alkaline direct ethanol fuel cells (DEFC), which convert the chemical energy stored in ethanol directly into electricity, are one of the most promising energy-conversion devices for portable, mobile and stationary power applications, primarily because this type of fuel cell runs on a carbon-neutral, sustainable fuel and the electrocatalytic and membrane materials that constitute the cell are relatively inexpensive. As a result, the alkaline DEFC technology has undergone a rapid progress over the last decade. This article provides a comprehensive review of transport phenomena of various species in this fuel cell system. The past investigations into how the design and structural parameters of membrane electrode assemblies and the operating parameters affect the fuel cell performance are discussed. In addition, future perspectives and challenges with regard to transport phenomena in this fuel cell system are also highlighted.

Kinetic theory of nonlinear transport phenomena in complex plasmas

International Nuclear Information System (INIS)

Mishra, S. K.; Sodha, M. S.

2013-01-01

In contrast to the prevalent use of the phenomenological theory of transport phenomena, a number of transport properties of complex plasmas have been evaluated by using appropriate expressions, available from the kinetic theory, which are based on Boltzmann's transfer equation; in particular, the energy dependence of the electron collision frequency has been taken into account. Following the recent trend, the number and energy balance of all the constituents of the complex plasma and the charge balance on the particles is accounted for; the Ohmic loss has also been included in the energy balance of the electrons. The charging kinetics for the complex plasma comprising of uniformly dispersed dust particles, characterized by (i) uniform size and (ii) the Mathis, Rumpl, and Nordsieck power law of size distribution has been developed. Using appropriate expressions for the transport parameters based on the kinetic theory, the system of equations has been solved to investigate the parametric dependence of the complex plasma transport properties on the applied electric field and other plasma parameters; the results are graphically illustrated.

Interfacial thermal conductance in multilayer graphene/phosphorene heterostructure

International Nuclear Information System (INIS)

Zhang, Ying-Yan; Pei, Qing-Xiang; Mai, Yiu-Wing; Lai, Siu-Kai

2016-01-01

Vertical integration of 2D materials has recently appeared as an effective method for the design of novel nano-scale devices. Using non-equilibrium molecular dynamics simulations, we study the interfacial thermal transport property of graphene/phosphorene heterostructures where phosphorene is sandwiched in between graphene. Various modulation techniques are thoroughly explored. We found that the interfacial thermal conductance at the interface of graphene and phosphorene can be enhanced significantly by using vacancy defects, hydrogenation and cross-plane compressive strain. By contrast, the reduction in the interfacial thermal conductance can be achieved by using cross-plane tensile strain. Our results provide important guidelines for manipulating the thermal transport in graphene/phosphorene based-nano-devices. (paper)

Interfacial transport processes and rheology

CERN Document Server

Brenner, Howard

1991-01-01

This textbook is designed to provide the theory, methods of measurement, and principal applications of the expanding field of interfacial hydrodynamics. It is intended to serve the research needs of both academic and industrial scientists, including chemical or mechanical engineers, material and surface scientists, physical chemists, chemical and biophysicists, rheologists, physiochemical hydrodynamicists, and applied mathematicians (especially those with interests in viscous fluid mechanics and continuum mechanics).As a textbook it provides materials for a one- or two-semester graduate-level

Macroscopic Modeling of Transport Phenomena in Direct Methanol Fuel Cells

DEFF Research Database (Denmark)

Olesen, Anders Christian

An increasing need for energy efficiency and high energy density has sparked a growing interest in direct methanol fuel cells for portable power applications. This type of fuel cell directly generates electricity from a fuel mixture consisting of methanol and water. Although this technology...... surpasses batteries in important areas, fundamental research is still required to improve durability and performance. Particularly the transport of methanol and water within the cell structure is difficult to study in-situ. A demand therefore exist for the fundamental development of mathematical models...... for studying their transport. In this PhD dissertation the macroscopic transport phenomena governing direct methanol fuel cell operation are analyzed, discussed and modeled using the two-fluid approach in the computational fluid dynamics framework of CFX 14. The overall objective of this work is to extend...

Transport phenomena through porous screens and openings : from theory to greenhouse practice

NARCIS (Netherlands)

Miguel, A.A.F.

1998-01-01

The study of transport phenomena in multi-zone enclosures with permeable boundaries is fundamental for indoor climate control management. In this study, aspects concerning the air exchange through porous screens and openings, and heat transfer between the enclosure surface and inside air,

Minimizing performance degradation induced by interfacial recombination in perovskite solar cells through tailoring of the transport layer electronic properties

Directory of Open Access Journals (Sweden)

Liang Xu

2018-03-01

Full Text Available The performance of hybrid organic-inorganic metal halide perovskite solar cells is investigated using one-dimensional drift-diffusion device simulations. We study the effects of interfacial defect density, doping concentration, and electronic level positions of the charge transport layer (CTL. Choosing CTLs with a favorable band alignment, rather than passivating CTL-perovskite interfacial defects, is shown to be beneficial for maintaining high power-conversion efficiency, due to reduced minority carrier density arising from a favorable local electric field profile. Insights from this study provide theoretical guidance on practical selection of CTL materials for achieving high-performance perovskite solar cells.

Proceedings of the Fifth Microgravity Fluid Physics and Transport Phenomena Conference

Science.gov (United States)

Singh, Bhim S. (Editor)

2000-01-01

The Fifth Microgravity Fluid Physics and Transport Phenomena Conference provided the scientific community the opportunity to view the current scope of the Microgravity Fluid Physics and Transport Phenomena Program and research opportunities and plans for the near future. Consistent with the conference theme "Microgravity Research an Agency-Wide Asset" the conference focused not only on fundamental research but also on applications of this knowledge towards enabling future space exploration missions. The conference included 14 invited plenary talks, 61 technical paper presentations, 61 poster presentations, exhibits and a forum on emerging research themes focusing on nanotechnology and biofluid mechanics. This web-based proceeding includes the presentation and poster charts provided by the presenters of technical papers and posters that were scanned at the conference site. Abstracts of all the papers and posters are included and linked to the presentations charts. The invited and plenary speakers were not required to provide their charts and are generally not available for scanning and hence not posted. The conference program is also included.

State-of-the-art report on the theoretical modeling of interfacial area concentration

International Nuclear Information System (INIS)

Lee, Won Jae; Euh, Dong Jin

1998-03-01

Classical approaches based on experimental correlations and the mechanistic approaches based on the interfacial area concentration were reviewed. The study focuses on the state-of-the-art researches based on the mechanistic modeling of the interfacial area concentration. The investigation is performed by classifying the mechanistic modeling approaches into those using the number density transport equations supported with a simple algebraic relation for obtaining interfacial area concentration and those using the direct interfacial area transport equations. The modeling approaches are subdivided into one group and multi-group models. The state-of-the-art source terms of transport equations are also investigated for their applicability and limitations. (author). 62 refs., 6 tabs., 49 figs

Development of instrumentation in the transport phenomena research in thermal equipment

International Nuclear Information System (INIS)

Carvalho Tofani, P. de; Ladeira, L.C.D.

1983-11-01

The results obtained from the effort on the acquisition of know-how in experimental reactor thermal during the last years, through the approach of relevant aspects of basic research on transport phenomena applicable to nuclear reactor analysis and conventional thermal equipment based in the simultaneous development of instrumentation and experimental methods are presented. (E.G.) [pt

Center for Electrocatalysis, Transport Phenomena, and Materials (CETM) for Innovative Energy Storage - Final Report

Energy Technology Data Exchange (ETDEWEB)

Soloveichik, Grigorii [GE Global Research, Niskayuna, New York (United States)

2015-11-30

EFRC vision. The direct use of organic hydrides in fuel cells as virtual hydrogen carriers that generate stable organic molecules, protons, and electrons upon electro-oxidation and can be electrochemically charged by re-hydrogenating the oxidized carrier was the major focus of the Center for Electrocatalysis, Transport Phenomena and Materials for Innovative Energy Storage (EFRC-ETM). Compared to a hydrogen-on-demand design that includes thermal decomposition of organic hydrides in a catalytic reactor, the proposed approach is much simpler and does not require additional dehydrogenation catalysts or heat exchangers. Further, this approach utilizes the advantages of a flow battery (i.e., separation of power and energy, ease of transport and storage of liquid fuels) with fuels that have system energy densities similar to current hydrogen PEM fuel cells. EFRC challenges. Two major EFRC challenges were electrocatalysis and transport phenomena. The electrocatalysis challenge addresses fundamental processes which occur at a single molecular catalyst (microscopic level) and involve electron and proton transfer between the hydrogen rich and hydrogen depleted forms of organic liquid fuel and the catalyst. To form stable, non-radical dehydrogenation products from the organic liquid fuel, it is necessary to ensure fast transport of at least two electrons and two protons (per double bond formation). The same is true for the reverse hydrogenation reaction. The transport phenomena challenge addresses transport of electrons to/from the electrocatalyst and the current collector as well as protons across the polymer membrane. Additionally it addresses prevention of organic liquid fuel, water and oxygen transport through the PEM. In this challenge, the transport of protons or molecules involves multiple sites or a continuum (macroscopic level) and water serves as a proton conducting medium for the majority of known sulfonic acid based PEMs. Proton transfer in the presence of

Thermo-fluidic devices and materials inspired from mass and energy transport phenomena in biological system

Institute of Scientific and Technical Information of China (English)

Jian XIAO; Jing LIU

2009-01-01

Mass and energy transport consists of one of the most significant physiological processes in nature, which guarantees many amazing biological phenomena and activ-ities. Borrowing such idea, many state-of-the-art thermo-fluidic devices and materials such as artificial kidneys, carrier erythrocyte, blood substitutes and so on have been successfully invented. Besides, new emerging technologies are still being developed. This paper is dedicated to present-ing a relatively complete review of the typical devices and materials in clinical use inspired by biological mass and energy transport mechanisms. Particularly, these artificial thermo-fluidic devices and materials will be categorized into organ transplantation, drug delivery, nutrient transport, micro operation, and power supply. Potential approaches for innovating conventional technologies were discussed, corresponding biological phenomena and physical mechan-isms were interpreted, future promising mass-and-energy-transport-based bionic devices were suggested, and prospects along this direction were pointed out. It is expected that many artificial devices based on biological mass and energy transport principle will appear to better improve vari-ous fields related to human life in the near future.

Enhanced interfacial thermal transport in pnictogen tellurides metallized with a lead-free solder alloy

Energy Technology Data Exchange (ETDEWEB)

Devender,; Ramanath, Ganpati, E-mail: Ramanath@rpi.edu [Department of Materials Science and Engineering, Rensselaer Polytechnic Institute, Troy, New York 12180 (United States); Lofgreen, Kelly; Devasenathipathy, Shankar; Swan, Johanna; Mahajan, Ravi [Intel Corporation, Assembly Test and Technology Development, Chandler, Arizona 85226 (United States); Borca-Tasciuc, Theodorian [Department of Mechanical Aerospace and Nuclear Engineering, Rensselaer Polytechnic Institute, Troy, New York 12180 (United States)

2015-11-15

Controlling thermal transport across metal–thermoelectric interfaces is essential for realizing high efficiency solid-state refrigeration and waste-heat harvesting power generation devices. Here, the authors report that pnictogen chalcogenides metallized with bilayers of Sn{sub 96.5}Ag{sub 3}Cu{sub 0.5} solder and Ni barrier exhibit tenfold higher interfacial thermal conductance Γ{sub c} than that obtained with In/Ni bilayer metallization. X-ray diffraction and x-ray spectroscopy indicate that reduced interdiffusion and diminution of interfacial SnTe formation due to Ni layer correlates with the higher Γ{sub c}. Finite element modeling of thermoelectric coolers metallized with Sn{sub 96.5}Ag{sub 3}Cu{sub 0.5}/Ni bilayers presages a temperature drop ΔT ∼ 22 K that is 40% higher than that obtained with In/Ni metallization. Our results underscore the importance of controlling chemical intermixing at solder–metal–thermoelectric interfaces to increase the effective figure of merit, and hence, the thermoelectric cooling efficiency. These findings should facilitate the design and development of lead-free metallization for pnictogen chalcogenide-based thermoelectrics.

Interfacial pH-gradient induced micro-capillary filling with the aid of transverse electrodes arrays in presence of electrical double layer effects

International Nuclear Information System (INIS)

Jain, Avi; Chakraborty, Suman

2010-01-01

In the present work, we outline the design and analysis of a micro-capillary filling mechanism through the aid of interfacial pH gradients (and hence interfacial tension gradients) generated by employing arrays of transverse electrodes inducing step changes in voltages, in a natural buffer system that requires low power and no synthetic ampholytes. The capillary transport is modulated by a dynamic and non-trivial coupling between the interfacial tension and viscous resistances, as a consequence of the underlying intermolecular interactions. The competing effects of the driving and the retarding forces effectively determine the displacement, velocity and acceleration characteristics of the capillary front, in a dynamically evolving manner. A comprehensive theoretical model of capillary dynamics is developed here to address these issues in details, thereby revealing the combined influence of the interfacial electrochemistry and the applied transverse voltages, as guided by the pertinent fundamental thermodynamic principles governed by free energy considerations and the physico-chemical phenomena over interfacial scales. Non-trivial implications of the pH-gradient driven micro-capillary transport are aptly emphasized, so as to offer significant physical insights on the adopted strategy as a guiding principle for facilitating capillary filling processes by inducing a modulation in the effective interfacial energy. Particular implications on the capillary filling time are also pinpointed, revealing the effectiveness of the adopted design strategy. Finally, a universal scaling relationship of the capillary filling time as a function of the pertinent operating parameters is derived, so as to provide a generalized guideline for implementing the design scheme. A non-dimensional parameter, depending simultaneously on the inter-electrode pitch and the transverse voltage, is identified, which may be kept to a minimal limit within the other operating constraints of the chosen

Effects of interfacial Fe electronic structures on magnetic and electronic transport properties in oxide/NiFe/oxide heterostructures

International Nuclear Information System (INIS)

Liu, Qianqian; Chen, Xi; Zhang, Jing-Yan; Yang, Meiyin; Li, Xu-Jing; Jiang, Shao-Long; Liu, Yi-Wei; Cao, Yi; Wu, Zheng-Long; Feng, Chun; Ding, Lei; Yu, Guang-Hua

2015-01-01

Highlights: • The magnetic and transport properties of oxide/NiFe/oxide films were studied. • The oxide (SiO 2 , MgO and HfO 2 ) has different elemental electronegativity. • Redox reaction at different NiFe/oxide interface is dependent on the oxide layer. • Different interfacial electronic structures shown by XPS influence the properties. - Abstract: We report that the magnetic and electronic transport properties in oxide/NiFe(2 nm)/oxide film (oxide = SiO 2 , MgO or HfO 2 ) are strongly influenced by the electronic structure of NiFe/oxide interface. Magnetic measurements show that there exist magnetic dead layers in the SiO 2 sandwiched film and MgO sandwiched film, whereas there is no magnetic dead layer in the HfO 2 sandwiched film. Furthermore, in the ultrathin SiO 2 sandwiched film no magnetoresistance (MR) is detected, while in the ultrathin MgO sandwiched film and HfO 2 sandwiched film the MR ratios reach 0.35% and 0.88%, respectively. The investigation by X-ray photoelectron spectroscopy reveals that the distinct interfacial redox reactions, which are dependent on the oxide layers, lead to the variation of magnetic and transport properties in different oxide/NiFe/oxide heterostructures

Impact of Disorder on Spin Dependent Transport Phenomena

KAUST Repository

Saidaoui, Hamed

2016-07-03

The impact of the spin degree of freedom on the transport properties of electrons traveling through magnetic materials has been known since the pioneer work of Mott [1]. Since then it has been demonstrated that the spin angular momentum plays a key role in the scattering process of electrons in magnetic multilayers. This role has been emphasized by the discovery of the Giant Magnetoresistance in 1988 by Fert and Grunberg [2, 3]. Among the numerous applications and effects that emerged in mesoscopic devices two mechanisms have attracted our attention during the course of this thesis: the spin transfer torque and the spin Hall effects. The former consists in the transfer of the spin angular momentum from itinerant carriers to local magnetic moments [4]. This mechanism results in the current-driven magnetization switching and excitations, which has potential application in terms of magnetic data storage and non-volatile memories. The latter, spin Hall effect, is considered as well to be one of the most fascinating mechanisms in condensed matter physics due to its ability of generating non-equilibrium spin currents without the need for any magnetic materials. In fact the spin Hall effect relies only on the presence of the spin-orbit interaction in order to create an imbalance between the majority and minority spins. The objective of this thesis is to investigate the impact of disorder on spin dependent transport phenomena. To do so, we identified three classes of systems on which such disorder may have a dramatic influence: (i) antiferromagnetic materials, (ii) impurity-driven spin-orbit coupled systems and (iii) two dimensional semiconducting electron gases with Rashba spin-orbit coupling. Antiferromagnetic materials - We showed that in antiferromagnetic spin-valves, spin transfer torque is highly sensitive to disorder, which prevents its experimental observation. To solve this issue, we proposed to use either a tunnel barrier as a spacer or a local spin torque using

Hierarchical modeling of plasma and transport phenomena in a dielectric barrier discharge reactor

Science.gov (United States)

Bali, N.; Aggelopoulos, C. A.; Skouras, E. D.; Tsakiroglou, C. D.; Burganos, V. N.

2017-12-01

A novel dual-time hierarchical approach is developed to link the plasma process to macroscopic transport phenomena in the interior of a dielectric barrier discharge (DBD) reactor that has been used for soil remediation (Aggelopoulos et al 2016 Chem. Eng. J. 301 353-61). The generation of active species by plasma reactions is simulated at the microseconds (µs) timescale, whereas convection and thermal conduction are simulated at the macroscopic (minutes) timescale. This hierarchical model is implemented in order to investigate the influence of the plasma DBD process on the transport and reaction mechanisms during remediation of polluted soil. In the microscopic model, the variables of interest include the plasma-induced reactive concentrations, while in the macroscopic approach, the temperature distribution, and the velocity field both inside the discharge gap and within the polluted soil material as well. For the latter model, the Navier-Stokes and Darcy Brinkman equations for the transport phenomena in the porous domain are solved numerically using a FEM software. The effective medium theory is employed to provide estimates of the effective time-evolving and three-phase transport properties in the soil sample. Model predictions considering the temporal evolution of the plasma remediation process are presented and compared with corresponding experimental data.

Analysis of transport phenomena and electrochemical reactions in a micro PEM fuel cell

Energy Technology Data Exchange (ETDEWEB)

Sadiq Al-Baghdadi, Maher A.R. [Fuel Cell Research Center, International Energy and Environment Foundation, Najaf, P.O.Box 39 (Iraq)

2013-07-01

Micro-fuel cells are considered as promising electrochemical power sources in portable electronic devices. The presence of microelectromechanical system (MEMS) technology makes it possible to manufacture the miniaturized fuel cell systems. The majority of research on micro-scale fuel cells is aimed at micro-power applications. Performance of micro-fuel cells are closely related to many factors, such as designs and operating conditions. CFD modeling and simulation for heat and mass transport in micro PEM fuel cells are being used extensively in researches and industrial applications to gain better understanding of the fundamental processes and to optimize the micro fuel cell designs before building a prototype for engineering application. In this research, full three-dimensional, non-isothermal computational fluid dynamics model of a micro proton exchange membrane (PEM) fuel cell has been developed. This comprehensive model accounts for the major transport phenomena such as convective and diffusive heat and mass transfer, electrode kinetics, transport and phase-change mechanism of water, and potential fields in a micro PEM fuel cell. The model explains many interacting, complex electrochemical, and transport phenomena that cannot be studied experimentally. Three-dimensional results of the species profiles, temperature distribution, potential distribution, and local current density distribution are presented and analysed, with the focus on the physical insight and fundamental understanding.

Barodiffusion phenomena at active transport of na+ and K+ ions through the cell membrane

International Nuclear Information System (INIS)

Khrapijchuk, G.V.; Chalyi, A.V.; Nurishchenko, N.Je.

2010-01-01

The influence of ultrasound as the significant motive force of barodiffusion phenomena at the processes of active transport of Na + and K + ions through the cell membrane is considered. The dependence of membrane potential is theoretically estimated at active transport of natrium and potassium ions on the ultrasound intensity and pressure overfall between external and internal medium of the cell.

A Summary of Interfacial Heat Transfer Models and Correlations

Energy Technology Data Exchange (ETDEWEB)

Bae, Sung Won; Cho, Hyung Kyu; Lee, Young Jin; Kim, Hee Chul; Jung, Young Jong; Kim, K. D. [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

2007-10-15

A long term project has been launched in October 2006 to develop a plant safety analysis code. 5 organizations are joining together for the harmonious coworking to build up the code. In this project, KAERI takes the charge of the building up the physical models and correlations about the transport phenomena. The momentum and energy transfer terms as well as the mass are surveyed from the RELAP5/MOD3, RELAP5-3D, CATHARE, and TRAC-M does. Also the recent papers are surveyed. Among these resources, most of the CATHARE models are based on their own experiment and test results. Thus, the CATHARE models are only used as the comparison purposes. In this paper, a summary of the models and the correlations about the interfacial heat transfer are represented. These surveyed models and correlations will be tested numerically and one correlation is selected finally.

Metal/dielectric thermal interfacial transport considering cross-interface electron-phonon coupling: Theory, two-temperature molecular dynamics, and thermal circuit

Science.gov (United States)

Lu, Zexi; Wang, Yan; Ruan, Xiulin

2016-02-01

The standard two-temperature equations for electron-phonon coupled thermal transport across metal/nonmetal interfaces are modified to include the possible coupling between metal electrons with substrate phonons. The previous two-temperature molecular dynamics (TT-MD) approach is then extended to solve these equations numerically at the atomic scale, and the method is demonstrated using Cu/Si interface as an example. A key parameter in TT-MD is the nonlocal coupling distance of metal electrons and nonmetal phonons, and here we use two different approximations. The first is based on Overhauser's "joint-modes" concept, while we use an interfacial reconstruction region as the length scale of joint region rather than the phonon mean-free path as in Overhauser's original model. In this region, the metal electrons can couple to the joint phonon modes. The second approximation is the "phonon wavelength" concept where electrons couple to phonons nonlocally within the range of one phonon wavelength. Compared with the original TT-MD, including the cross-interface electron-phonon coupling can slightly reduce the total thermal boundary resistance. Whether the electron-phonon coupling within the metal block is nonlocal or not does not make an obvious difference in the heat transfer process. Based on the temperature profiles from TT-MD, we construct a new mixed series-parallel thermal circuit. We show that such a thermal circuit is essential for understanding metal/nonmetal interfacial transport, while calculating a single resistance without solving temperature profiles as done in most previous studies is generally incomplete. As a comparison, the simple series circuit that neglects the cross-interface electron-phonon coupling could overestimate the interfacial resistance, while the simple parallel circuit in the original Overhauser's model underestimates the total interfacial resistance.

Two-point concrete resistivity measurements: interfacial phenomena at the electrode–concrete contact zone

International Nuclear Information System (INIS)

McCarter, W J; Taha, H M; Suryanto, B; Starrs, G

2015-01-01

Ac impedance spectroscopy measurements are used to critically examine the end-to-end (two-point) testing technique employed in evaluating the bulk electrical resistivity of concrete. In particular, this paper focusses on the interfacial contact region between the electrode and specimen and the influence of contacting medium and measurement frequency on the impedance response. Two-point and four-point electrode configurations were compared and modelling of the impedance response was undertaken to identify and quantify the contribution of the electrode–specimen contact region on the measured impedance. Measurements are presented in both Bode and Nyquist formats to aid interpretation. Concretes mixes conforming to BSEN206-1 and BS8500-1 were investigated which included concretes containing the supplementary cementitious materials fly ash and ground granulated blast-furnace slag. A measurement protocol is presented for the end-to-end technique in terms of test frequency and electrode–specimen contacting medium in order to minimize electrode–specimen interfacial effect and ensure correct measurement of bulk resistivity. (paper)

Statistical mechanical perturbation theory of solid-vapor interfacial free energy

NARCIS (Netherlands)

Kalikmanov, Vitalij Iosifovitsj; Hagmeijer, Rob; Venner, Cornelis H.

2017-01-01

The solid–vapor interfacial free energy γsv plays an important role in a number of physical phenomena, such as adsorption, wetting, and adhesion. We propose a closed form expression for the orientation averaged value of this quantity using a statistical mechanical perturbation approach developed in

Statistical Mechanical Perturbation Theory of Solid−Vapor Interfacial Free Energy

NARCIS (Netherlands)

Kalikmanov, V.I.; Hagmeijer, R.; Venner, C.H.

2017-01-01

The solid–vapor interfacial free energy γsv plays an important role in a number of physical phenomena, such as adsorption, wetting, and adhesion. We propose a closed form expression for the orientation averaged value of this quantity using a statistical mechanical perturbation approach developed in

Numerical investigations for insulation particle transport phenomena in water flow

International Nuclear Information System (INIS)

Krepper, E.; Grahn, A.; Alt, S.; Kaestner, W.; Kratzsch, A.; Seeliger, A.

2005-01-01

The investigation of insulation debris generation, transport and sedimentation gains importance regarding the reactor safety research for PWR and BWR considering the long term behaviour of emergency core coolant systems during all types of LOCA. The insulation debris released near the break during LOCA consists of a mixture of very different particles concerning size, shape, consistence and other properties. Some fraction of the released insulation debris will be transported into the reactor sump where it may affect emergency core cooling. Open questions of generic interest are e.g. the sedimentation of the insulation debris in a water pool, possible re-suspension, transport in the sump water flow, particle load on strainers and corresponding difference pressure. A joint research project in cooperation with Institute of Process Technology, Process Automation and Measuring Technology (IPM) Zittau deals with the experimental investigation and the development of CFD models for the description of particle transport phenomena in coolant flow. While experiments are performed at the IPM-Zittau, theoretical work is concentrated at Forschungszentrum Rossendorf. In the present paper the basic concepts for CFD modelling are described and first results including feasibility studies are shown. During the ongoing work further results are expected. (author)

Interfacial effect on physical properties of composite media: Interfacial volume fraction with non-spherical hard-core-soft-shell-structured particles.

Science.gov (United States)

Xu, Wenxiang; Duan, Qinglin; Ma, Huaifa; Chen, Wen; Chen, Huisu

2015-11-02

Interfaces are known to be crucial in a variety of fields and the interfacial volume fraction dramatically affects physical properties of composite media. However, it is an open problem with great significance how to determine the interfacial property in composite media with inclusions of complex geometry. By the stereological theory and the nearest-surface distribution functions, we first propose a theoretical framework to symmetrically present the interfacial volume fraction. In order to verify the interesting generalization, we simulate three-phase composite media by employing hard-core-soft-shell structures composed of hard mono-/polydisperse non-spherical particles, soft interfaces, and matrix. We numerically derive the interfacial volume fraction by a Monte Carlo integration scheme. With the theoretical and numerical results, we find that the interfacial volume fraction is strongly dependent on the so-called geometric size factor and sphericity characterizing the geometric shape in spite of anisotropic particle types. As a significant interfacial property, the present theoretical contribution can be further drawn into predicting the effective transport properties of composite materials.

Interfacial fluid dynamics and transport processes

CERN Document Server

Schwabe, Dietrich

2003-01-01

The present set of lectures and tutorial reviews deals with various topical aspects related to instabilities of interfacial processes and driven flows from both the theoretical and experimental point of views. New research has been spurred by the many demands for applications in material sciences (melting, solidification, electro deposition), biomedical engineering and processing in microgravity environments. This book is intended as both a modern source of reference for researchers in the field as well as an introduction to postgraduate students and non-specialists from related areas.

Colloids: a review of current knowledge with a view to application to phenomena of transportation within PWR

International Nuclear Information System (INIS)

Guinard, L.

1996-01-01

In an attempt to minimise dosimetry within the primary circuit of PWR units, research is being carried out into understanding the phenomena of transportation and deposition of corrosion products. It is therefore desirable to known the form of these corrosion products and the laws governing this form. It is generally considered that they are in soluble or particulate form. A third starts with a general presentation of colloids and goes on to define points which are useful, both on a theoretical and experimental level, in terms of application to phenomena of transportation within PWRs. (author). 69 refs., 30 figs., 6 tabs., 3 appends

Interfacial Passivation of the p-Doped Hole-Transporting Layer Using General Insulating Polymers for High-Performance Inverted Perovskite Solar Cells.

Science.gov (United States)

Zhang, Fan; Song, Jun; Hu, Rui; Xiang, Yuren; He, Junjie; Hao, Yuying; Lian, Jiarong; Zhang, Bin; Zeng, Pengju; Qu, Junle

2018-05-01

Organic-inorganic lead halide perovskite solar cells (PVSCs), as a competing technology with traditional inorganic solar cells, have now realized a high power conversion efficiency (PCE) of 22.1%. In PVSCs, interfacial carrier recombination is one of the dominant energy-loss mechanisms, which also results in the simultaneous loss of potential efficiency. In this work, for planar inverted PVSCs, the carrier recombination is dominated by the dopant concentration in the p-doped hole transport layers (HTLs), since the F4-TCNQ dopant induces more charge traps and electronic transmission channels, thus leading to a decrease in open-circuit voltages (V OC ). This issue is efficiently overcome by inserting a thin insulating polymer layer (poly(methyl methacrylate) or polystyrene) as a passivation layer with an appropriate thickness, which allows for increases in the V OC without significantly sacrificing the fill factor. It is believed that the passivation layer attributes to the passivation of interfacial recombination and the suppression of current leakage at the perovskite/HTL interface. By manipulating this interfacial passivation technique, a high PCE of 20.3% is achieved without hysteresis. Consequently, this versatile interfacial passivation methodology is highly useful for further improving the performance of planar inverted PVSCs. © 2018 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Effect of interfacial layer on water flow in nanochannels: Lattice Boltzmann simulations

Energy Technology Data Exchange (ETDEWEB)

Jin, Yakang [State Key Laboratory of Heavy Oil Processing, China University of Petroleum, Qingdao, Shandong 266580 (China); College of Science, China University of Petroleum, Qingdao 266580, Shandong (China); Liu, Xuefeng, E-mail: liuxf@upc.edu.cn [College of Science, China University of Petroleum, Qingdao 266580, Shandong (China); Liu, Zilong [College of Science, China University of Petroleum, Qingdao 266580, Shandong (China); Lu, Shuangfang [Institute of Unconventional Oil & Gas and New Energy, China University of Petroleum, Qingdao 266580, Shandong (China); Xue, Qingzhong, E-mail: xueqingzhong@tsinghua.org.cn [State Key Laboratory of Heavy Oil Processing, China University of Petroleum, Qingdao, Shandong 266580 (China); College of Science, China University of Petroleum, Qingdao 266580, Shandong (China); National Production Equipment Research Center, Dongying 257064, Shandong (China)

2016-04-15

A novel interfacial model was proposed to understand water flow mechanism in nanochannels. Based on our pore-throat nanochannel model, the effect of interfacial layer on water flow in nanochannels was quantitatively studied using Lattice Boltzmann method (LBM). It is found that both the permeability of nanochannel and water velocity in the nanochannel dramatically decrease with increasing the thickness of interfacial layer. The permeability of nanochannel with pore radius of 10 nm decreases by about three orders of magnitude when the thickness of interfacial layer is changed from 0 nm to 3 nm gradually. Furthermore, it has been demonstrated that the cross-section shape has a great effect on the water flow inside nanochannel and the effect of interfacial layer on the permeability of nanochannel has a close relationship with cross-section shape when the pore size is smaller than 12 nm. Besides, both pore-throat ratio and throat length can greatly affect water flow in nanochannels, and the influence of interfacial layer on water flow in nanochannels becomes more evident with increasing pore-throat ratio and throat length. Our theoretical results provide a simple and effective method to study the flow phenomena in nano-porous media, particularly to quantitatively study the interfacial layer effect in nano-porous media.

Aerosol Particle Interfacial Thermodynamics and Phase Partitioning Measurements Using Biphasic Microfluidics

Science.gov (United States)

Dutcher, Cari; Metcalf, Andrew

2015-03-01

Secondary organic aerosol particles are nearly ubiquitous in the atmosphere and yet there remain large uncertainties in their formation processes and ambient properties. These particles are complex microenvironments, which can contain multiple interfaces due to internal aqueous-organic phase partitioning and to the external liquid-vapor surface. Interfacial properties affect the ambient aerosol morphology, or internal structure of the particle, which in turn can affect the way a particle interacts with an environment of condensable clusters and organic vapors. To improve our ability to accurately predict ambient aerosol morphology, we must improve our knowledge of aerosol interfaces and their interactions with the ambient environment. Unfortunately, many techniques employed to measure interfacial properties do so in bulk solutions or in the presence of a ternary (e.g. solid) phase. In this talk, a novel method using biphasic microscale flows will be introduced for generating, trapping, and perturbing complex interfaces at atmospherically relevant conditions. These microfluidic experiments utilize high-speed imaging to monitor interfacial phenomena at the microscale and are performed with phase contrast and fluorescence microscopy on a temperature-controlled inverted microscope stage. From these experiments, interfacial thermodynamic properties such as surface or interfacial tension, rheological properties such as interfacial moduli, and kinetic properties such as mass transfer coefficients can be measured or inferred.

Review on modeling development for multiscale chemical reactions coupled transport phenomena in solid oxide fuel cells

International Nuclear Information System (INIS)

Andersson, Martin; Yuan, Jinliang; Sunden, Bengt

2010-01-01

A literature study is performed to compile the state-of-the-art, as well as future potential, in SOFC modeling. Principles behind various transport processes such as mass, heat, momentum and charge as well as for electrochemical and internal reforming reactions are described. A deeper investigation is made to find out potentials and challenges using a multiscale approach to model solid oxide fuel cells (SOFCs) and combine the accuracy at microscale with the calculation speed at macroscale to design SOFCs, based on a clear understanding of transport phenomena, chemical reactions and functional requirements. Suitable methods are studied to model SOFCs covering various length scales. Coupling methods between different approaches and length scales by multiscale models are outlined. Multiscale modeling increases the understanding for detailed transport phenomena, and can be used to make a correct decision on the specific design and control of operating conditions. It is expected that the development and production costs will be decreased and the energy efficiency be increased (reducing running cost) as the understanding of complex physical phenomena increases. It is concluded that the connection between numerical modeling and experiments is too rare and also that material parameters in most cases are valid only for standard materials and not for the actual SOFC component microstructures.

Liquid metal actuation by electrical control of interfacial tension

Energy Technology Data Exchange (ETDEWEB)

Eaker, Collin B.; Dickey, Michael D., E-mail: michael-dickey@ncsu.edu [Department of Chemical and Biomolecular Engineering, North Carolina State University, 911 Partners Way, Raleigh, North Carolina 27695 (United States)

2016-09-15

By combining metallic electrical conductivity with low viscosity, liquid metals and liquid metal alloys offer new and exciting opportunities to serve as reconfigurable components of electronic, microfluidic, and electromagnetic devices. Here, we review the physics and applications of techniques that utilize voltage to manipulate the interfacial tension of liquid metals; such techniques include electrocapillarity, continuous electrowetting, electrowetting-on-dielectric, and electrochemistry. These techniques lower the interfacial tension between liquid metals and a surrounding electrolyte by driving charged species (or in the case of electrochemistry, chemical species) to the interface. The techniques are useful for manipulating and actuating liquid metals at sub-mm length scales where interfacial forces dominate. We focus on metals and alloys that are liquid near or below room temperature (mercury, gallium, and gallium-based alloys). The review includes discussion of mercury—despite its toxicity—because it has been utilized in numerous applications and it offers a way of introducing several phenomena without the complications associated with the oxide layer that forms on gallium and its alloys. The review focuses on the advantages, applications, opportunities, challenges, and limitations of utilizing voltage to control interfacial tension as a method to manipulate liquid metals.

Interfacial structures in confined cap-turbulent and churn-turbulent flows

International Nuclear Information System (INIS)

Sun Xiaodong; Kim, Seungjin; Cheng Ling; Ishii, Mamoru; Beus, Stephen G.

2004-01-01

The objective of the present work is to study and model the interfacial structure development of air-water two-phase flow in a confined flow passage. Experiments of a total of 13 flow conditions in cap-turbulent and churn-turbulent flow regimes are carried out in a vertical air-water upward two-phase flow experimental loop with a test section of 200 mm in width and 10 mm in gap. Miniaturized four-sensor conductivity probes are used to measure local two-phase parameters at three different elevations for each flow condition. Bubble characteristics captured by the probes are categorized into two groups in view of the two-group interfacial area transport equation, i.e., spherical/distorted bubbles as Group 1 and cap/churn-turbulent bubbles as Group 2. The acquired local parameters are time-averaged void fraction, interfacial velocity, bubble number frequency, interfacial area concentration, and bubble Sauter mean diameter for each group of bubbles. Also, the line-averaged and area-averaged data are presented and discussed in detail. The comparisons of these parameters at different elevations demonstrate the development of interfacial structures along the flow direction due to bubble interactions and the hydrodynamic effects. Furthermore, these data can serve as one part of the experimental data for investigation of the interfacial area transport in a confined two-phase flow

Role of interfacial rheological properties in oil field chemistry

Energy Technology Data Exchange (ETDEWEB)

Lakatos-Szabo, J.; Lakatos, I.; Kosztin, B.

1996-12-31

Interfacial rheological properties of different Hungarian crude oil/water systems were determined in wide temperature and shear rate range and in presence of inorganic electrolytes, tensides, alkaline materials and polymers. The detailed laboratory study definitely proved that the interfacial rheological properties are extremely sensitive parameters towards the chemical composition of inmiscible formation liquids. Comparison and interpretation of the interfacial rheological properties may contribute significantly to extension of the weaponry of the reservoir characterization, better understanding of the displacement mechanism, development of the more profitable EOR/IOR methods, intensification of the surface technologies, optimization of the pipeline transportation and improvement of the refinery operations. It was evidenced that the interfacial rheology is an efficient and powerful detection technique, which may enhance the knowledge on formation, structure, properties and behaviour of interfacial layers. 17 refs., 18 figs., 2 tabs.

A CFD analysis of transport phenomena and electrochemical reactions in a tubular-shaped PEM fuel cell

Energy Technology Data Exchange (ETDEWEB)

Sadiq Al-Baghdadi, Maher A.R. [Fuel Cell Research Center, International Energy and Environment Foundation, Al-Najaf, P.O.Box 39 (Iraq)

2013-07-01

A fuel cell is most interesting new power source because it solves not only the environment problem but also natural resource exhaustion problem. CFD modeling and simulation for heat and mass transport in PEM fuel cells are being used extensively in researches and industrial applications to gain better understanding of the fundamental processes and to optimize fuel cell designs before building a prototype for engineering application. In this research, full three-dimensional, non-isothermal computational fluid dynamics model of a tubular-shaped proton exchange membrane (PEM) fuel cell has been developed. This comprehensive model accounts for the major transport phenomena such as convective and diffusive heat and mass transfer, electrode kinetics, transport and phase-change mechanism of water, and potential fields in a tubular-shaped PEM fuel cell. The model explains many interacting, complex electrochemical, and transport phenomena that cannot be studied experimentally. Three-dimensional results of the species profiles, temperature distribution, potential distribution, and local current density distribution are presented and analysed, with the focus on the physical insight and fundamental understanding.

Nature and morphology of fumed oxides and features of interfacial phenomena

International Nuclear Information System (INIS)

Gun’ko, V.M.; Zarko, V.I.; Goncharuk, O.V.; Matkovsky, A.K.; Remez, O.S.; Skubiszewska-Zięba, J.; Wojcik, G.; Walusiak, B.; Blitz, J.P.

2016-01-01

Graphical abstract: - Highlights: • Effects of oxide surface structure on interfacial behavior of nonpolar and polar adsorbates. • Confined space effects on freezing and melting temperatures of bound adsorbates. • Equilibrium adsorption and evaporation rate vs. structure of nanooxide adsorbents. - Abstract: Individual and complex fumed nanooxides were studied using high-resolution transmission electron microscopy, X-ray diffraction, ultraviolet-visible (UV–vis) spectroscopy, differential scanning calorimetry, nuclear magnetic resonance spectroscopy, adsorption, desorption (evaporation), and quantum chemical methods. For mixed nanooxides in contrast to simple and small nanoparticles of individual silica or titania, complex core–shell nanoparticles (50–200 nm in size) with titania or alumina cores and silica or alumina shells can be destroyed under high-pressure cryogelation (HPCG), mechnochemical activation (MCA) that also affect the structure of aggregates of nanoparticles and agglomerates of aggregates becoming more compacted. This is accompanied by changes in color from white to beige of different tints and changes in the UV–vis spectra in the 300–600 nm range, as well as changes in crystalline structure of alumina. Any treatment of ‘soft’ nanooxides affects the interfacial behavior of polar and nonpolar adsorbates. For some of them, the hysteresis loops become strongly open. Rearrangement of secondary particles affects the freezing-melting point depression. Clusterization of adsorbates bound in pores causes diminution of heat effects during phase transition (freezing, fusion). Freezing point depression and increasing melting point cause significant hysteresis freezing-melting effects for adsorbates bound to oxide nanoparticles. The study shows that complex nanooxides can be more sensitive to external actions than simple nanooxides such as silica.

Nature and morphology of fumed oxides and features of interfacial phenomena

Energy Technology Data Exchange (ETDEWEB)

Gun’ko, V.M., E-mail: vlad_gunko@ukr.net [Chuiko Institute of Surface Chemistry, 17 General Naumov Street, 03164 Kyiv (Ukraine); Zarko, V.I.; Goncharuk, O.V.; Matkovsky, A.K.; Remez, O.S. [Chuiko Institute of Surface Chemistry, 17 General Naumov Street, 03164 Kyiv (Ukraine); Skubiszewska-Zięba, J.; Wojcik, G. [Faculty of Chemistry, Maria Curie-Skłodowska University, 20-031 Lublin (Poland); Walusiak, B.; Blitz, J.P. [Eastern Illinois University, Department of Chemistry, Charleston, IL 61920 (United States)

2016-03-15

Graphical abstract: - Highlights: • Effects of oxide surface structure on interfacial behavior of nonpolar and polar adsorbates. • Confined space effects on freezing and melting temperatures of bound adsorbates. • Equilibrium adsorption and evaporation rate vs. structure of nanooxide adsorbents. - Abstract: Individual and complex fumed nanooxides were studied using high-resolution transmission electron microscopy, X-ray diffraction, ultraviolet-visible (UV–vis) spectroscopy, differential scanning calorimetry, nuclear magnetic resonance spectroscopy, adsorption, desorption (evaporation), and quantum chemical methods. For mixed nanooxides in contrast to simple and small nanoparticles of individual silica or titania, complex core–shell nanoparticles (50–200 nm in size) with titania or alumina cores and silica or alumina shells can be destroyed under high-pressure cryogelation (HPCG), mechnochemical activation (MCA) that also affect the structure of aggregates of nanoparticles and agglomerates of aggregates becoming more compacted. This is accompanied by changes in color from white to beige of different tints and changes in the UV–vis spectra in the 300–600 nm range, as well as changes in crystalline structure of alumina. Any treatment of ‘soft’ nanooxides affects the interfacial behavior of polar and nonpolar adsorbates. For some of them, the hysteresis loops become strongly open. Rearrangement of secondary particles affects the freezing-melting point depression. Clusterization of adsorbates bound in pores causes diminution of heat effects during phase transition (freezing, fusion). Freezing point depression and increasing melting point cause significant hysteresis freezing-melting effects for adsorbates bound to oxide nanoparticles. The study shows that complex nanooxides can be more sensitive to external actions than simple nanooxides such as silica.

Transition phenomena and thermal transport properties in LHD plasmas with an electron internal transport barrier

International Nuclear Information System (INIS)

Shimozuma, T.; Kubo, S.; Idei, H.; Inagaki, S.; Tamura, N.; Tokuzawa, T.; Morisaki, T.; Watanabe, K.Y.; Ida, K.; Yamada, I.; Narihara, K.; Muto, S.; Yokoyama, M.; Yoshimura, Y.; Notake, T.; Ohkubo, K.; Seki, T.; Saito, K.; Kumazawa, R.; Mutoh, T.; Watari, T.; Komori, A.

2005-01-01

Two types of improved core confinement were observed during centrally focused electron cyclotron heating (ECH) into plasmas sustained by counter (CNTR) and Co neutral beam injections (NBI) in the Large Helical Device. The CNTR NBI plasma displayed transition phenomena to the high-electron-temperature state and had a clear electron internal transport barrier, while the Co NBI plasma did not show a clear transition or an ECH power threshold but showed broad high temperature profiles with moderate temperature gradient. This indicated that the Co NBI plasma with additional ECH also had an improved core confinement. The electron heat transport characteristics of these plasmas were directly investigated using heat pulse propagation excited by modulated ECH. These effects appear to be related to the m/n = 2/1 rational surface or the island induced by NBI beam-driven current

Influence of coupling phenomena on the transport through compacted clays

Energy Technology Data Exchange (ETDEWEB)

Rosanne, M.; Koudina, N.; Adler, P.M. [IPGP, Paris (France); Tevissen, E. [ANDRA, Dept. Etude-Experimentation et Calcul, Chatenay Malabry (France)

2001-07-01

Our principal motivation was to study the influence of the coupling phenomena on transport through compacted clays. Coupled transports may occur when a pressure gradient {nabla}P, and electrical field E and a concentration gradient {nabla}C interact. These three gradients induce three fluxes. A flow is generated characterized by the seepage velocity U; a solute flux J{sub L} and a current density I are generated. Close to equilibrium, when the gradients are not to large, the problem is linear and the fluxes are linear functions of the gradients. A first series of experiments was performed with argillite to determine the diagonal properties, i.e., permeability, conductivity, and diffusion coefficient. In a second series of experiments, the voltage resulting from an imposed concentration gradient between two reservoirs separated by a clay sample was systematically measured; this corresponds to the coefficient L{sub 13}. (orig.)

USING MOLECULAR PROBES TO STUDY INTERFACIAL REDOX REACTION AT FE-BEARING SMECTITES

Science.gov (United States)

The interfacial electron transfer of clay-water systems has a wide range of significance in geochemical and biogeochernical environments. However the mechanism of interfacial electron transport is poorly understood. The electron transfer mechanism at the solid-water interfaces of...

Transport phenomena in fuel cells : from microscale to macroscale

Energy Technology Data Exchange (ETDEWEB)

Djilali, N. [Victoria Univ., BC (Canada). Dept. of Mechanical Engineering]|[Victoria Univ., BC (Canada). Inst. for Integrated Energy Systems

2006-07-01

Proton Exchange Membrane (PEM) fuel cells rely on an array of thermofluid transport processes for the regulated supply of reactant gases and the removal of by-product heat and water. Flows are characterized by a broad range of length and time scales that take place in conjunction with reaction kinetics in a variety of regimes and structures. This paper examined some of the challenges related to computational fluid dynamics (CFD) modelling of PEM fuel cell transport phenomena. An overview of the main features, components and operation of PEM fuel cells was followed by a discussion of the various strategies used for component modelling of the electrolyte membrane; the gas diffusion layer; microporous layer; and flow channels. A review of integrated CFD models for PEM fuel cells included the coupling of electrochemical thermal and fluid transport with 3-D unit cell simulations; air-breathing micro-structured fuel cells; and stack level modelling. Physical models for modelling of transport at the micro-scale were also discussed. Results of the review indicated that the treatment of electrochemical reactions in a PEM fuel cell currently combines classical reaction kinetics with solutions procedures to resolve charged species transport, which may lead to thermodynamically inconsistent solutions for more complex systems. Proper representation of the surface coverage of all the chemical species at all reaction sites is needed, and secondary reactions such as platinum (Pt) dissolution and oxidation must be accounted for in order to model and understand degradation mechanisms in fuel cells. While progress has been made in CFD-based modelling of fuel cells, functional and predictive capabilities remain a challenge because of fundamental modelling and material characterization deficiencies in ionic and water transport in polymer membranes; 2-phase transport in porous gas diffusion electrodes and gas flow channels; inadequate macroscopic modelling and resolution of catalyst

Transition phenomena and thermal transport property in LHD plasmas with an electron internal transport barrier

International Nuclear Information System (INIS)

Shimozuma, T.; Kubo, S.; Idei, H.

2005-01-01

Two kinds of improved core confinement were observed during centrally focused Electron Cyclotron Heating (ECH) into plasmas sustained by Counter (CNTR) and Co Neutral Beam Injections (NBI) in the Large Helical Device (LHD). One shows transition phenomena to the high-electron-temperature state and has a clear electron Internal Transport Barrier (eITB) in CNTR NBI plasma. Another has no clear transition and no ECH power threshold, but shows a broad high temperature profiles with moderate temperature gradient, which indicates the improved core confinement with additional ECH in Co NBI plasma. The electron heat transport characteristics of these plasmas were directly investigated by using the heat pulse propagation excited by Modulated ECH (MECH). The difference of the features could be caused by the existence of the m/n=2/1 rational surface or island determined by the direction of NBI beam-driven current. (author)

Measurement of local interfacial area concentration in boiling loop

International Nuclear Information System (INIS)

Kyoung, Ho Kang; Byong, Jo Yun; Goon, Cherl Park

1995-01-01

An accurate prediction of two-phase flow is essential to many energy systems, including nuclear reactors. To model the two-phase flow, detailed information on the internal flow structure is required. The void fraction and interfacial area concentration are important fundamental parameters characterizing the internal structure of two-phase flow. The interfacial area concentration is defined as the available interfacial area per unit volume of the two-phase mixture in calculations of the interfacial transport of mass, momentum, and energy. Although a number of studies have been made in this area, the interfacial area concentration in two-phase flow has not been sufficiently investigated either experimentally or analytically. Most existing models for interfacial area concentration are limited to area-averaged interfacial area concentration in a flow channel. And the studies on local interfacial area concentration are limited to the case of air-water two-phase flow. However, the internal flow structure of steam-water two-phase flow having various bubble sizes could be quite different from that of air-water two-phase flow, the reliability of which weak in practical applications. In this study, the local interfacial area concentration steam-water two-phase flow has been investigated experimentally in a circular boiling tube having a heating rod in the center, and for the low flow with liquid superficial velocity <1 m/s

Thickness dependence of the interfacial Dzyaloshinskii-Moriya interaction in inversion symmetry broken systems

NARCIS (Netherlands)

Cho, J.; Kim, N.H.; Lee, S.; Kim, J.S.; Lavrijsen, R.; Solignac, A.M.P.; Yin, Y.; Han, D.; Hoof, N.J.J.; Swagten, H.J.M.; Koopmans, B.; You, C.-H.

In magnetic multilayer systems, a large spin-orbit coupling at the interface between heavy metals and ferromagnets can lead to intriguing phenomena such as the perpendicular magnetic anisotropy, the spin Hall effect, the Rashba effect, and especially the interfacial Dzyaloshinskii–Moriya (IDM)

Interfacial wave theory of pattern formation in solidification dendrites, fingers, cells and free boundaries

CERN Document Server

Xu, Jian-Jun

2017-01-01

This comprehensive work explores interfacial instability and pattern formation in dynamic systems away from the equilibrium state in solidification and crystal growth. Further, this significantly expanded 2nd edition introduces and reviews the progress made during the last two decades. In particular, it describes the most prominent pattern formation phenomena commonly observed in material processing and crystal growth in the framework of the previously established interfacial wave theory, including free dendritic growth from undercooled melt, cellular growth and eutectic growth in directional solidification, as well as viscous fingering in Hele-Shaw flow. It elucidates the key problems, systematically derives their mathematical solutions by pursuing a unified, asymptotic approach, and finally carefully examines these results by comparing them with the available experimental results. The asymptotic approach described here will be useful for the investigation of pattern formation phenomena occurring in a much b...

Impact of Interfacial Layers in Perovskite Solar Cells.

Science.gov (United States)

Cho, An-Na; Park, Nam-Gyu

2017-10-09

Perovskite solar cells (PCSs) are composed of organic-inorganic lead halide perovskite as the light harvester. Since the first report on a long-term-durable, 9.7 % efficient, solid-state perovskite solar cell, organic-inorganic halide perovskites have received considerable attention because of their excellent optoelectronic properties. As a result, a power conversion efficiency (PCE) exceeding 22 % was certified. Controlling the grain size, grain boundary, morphology, and defects of the perovskite layer is important for achieving high efficiency. In addition, interfacial engineering is equally or more important to further improve the PCE through better charge collection and a reduction in charge recombination. In this Review, the type of interfacial layers and their impact on photovoltaic performance are investigated for both the normal and the inverted cell architectures. Four different interfaces of fluorine-doped tin oxide (FTO)/electron-transport layer (ETL), ETL/perovskite, perovskite/hole-transport layer (HTL), and HTL/metal are classified, and their roles are investigated. The effects of interfacial engineering with organic or inorganic materials on photovoltaic performance are described in detail. Grain-boundary engineering is also included because it is related to interfacial engineering and the grain boundary in the perovskite layer plays an important role in charge conduction, recombination, and chargecarrier life time. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Prediction of adiabatic bubbly flows in TRACE using the interfacial area transport equation

International Nuclear Information System (INIS)

Talley, J.; Worosz, T.; Kim, S.; Mahaffy, J.; Bajorek, S.; Tien, K.

2011-01-01

The conventional thermal-hydraulic reactor system analysis codes utilize a two-field, two-fluid formulation to model two-phase flows. To close this model, static flow regime transition criteria and algebraic relations are utilized to estimate the interfacial area concentration (a i ). To better reflect the continuous evolution of two-phase flow, an experimental version of TRACE is being developed which implements the interfacial area transport equation (IATE) to replace the flow regime based approach. Dynamic estimation of a i is provided through the use of mechanistic models for bubble coalescence and disintegration. To account for the differences in bubble interactions and drag forces, two-group bubble transport is sought. As such, Group 1 accounts for the transport of spherical and distorted bubbles, while Group 2 accounts for the cap, slug, and churn-turbulent bubbles. Based on this categorization, a two-group IATE applicable to the range of dispersed two-phase flows has been previously developed. Recently, a one-group, one-dimensional, adiabatic IATE has been implemented into the TRACE code with mechanistic models accounting for: (1) bubble breakup due to turbulent impact of an eddy on a bubble, (2) bubble coalescence due to random collision driven by turbulent eddies, and (3) bubble coalescence due to the acceleration of a bubble in the wake region of a preceding bubble. To demonstrate the enhancement of the code's capability using the IATE, experimental data for a i , void fraction, and bubble velocity measured by a multi-sensor conductivity probe are compared to both the IATE and flow regime based predictions. In total, 50 air-water vertical co-current upward and downward bubbly flow conditions in pipes with diameters ranging from 2.54 to 20.32 cm are evaluated. It is found that TRACE, using the conventional flow regime relation, always underestimates a i . Moreover, the axial trend of the a i prediction is always quasi-linear because a i in the

Improved Interfacial Bonding in Magnesium/Aluminum Overcasting Systems by Aluminum Surface Treatments

Science.gov (United States)

Zhang, Hui; Chen, Yiqing; Luo, Alan A.

2014-12-01

"Overcasting" technique is used to produce bimetallic magnesium/aluminum (Mg/Al) structures where lightweight Mg can be cast onto solid Al substrates. An inherent difficulty in creating strong Mg/Al interfacial bonding is the natural oxide film on the solid Al surfaces, which reduces the wettability between molten Mg and Al substrates during the casting process. In the paper, an "electropolishing + anodizing" surface treatment has been developed to disrupt the oxide film on a dilute Al-0.08 wt pct Ga alloy, improving the metallurgical bonding between molten Mg and Al substrates in the bimetallic experiments carried out in a high-vacuum test apparatus. The test results provided valuable information of the interfacial phenomena of the Mg/Al bimetallic samples. The results show significantly improved metallurgical bonding in the bimetallic samples with "electropolishing + anodizing" surface treatment and Ga alloying. It is recommended to adjust the pre-heating temperature and time of the Al substrates and the Mg melt temperature to control the interfacial reactions for optimum interfacial properties in the actual overcasting processes.

Recent advances in interfacial engineering of perovskite solar cells

Science.gov (United States)

Ye, Meidan; He, Chunfeng; Iocozzia, James; Liu, Xueqin; Cui, Xun; Meng, Xiangtong; Rager, Matthew; Hong, Xiaodan; Liu, Xiangyang; Lin, Zhiqun

2017-09-01

Due to recent developments, organometallic halide perovskite solar cells (PSCs) have attracted even greater interest owing to their impressive photovoltaic properties and simple device manufacturing processes with the potential for commercial applications. The power conversion efficiencies (PCEs) of PSCs have surged from 3.8% for methyl ammonium lead halide-sensitized liquid solar cells, CH3NH3PbX3 (X  =  Cl, Br, I), in 2009, to more than 22% for all-solid-state solar cells in 2016. Over the past few years, significant effort has been dedicated to realizing PSCs with even higher performance. In this review, recent advances in the interfacial engineering of PSCs are addressed. The specific strategies for the interfacial engineering of PSCs fall into two categories: (1) solvent treatment and additives to improve the light-harvesting capabilities of perovskite films, and (2) the incorporation of various functional materials at the interfaces between the active layers (e.g. electron transporting layer, perovskite layer, and hole transporting layer). This review aims to provide a comprehensive overview of strategies for the interfacial engineering of PSCs with potential benefits including enhanced light harvesting, improved charge separation and transport, improved device stability, and elimination of photocurrent hysteresis.

Pore-level flow, transport, agglomeration, and reaction kinetics of microorganisms

International Nuclear Information System (INIS)

Fauci, L.; Gaver, D.; Moore, P.; Papadopoulos, K.; Sharma, B.

1993-01-01

The overall goal of this research project is to improve the characterization and assessment techniques currently being used to evaluate bioremediation alternatives. This will be accomplished by investigating the phenomena and processes that affect the fate and transport of pollutants and microorganisms at the microscopic level. The specific research objectives are: Quantify the physical constants relevant to the interfacial adsorption of bacteria; Examine the bacteriological properties associated with the bioremediation of a toxin using a microscopic viewpoint; and Determine the detailed pore-level behavior of contaminants and microorganisms in a system with adsorbed contamination

Electroless Formation of Hybrid Lithium Anodes for Fast Interfacial Ion Transport

KAUST Repository

Choudhury, Snehashis; Tu, Zhengyuan; Stalin, Sanjuna; Vu, Duylinh; Fawole, Kristen; Gunceler, Deniz; Sundararaman, Ravishankar; Archer, Lynden A.

2017-01-01

Rechargeable batteries based on metallic anodes are of interest for fundamental and application-focused studies of chemical and physical kinetics of liquids at solid interfaces. Approaches that allow facile creation of uniform coatings on these metals to prevent physical contact with liquid electrolytes, while enabling fast ion transport, are essential to address chemical instability of the anodes. Here, we report a simple electroless ion-exchange chemistry for creating coatings of indium on lithium. By means of joint density functional theory and interfacial characterization experiments, we show that In coatings stabilize Li by multiple processes, including exceptionally fast surface diffusion of lithium ions and high chemical resistance to liquid electrolytes. Indium coatings also undergo reversible alloying reactions with lithium ions, facilitating design of high-capacity hybrid In-Li anodes that use both alloying and plating approaches for charge storage. By means of direct visualization, we further show that the coatings enable remarkably compact and uniform electrodeposition. The resultant In-Li anodes are shown to exhibit minimal capacity fade in extended galvanostatic cycling when paired with commercial-grade cathodes.

Electroless Formation of Hybrid Lithium Anodes for Fast Interfacial Ion Transport

KAUST Repository

Choudhury, Snehashis

2017-08-17

Rechargeable batteries based on metallic anodes are of interest for fundamental and application-focused studies of chemical and physical kinetics of liquids at solid interfaces. Approaches that allow facile creation of uniform coatings on these metals to prevent physical contact with liquid electrolytes, while enabling fast ion transport, are essential to address chemical instability of the anodes. Here, we report a simple electroless ion-exchange chemistry for creating coatings of indium on lithium. By means of joint density functional theory and interfacial characterization experiments, we show that In coatings stabilize Li by multiple processes, including exceptionally fast surface diffusion of lithium ions and high chemical resistance to liquid electrolytes. Indium coatings also undergo reversible alloying reactions with lithium ions, facilitating design of high-capacity hybrid In-Li anodes that use both alloying and plating approaches for charge storage. By means of direct visualization, we further show that the coatings enable remarkably compact and uniform electrodeposition. The resultant In-Li anodes are shown to exhibit minimal capacity fade in extended galvanostatic cycling when paired with commercial-grade cathodes.

Relaxation phenomena in and microscopic transport theories of deeply inelastic collisions between heavy ions

International Nuclear Information System (INIS)

Noerenberg, W.

1976-01-01

Relaxation phenomena in deeply inelastic collisions are qualitatively discussed and compared with precompound reactions. Different approaches for describing these processes are reviewed, in particular the microscopic transport theories, which can be understood from a generalized master equation for macroscopic variables. The Markoff approximation and the classical limit for the relative motion lead to two coupled equations, the classical equation of relative motion with friction and a Pauli master equation for the internal degrees of freedom. The master equation approximated by the corresponding Fokker-Planck equation for mass transfer and energy dissipation is discussed in detail. Simple analytic expressions are derived for the transport coefficients as functions of excitation energy, total mass, mass fragmentation and relative angular momentum. Calculated transport coefficients are compared with experimental values. Problems and future developments in microscopic transport theories are outlined. (orig.) [de

Interfacial structures of confined air-water two-phase bubbly flow

International Nuclear Information System (INIS)

Kim, S.; Ishii, M.; Wu, Q.; McCreary, D.; Beus, S.G.

2000-01-01

The interfacial structure of the two-phase flows is of great importance in view of theoretical modeling and practical applications. In the present study, the focus is made on obtaining detailed local two-phase parameters in the air-water bubbly flow in a rectangular vertical duct using the double-sensor conductivity probe. The characteristic wall-peak is observed in the profiles of the interracial area concentration and the void fraction. The development of the interfacial area concentration along the axial direction of the flow is studied in view of the interfacial area transport and bubble interactions. The experimental data is compared with the drift flux model with C 0 = 1.35

Tunable anomalous hall effect induced by interfacial catalyst in perpendicular multilayers

Science.gov (United States)

Zhang, J. Y.; Peng, W. L.; Sun, Q. Y.; Liu, Y. W.; Dong, B. W.; Zheng, X. Q.; Yu, G. H.; Wang, C.; Zhao, Y. C.; Wang, S. G.

2018-04-01

The interfacial structures, playing a critical role on the transport properties and the perpendicular magnetic anisotropy in thin films and multilayers, can be modified by inserting an ultrathin functional layer at the various interfaces. The anomalous Hall effect (AHE) in the multilayers with core structure of Ta/CoFeB/X/MgO/Ta (X: Hf or Pt) is tuned by interfacial catalytic engineering. The saturation anomalous Hall resistance (RAH) is increased by 16.5% with 0.1 nm Hf insertion compared with the reference sample without insertion. However, the RAH value is decreased by 9.0% with 0.1 nm Pt insertion. The interfacial states were characterized by the X-ray photoelectron spectroscopy (XPS). The XPS results indicate that a strong bonding between Hf and O for Hf insertion, but no bonding between Pt and O for Pt insertion. The bonding between metal and oxygen leads to various oxygen migration behavior at the interfaces. Therefore, the opposite behavior about the RAH originates from the different oxygen behavior due to various interfacial insertion. This work provides a new approach to manipulate spin transport property for the potential applications.

Modelling of Transport Phenomena at Cement Matrix—Aggregate Interfaces

DEFF Research Database (Denmark)

van Breugel, Klaas; Koenders, Eddie; Ye, Guang

2004-01-01

The performance of a heterogeneous material like concrete is largely determined by the many interfaces in this material. This contribution focuses on the potential of numerical simulation models to investigate the character of the matrix-aggregate interfacial zone and to simulate hydration-induce...

Analysis of Particle-Dispersed Composites Accounting Stochastically for Interfacial Damage

International Nuclear Information System (INIS)

Huajian Chang; Michihiko Nakagaki

2002-01-01

More and more composite materials have been being utilized in nuclear facilities. While the external loading applied, the stress in composite is concentrated, which is harmful and may cause interfacial damage. The de-bonding and sliding at the interface between matrix and particles are the most common phenomena. In this paper, a statistically elastoplastic constitutive model for particle-dispersed composites is developed by accounting stochastically for both interfacial damage and localized plasticity. The effects of damaged interface on the strain field in composite are considered in two ways. First, the damaged interface between the matrix and the particles makes the strain field inside inclusions is different from that of the particles with perfectly bonded interface. Second, it contributes an additional strain, which is due to the displacement jump at the matrix-inclusion interface. This additional is defined as an integration of displacement jumps between the matrix and the particles over their interface. In present paper, the first part is considered by using a modified Eshelby's S-tensor. After deriving the local relative displacement distributions between matrix and inclusion at the interface, the second contribution of damaged interface to the average strain can be expressed in terms of the corresponding Eigen-strain or the uniform external loading, by introducing the damage-relevant tensors, which are transformation tensors and tends to zero if interfacial damage does not take place. Both the tangential and normal discontinuities at the interface are independently modeled. The model uses statistic scheme with distribution functions in the stress/strain space, so that the meso-local effects of plastic deformation, interfacial damage and their interactions are accounted for. In order to verify the feasibility and performance of the proposed constitutive model, numerical calculations are carried out. It is found that the damaged interface conditions of de

Radiation transport phenomena and modeling. Part A: Codes; Part B: Applications with examples

International Nuclear Information System (INIS)

Lorence, L.J. Jr.; Beutler, D.E.

1997-09-01

This report contains the notes from the second session of the 1997 IEEE Nuclear and Space Radiation Effects Conference Short Course on Applying Computer Simulation Tools to Radiation Effects Problems. Part A discusses the physical phenomena modeled in radiation transport codes and various types of algorithmic implementations. Part B gives examples of how these codes can be used to design experiments whose results can be easily analyzed and describes how to calculate quantities of interest for electronic devices

Studies on the disbonding initiation of interfacial cracks.

Energy Technology Data Exchange (ETDEWEB)

McAdams, Brian J. (Lehigh University, Bethlehem, PA); Pearson, Raymond A. (Lehigh University, Bethlehem, PA)

2005-08-01

With the continuing trend of decreasing feature sizes in flip-chip assemblies, the reliability tolerance to interfacial flaws is also decreasing. Small-scale disbonds will become more of a concern, pointing to the need for a better understanding of the initiation stage of interfacial delamination. With most accepted adhesion metric methodologies tailored to predict failure under the prior existence of a disbond, the study of the initiation phenomenon is open to development and standardization of new testing procedures. Traditional fracture mechanics approaches are not suitable, as the mathematics assume failure to originate at a disbond or crack tip. Disbond initiation is believed to first occur at free edges and corners, which act as high stress concentration sites and exhibit singular stresses similar to a crack tip, though less severe in intensity. As such, a 'fracture mechanics-like' approach may be employed which defines a material parameter--a critical stress intensity factor (K{sub c})--that can be used to predict when initiation of a disbond at an interface will occur. The factors affecting the adhesion of underfill/polyimide interfaces relevant to flip-chip assemblies were investigated in this study. The study consisted of two distinct parts: a comparison of the initiation and propagation phenomena and a comparison of the relationship between sub-critical and critical initiation of interfacial failure. The initiation of underfill interfacial failure was studied by characterizing failure at a free-edge with a critical stress intensity factor. In comparison with the interfacial fracture toughness testing, it was shown that a good correlation exists between the initiation and propagation of interfacial failures. Such a correlation justifies the continuing use of fracture mechanics to predict the reliability of flip-chip packages. The second aspect of the research involved fatigue testing of tensile butt joint specimens to determine lifetimes at sub

Interfacial structures of confined air-water two-phase bubbly flow

Energy Technology Data Exchange (ETDEWEB)

Kim, S.; Ishii, M.; Wu, Q.; McCreary, D.; Beus, S.G.

2000-08-01

The interfacial structure of the two-phase flows is of great importance in view of theoretical modeling and practical applications. In the present study, the focus is made on obtaining detailed local two-phase parameters in the air-water bubbly flow in a rectangular vertical duct using the double-sensor conductivity probe. The characteristic wall-peak is observed in the profiles of the interracial area concentration and the void fraction. The development of the interfacial area concentration along the axial direction of the flow is studied in view of the interfacial area transport and bubble interactions. The experimental data is compared with the drift flux model with C{sub 0} = 1.35.

Electroless formation of hybrid lithium anodes for fast interfacial ion transport

Energy Technology Data Exchange (ETDEWEB)

Choudhury, Snehashis; Stalin, Sanjuna; Vu, Duylinh; Fawole, Kristen; Archer, Lynden A. [School of Chemical and Biomolecular Engineering, Cornell University, Ithaca, NY (United States); Tu, Zhengyuan [Department of Material Science and Engineering, Cornell University, Ithaca, NY (United States); Gunceler, Deniz [Department of Physics, Cornell University, Ithaca, NY (United States); Sundararaman, Ravishankar [Material Science and Engineering, Rensselaer Polytechnic Institute, Troy, NY (United States)

2017-10-09

Rechargeable batteries based on metallic anodes are of interest for fundamental and application-focused studies of chemical and physical kinetics of liquids at solid interfaces. Approaches that allow facile creation of uniform coatings on these metals to prevent physical contact with liquid electrolytes, while enabling fast ion transport, are essential to address chemical instability of the anodes. Here, we report a simple electroless ion-exchange chemistry for creating coatings of indium on lithium. By means of joint density functional theory and interfacial characterization experiments, we show that In coatings stabilize Li by multiple processes, including exceptionally fast surface diffusion of lithium ions and high chemical resistance to liquid electrolytes. Indium coatings also undergo reversible alloying reactions with lithium ions, facilitating design of high-capacity hybrid In-Li anodes that use both alloying and plating approaches for charge storage. By means of direct visualization, we further show that the coatings enable remarkably compact and uniform electrodeposition. The resultant In-Li anodes are shown to exhibit minimal capacity fade in extended galvanostatic cycling when paired with commercial-grade cathodes. (copyright 2017 Wiley-VCH Verlag GmbH and Co. KGaA, Weinheim)

Transport Phenomena Projects: Natural Convection between Porous, Concentric Cylinders--A Method to Learn and to Innovate

Science.gov (United States)

Saatadjian, Esteban; Lesage, Francois; Mota, Jose Paulo B.

2013-01-01

A project that involves the numerical simulation of transport phenomena is an excellent method to teach this subject to senior/graduate chemical engineering students. The subject presented here has been used in our senior/graduate course, it concerns the study of natural convection heat transfer between two concentric, horizontal, saturated porous…

Characterization of diffusive transport in cementitious materials: influence of microstructure in mortars

International Nuclear Information System (INIS)

Larbi, B.

2013-01-01

Concrete durability is a subject of considerable interest, especially with the use of cement based materials on structures increasingly demanding on term of sustainability and resistance to aggressive ions penetration or radionuclide release. Diffusion is considered as one of the main transport phenomena that cause migration of aggressive solutes and radionuclide in a porous media according to most studies. In order to enable more effective prediction of structures service life, the understanding of the link between cement based materials microstructure and transport macro properties needed to be enhanced. In this context, the present study is undertaken to enhance our understanding of the links between microstructure and tritiated water diffusivity in saturated mortars. The effect of aggregates via the ITZ (Interfacial Transition Zone) on transport properties and materials durability is studied. (author) [fr

Transport Phenomena in Porous Media Aspects of MicroMacro Behaviour

CERN Document Server

Ichikawa, Yasuaki

2012-01-01

This monograph presents an integrated perspective of the wide range of phenomena and processes applicable to the study of transport of species in porous materials. In order to formulate the entire range of porous media and their uses, this book gives the basics of continuum mechanics, thermodynamics, seepage and consolidation and diffusion, including multiscale homogenization methods. The particular structure of the book has been chosen because it is essential to be aware of the true properties of porous materials particularly in terms of nano, micro and macro mechanisms.  This book is of pedagogical and practical importance to the fields covered by civil, environmental, nuclear and petroleum engineering and also in chemical physics and geophysics as it relates to radioactive waste disposal, geotechnical engineering, mining and petroleum engineering and chemical engineering.

Interfacial electron and phonon scattering processes in high-powered nanoscale applications.

Energy Technology Data Exchange (ETDEWEB)

Hopkins, Patrick E.

2011-10-01

The overarching goal of this Truman LDRD project was to explore mechanisms of thermal transport at interfaces of nanomaterials, specifically linking the thermal conductivity and thermal boundary conductance to the structures and geometries of interfaces and boundaries. Deposition, fabrication, and post possessing procedures of nanocomposites and devices can give rise to interatomic mixing around interfaces of materials leading to stresses and imperfections that could affect heat transfer. An understanding of the physics of energy carrier scattering processes and their response to interfacial disorder will elucidate the potentials of applying these novel materials to next-generation high powered nanodevices and energy conversion applications. An additional goal of this project was to use the knowledge gained from linking interfacial structure to thermal transport in order to develop avenues to control, or 'tune' the thermal transport in nanosystems.

Transport phenomena in high Tc superconductors. Resume of Ph.D thesis

International Nuclear Information System (INIS)

Crisan, I.A.

1994-01-01

This is an extended abstract of the Ph. D. thesis devoted to the transport phenomena in high-Tc superconductors. There are three chapters. The first chapter presents an overview of the essential theoretical aspects concerning the vortex dynamics particularly in ceramic superconductors. The chapter two gives a description of the preparation methods of superconductor samples used by the author as well as the measurement devices for volt-ampere characteristics and the associated electronic circuitry. In the third chapter there are presented the experimental data obtained from different samples prepared in different temperature and magnetic field conditions. The obtained results are finally interpreted in the frame of existent or original models. (M.I.C.). 31 Refs

Comparison for the interfacial and wall friction models in thermal-hydraulic system analysis codes

International Nuclear Information System (INIS)

Hwang, Moon Kyu; Park, Jee Won; Chung, Bub Dong; Kim, Soo Hyung; Kim, See Dal

2007-07-01

The average equations employed in the current thermal hydraulic analysis codes need to be closed with the appropriate models and correlations to specify the interphase phenomena along with fluid/structure interactions. This includes both thermal and mechanical interactions. Among the closure laws, an interfacial and wall frictions, which are included in the momentum equations, not only affect pressure drops along the fluid flow, but also have great effects for the numerical stability of the codes. In this study, the interfacial and wall frictions are reviewed for the commonly applied thermal-hydraulic system analysis codes, i.e. RELAP5-3D, MARS-3D, TRAC-M, and CATHARE

Interfacial effects in organic semiconductor heterojunctions

International Nuclear Information System (INIS)

Stadler, P.

2011-01-01

The field of organic electronics has systematically gained interest in recent years, technologically and scientifically advances have been made leading to practical applications such as organic light emitting diodes, organic field-effect transistors and organic photo-voltaic cells. In this thesis a fundamental study on organic molecules is presented targeting on interfacial effects at organic heterojunctions. Generally in organic electronic devices interfaces are considered as key parameters for achieving high performance applications. Therefore in this work the emphasis is to investigate layer-by-layer heterojunctions of organic molecules. Defined heterojunctions at inorganic III-V semiconductors form superlattices and quantum-wells, which lead to interfacial effects summarized as quantum confinement and two-dimensional electron gases. Although organic molecules differ in many aspects from their inorganic counterparts, similar effects can be theoretically expected at organic heterojunctions as well. Organic molecules form van-der-Waals type crystals and domains which are macroscopically anisotropic and polycrystalline or amorphous. Organic molecules are intrinsic semiconductors and at interfaces dipoles are formed, which control the energy level alignment. In order to characterize such structures and compare them to inorganic superlattices and quantum-wells it is necessary to induce charge carriers. In this work this is established either by interfacial doping using high-performance dielectrics in a field-effect transistor structure or by photo-doping by exciting a donor-acceptor bilayer. In both cases C 60 was chosen as organic semiconductor exhibiting good acceptor properties and an electron mobility in the range of 0.5 cm 2 V -1 s -1 . The fabrication of well-defined few-molecular layers allows probing directly at the interface. Spectroscopic methods and transport measurements are applied for characterization: Photoemission spectroscopy, absorption and photo

A statistical approach to strange diffusion phenomena

International Nuclear Information System (INIS)

Milligen, B.Ph. van; Carreras, B.A.; Sanchez, R.

2005-01-01

The study of particle (and heat) transport in fusion plasmas has revealed the existence of what might be called 'unusual' transport phenomena. Such phenomena are: unexpected scaling of the confinement time with system size, power degradation (i.e. sub-linear scaling of energy content with power input), profile stiffness (also known as profile consistency), rapid transient transport phenomena such as cold and heat pulses (travelling much faster than the diffusive timescale would allow), non-local behaviour and central profile peaking during off-axis heating, associated with unexplained inward pinches. The standard modelling framework, essentially equal to Fick's Law plus extensions, has great difficulty in providing an all-encompassing and satisfactory explanation of all these phenomena. This difficulty has motivated us to reconsider the basics of the modelling of diffusive phenomena. Diffusion is based on the well-known random walk. The random walk is captured in all its generality in the Continuous Time Random Walk (CTRW) formalism. The CTRW formalism is directly related to the well-known Generalized Master Equation, which describes the behaviour of tracer particle diffusion on a very fundamental level, and from which the phenomenological Fick's Law can be derived under some specific assumptions. We show that these assumptions are not necessarily satisfied under fusion plasma conditions, in which case other equations (such as the Fokker-Planck diffusion law or the Master Equation itself) provide a better description of the phenomena. This fact may explain part of the observed 'strange' phenomena (namely, the inward pinch). To show how the remaining phenomena mentioned above may perhaps find an explanation in the proposed alternative modelling framework, we have designed a toy model that incorporates a critical gradient mechanism, switching between rapid (super-diffusive) and normal diffusive transport as a function of the local gradient. It is then demonstrated

Interfacial and transport properties of nanoconstrained inorganic and organic materials

Science.gov (United States)

Kocherlakota, Lakshmi Suhasini

Nanoscale constraints impact the material properties of both organic and inorganic systems. The systems specifically studied here are (i) nanoconstrained polymeric systems, poly(l-trimethylsilyl-1-propyne) (PTMSP) and poly(ethylene oxide) (PEO) relevant to gas separation membranes (ii) Zwitterionic polymers poly(sulfobetaine methacrylate)(pSBMA), poly(carboxybetaine acrylamide) (pCBAA), and poly(oligo(ethylene glycol) methyl methacrylate) (PEGMA) brushes critical for reducing bio-fouling (iii) Surface properties of N-layer graphene sheets. Interfacial constraints in ultrathin poly(l-trimethylsilyl-1-propyne) (PTMSP) membranes yielded gas permeabilities and CO2/helium selectivities that exceed bulk PTMSP membrane transport properties by up to three-fold for membranes of submicrometer thickness. Indicative of a free volume increase, a molecular energetic mobility analysis (involving intrinsic friction analysis) revealed enhanced methyl side group mobilities in thin PTMSP membranes with maximum permeation, compared to bulk films. Aging studies conducted over the timescales relevant to the conducted experiments signify that the free volume states in the thin film membranes are highly unstable in the presence of sorbing gases such as CO2. To maintain this high free volume configuration of polymer while improving the temporal stability an "inverse" architecture to conventional polymer nanocomposites was investigated, in which the polymer phase of PTMSP and PEO were interfacially and dimensionally constrained in nanoporous anodic aluminum oxide (AAO) membranes. While with this architecture the benefits of nanocomposite and ultrathin film membranes of PTMSP could be reproduced and improved upon, also the temporal stability could be enhanced substantially. The PEO-AAO nanocomposite membranes also revealed improved gas selectivity properties of CO2 over helium. In the thermal transition studies of zwitterionic pSBMA brushes a reversible critical transition temperature of 60

Modeling of transport phenomena in concrete porous media.

Science.gov (United States)

Plecas, Ilija

2014-02-01

Two fundamental concerns must be addressed when attempting to isolate low-level waste in a disposal facility on land. The first concern is isolating the waste from water, or hydrologic isolation. The second is preventing movement of the radionuclides out of the disposal facility, or radionuclide migration. Particularly, we have investigated here the latter modified scenario. To assess the safety for disposal of radioactive waste-concrete composition, the leakage of 60Co from a waste composite into a surrounding fluid has been studied. Leakage tests were carried out by the original method, developed at the Vinča Institute. Transport phenomena involved in the leaching of a radioactive material from a cement composite matrix are investigated using three methods based on theoretical equations. These are: the diffusion equation for a plane source: an equation for diffusion coupled to a first-order equation, and an empirical method employing a polynomial equation. The results presented in this paper are from a 25-y mortar and concrete testing project that will influence the design choices for radioactive waste packaging for a future Serbian radioactive waste disposal center.

Carrier Transport Enhancement in Conjugated Polymers through Interfacial Self-Assembly of Solution-State Aggregates

KAUST Repository

Zhao, Kui

2016-07-13

We demonstrate that local and long range orders of poly(3-hexylthiophene) (P3HT) semicrystalline films can be synergistically improved by combining chemical functionalization of the dielectric surface with solution-state disentanglement and pre-aggregation of P3HT in a theta solvent, leading to a very significant enhancement of the field effect carrier mobility. The pre-aggregation and surface functionalization effects combine to enhance the carrier mobility nearly 100-fold as compared with standard film preparation by spin-coating, and nearly 10-fold increase over the benefits of pre-aggregation alone. In situ quartz crystal microbalance with dissipation (QCM-D) experiments reveal enhanced deposition of pre-aggregates on surfaces modified with an alkyl-terminated self-assembled monolayer (SAM) in comparison to un-aggregated polymer chains. Additional investigations reveal the combined pre-aggregation and surface functionalization significantly enhances local order of the conjugated polymer through planarization and extension of the conjugated backbone of the polymer which clearly translate to significant improvements of carrier transport at the semiconductor-dielectric interface in organic thin film transistors. This study points to opportunities in combining complementary routes, such as well-known pre-aggregation with substrate chemical functionalization, to enhance the polymer self-assembly and improve its interfacial order with benefits for transport properties.

Interfacial Layer Engineering for Performance Enhancement in Polymer Solar Cells

Directory of Open Access Journals (Sweden)

Hao Zeng

2015-02-01

Full Text Available Improving power conversion efficiency and device performance stability is the most critical challenge in polymer solar cells for fulfilling their applications in industry at large scale. Various methodologies have been developed for realizing this goal, among them interfacial layer engineering has shown great success, which can optimize the electrical contacts between active layers and electrodes and lead to enhanced charge transport and collection. Interfacial layers also show profound impacts on light absorption and optical distribution of solar irradiation in the active layer and film morphology of the subsequently deposited active layer due to the accompanied surface energy change. Interfacial layer engineering enables the use of high work function metal electrodes without sacrificing device performance, which in combination with the favored kinetic barriers against water and oxygen penetration leads to polymer solar cells with enhanced performance stability. This review provides an overview of the recent progress of different types of interfacial layer materials, including polymers, small molecules, graphene oxides, fullerene derivatives, and metal oxides. Device performance enhancement of the resulting solar cells will be elucidated and the function and operation mechanism of the interfacial layers will be discussed.

Interfacial phenomenon theory

International Nuclear Information System (INIS)

Kim, Jong Deuk

2000-02-01

This book is composed of 8 chapters. It tells what interfacial phenomenon is by showing interfacial energy, characteristic of interface and system of interface from chapter 1. It also introduces interfacial energy and structure theory, molecular structure and orientation theory, and interfacial electricity phenomenon theory in the following 3 chapters. It still goes on by introducing super molecule cluster, disequilibrium dispersion, and surface and film through 3 chapters. And the last chapter is about colloid and application of interface.

Strong Coupling between Nanofluidic Transport and Interfacial Chemistry: How Defect Reactivity Controls Liquid-Solid Friction through Hydrogen Bonding.

Science.gov (United States)

Joly, Laurent; Tocci, Gabriele; Merabia, Samy; Michaelides, Angelos

2016-04-07

Defects are inevitably present in nanofluidic systems, yet the role they play in nanofluidic transport remains poorly understood. Here, we report ab initio molecular dynamics (AIMD) simulations of the friction of liquid water on defective graphene and boron nitride sheets. We show that water dissociates at certain defects and that these "reactive" defects lead to much larger friction than the "nonreactive" defects at which water molecules remain intact. Furthermore, we find that friction is extremely sensitive to the chemical structure of reactive defects and to the number of hydrogen bonds they can partake in with the liquid. Finally, we discuss how the insight obtained from AIMD can be used to quantify the influence of defects on friction in nanofluidic devices for water treatment and sustainable energy harvesting. Overall, we provide new insight into the role of interfacial chemistry on nanofluidic transport in real, defective systems.

TFB:TPDSi2 interfacial layer usable in organic photovoltaic cells

Science.gov (United States)

Marks, Iobin J [Evanston, IL; Hains, Alexander W [Evanston, IL

2011-02-15

The present invention, in one aspect, relates to a solar cell. In one embodiment, the solar cell includes an anode; an active organic layer comprising an electron-donating organic material and an electron-accepting organic material; and an interfacial layer formed between the anode and active organic layer, where the interfacial layer comprises a hole-transporting polymer characterized with a hole-mobility higher than that of the electron-donating organic material in the active organic layer, and a small molecule that has a high hole-mobility and is capable of crosslinking on contact with air.

Relative viscosity of emulsions in simple shear flow: Temperature, shear rate, and interfacial tension dependence

Energy Technology Data Exchange (ETDEWEB)

Choi, Se Bin; Lee, Joon Sang [Dept. of Mechanical Engineering, Yonsei Unversity, Seoul (Korea, Republic of)

2015-08-15

We simulate an emulsion system under simple shear rates to analyze its rheological characteristics using the lattice Boltzmann method (LBM). We calculate the relative viscosity of an emulsion under a simple shear flow along with changes in temperature, shear rate, and surfactant concentration. The relative viscosity of emulsions decreased with an increase in temperature. We observed the shear-thinning phenomena, which is responsible for the inverse proportion between the shear rate and viscosity. An increase in the interfacial tension caused a decrease in the relative viscosity of the decane-in-water emulsion because the increased deformation caused by the decreased interfacial tension significantly influenced the wall shear stress.

Interfacial instabilities in vibrated fluids

Science.gov (United States)

Porter, Jeff; Laverón-Simavilla, Ana; Tinao Perez-Miravete, Ignacio; Fernandez Fraile, Jose Javier

2016-07-01

Vibrations induce a range of different interfacial phenomena in fluid systems depending on the frequency and orientation of the forcing. With gravity, (large) interfaces are approximately flat and there is a qualitative difference between vertical and horizontal forcing. Sufficient vertical forcing produces subharmonic standing waves (Faraday waves) that extend over the whole interface. Horizontal forcing can excite both localized and extended interfacial phenomena. The vibrating solid boundaries act as wavemakers to excite traveling waves (or sloshing modes at low frequencies) but they also drive evanescent bulk modes whose oscillatory pressure gradient can parametrically excite subharmonic surface waves like cross-waves. Depending on the magnitude of the damping and the aspect ratio of the container, these locally generated surfaces waves may interact in the interior resulting in temporal modulation and other complex dynamics. In the case where the interface separates two fluids of different density in, for example, a rectangular container, the mass transfer due to vertical motion near the endwalls requires a counterflow in the interior region that can lead to a Kelvin-Helmholtz type instability and a ``frozen wave" pattern. In microgravity, the dominance of surface forces favors non-flat equilibrium configurations and the distinction between vertical and horizontal applied forcing can be lost. Hysteresis and multiplicity of solutions are more common, especially in non-wetting systems where disconnected (partial) volumes of fluid can be established. Furthermore, the vibrational field contributes a dynamic pressure term that competes with surface tension to select the (time averaged) shape of the surface. These new (quasi-static) surface configurations, known as vibroequilibria, can differ substantially from the hydrostatic state. There is a tendency for the interface to orient perpendicular to the vibrational axis and, in some cases, a bulge or cavity is induced

Advanced diffusion processes and phenomena

CERN Document Server

Öchsner, Andreas; Belova, Irina

2014-01-01

This topical volume on Advanced Diffusion Processes and Phenomena addresses diffusion in a wider sense of not only mass diffusion but also heat diffusion in fluids and solids. Both diffusion phenomena play an important role in the characterization of engineering materials and corresponding structures. Understanding these different transport phenomena at many levels, from atomistic to macro, has therefore long attracted the attention of many researchers in materials science and engineering and related disciplines. The present topical volume captures a representative cross-section of some of the

Microscopic Linear Response Theory of Spin Relaxation and Relativistic Transport Phenomena in Graphene

Directory of Open Access Journals (Sweden)

Manuel Offidani

2018-05-01

Full Text Available We present a unified theoretical framework for the study of spin dynamics and relativistic transport phenomena in disordered two-dimensional Dirac systems with pseudospin-spin coupling. The formalism is applied to the paradigmatic case of graphene with uniform Bychkov-Rashba interaction and shown to capture spin relaxation processes and associated charge-to-spin interconversion phenomena in response to generic external perturbations, including spin density fluctuations and electric fields. A controlled diagrammatic evaluation of the generalized spin susceptibility in the diffusive regime of weak spin-orbit interaction allows us to show that the spin and momentum lifetimes satisfy the standard Dyakonov-Perel relation for both weak (Gaussian and resonant (unitary nonmagnetic disorder. Finally, we demonstrate that the spin relaxation rate can be derived in the zero-frequency limit by exploiting the SU(2 covariant conservation laws for the spin observables. Our results set the stage for a fully quantum-mechanical description of spin relaxation in both pristine graphene samples with weak spin-orbit fields and in graphene heterostructures with enhanced spin-orbital effects currently attracting much attention.

Structure from Dynamics: Vibrational Dynamics of Interfacial Water as a Probe of Aqueous Heterogeneity

Science.gov (United States)

2018-01-01

The structural heterogeneity of water at various interfaces can be revealed by time-resolved sum-frequency generation spectroscopy. The vibrational dynamics of the O–H stretch vibration of interfacial water can reflect structural variations. Specifically, the vibrational lifetime is typically found to increase with increasing frequency of the O–H stretch vibration, which can report on the hydrogen-bonding heterogeneity of water. We compare and contrast vibrational dynamics of water in contact with various surfaces, including vapor, biomolecules, and solid interfaces. The results reveal that variations in the vibrational lifetime with vibrational frequency are very typical, and can frequently be accounted for by the bulk-like heterogeneous response of interfacial water. Specific interfaces exist, however, for which the behavior is less straightforward. These insights into the heterogeneity of interfacial water thus obtained contribute to a better understanding of complex phenomena taking place at aqueous interfaces, such as photocatalytic reactions and protein folding. PMID:29490138

Investigations of grain size dependent sediment transport phenomena on multiple scales

Science.gov (United States)

Thaxton, Christopher S.

Sediment transport processes in coastal and fluvial environments resulting from disturbances such as urbanization, mining, agriculture, military operations, and climatic change have significant impact on local, regional, and global environments. Primarily, these impacts include the erosion and deposition of sediment, channel network modification, reduction in downstream water quality, and the delivery of chemical contaminants. The scale and spatial distribution of these effects are largely attributable to the size distribution of the sediment grains that become eligible for transport. An improved understanding of advective and diffusive grain-size dependent sediment transport phenomena will lead to the development of more accurate predictive models and more effective control measures. To this end, three studies were performed that investigated grain-size dependent sediment transport on three different scales. Discrete particle computer simulations of sheet flow bedload transport on the scale of 0.1--100 millimeters were performed on a heterogeneous population of grains of various grain sizes. The relative transport rates and diffusivities of grains under both oscillatory and uniform, steady flow conditions were quantified. These findings suggest that boundary layer formalisms should describe surface roughness through a representative grain size that is functionally dependent on the applied flow parameters. On the scale of 1--10m, experiments were performed to quantify the hydrodynamics and sediment capture efficiency of various baffles installed in a sediment retention pond, a commonly used sedimentation control measure in watershed applications. Analysis indicates that an optimum sediment capture effectiveness may be achieved based on baffle permeability, pond geometry and flow rate. Finally, on the scale of 10--1,000m, a distributed, bivariate watershed terain evolution module was developed within GRASS GIS. Simulation results for variable grain sizes and for

Studies of the effect of radioactive waste on the transport phenomena in soil

International Nuclear Information System (INIS)

El-Reefy, A.I.A.F

1992-01-01

This thesis introduces a new concept in the field of soil mechanics. It is an integrated work between soil and radiation in the form of gamma-rays. Chapter II was introduced to cover the basics in geotechnical engineering so as to draw a clearer picture to radiologists. Similarly, Chapter III was introduced to enable geotechnical engineers to comprehend radioactive behaviour in general. Although these two chapters are for further reading they contain various points that will be referred to regularly in the latter pages. The aim of this work is to investigate: - The effect of γ -radiations on the transport phenomena in soil. This was carried out by studying the effect of the following factors on the transmission of γ -rays with different energies: 1) Soil sample thickness 2) Grain size 3)Water content 4) Degree of compaction. - The effect of γ -radiations on moisture movement through soil. -Using the -ray transmission method to determine the soil physical properties. - Improvement of soil to increase its ability to attenuate -radiations. Experimental work took place under strict conditions at the Hot Lab. Center located at Inchas. Soil sample was sought from a nearby site which eventually will be the actual radioactive disposal site. The physical properties of the soil sample were determined as well as its grain size distribution. Accurate and detailed data on the gamma rays transport phenomena in soils was obtained using an up to date γ -radiation measurement technique. Finally, the extensive data obtained throughout this research was recorded and analyzed to ultimately approach our aim

Assessment of some interfacial shear correlations in a model of ECC bypass flow in PWR reactor downcomer

International Nuclear Information System (INIS)

Popov, N.K.; Rohatgi, U.S.

1987-01-01

The bypass/refill process in the PWR reactor downcomer, following a large rupture of a cold leg coolant supply pipe, is a complicated thermo-hydraulic two-phase flow phenomenon. Mathematical modeling of such phenomena is always accompanied with a difficult task of selection of suitable constitutive correlations. In a typically hydrodynamic phenomenon, like ECC refill process of the reactor lower plenum is considered, the phasic interfacial friction is the most influential constitutive correlation. Therefore, assessment of the well-known widely-used interfacial friction constitutive correlations in the model of ECC bypass/refill process, is the subject of this paper

Molecular Level Manipulation of Interfacial Charge Transport

Science.gov (United States)

Song, Charles Kiseok

The bulk-heterojunction organic (BHJ) photovoltaics (OPVs) and lithium ion battery (LiB) have been extensively studied. Power conversion efficiency (PCE) of an OPV greater than 10% and utilizing group 4 elements as the anode to accommodate high capacity for LiBs are the goals of many studies. However, the currently ubiquitous hole-collecting layer of OPVs limit device performance and durability, and group 4 elements are unstable and brittle to be commercially produced. Thus, my thesis has focused on developing functional and durable interfacial layers (IFLs) for OPVs and characterizing flexible artificial solid-electrolyte interphase (SEI) for LiBs. In Chapter 2, a series of robust organosilane-based dipolar self-assembled monolayer (SAM) IFLs on the tin-doped indium oxide (ITO) anodes of OPVs are developed. These hydrophobic and amorphous IFLs modify anode work functions from 4.66 to 5.27 eV. Two series of Glass/ITO/SAM IFL/Active Layer/LiF/Al BHJ OPVs are fabricated, and a strong positive correlation between the electrochemically-derived heterogeneous electron transport rate constants (ks) and OPV PCEs are observed due to enhanced anode carrier extraction. In Chapter 3, a series of unusually denser organosilane-based SAM IFLs on ITO anodes of OPVs are developed. Precursor mixtures having short and long tail groups were simultaneously deposited to minimize sterical encumbrance and denser SAM IFLs are achieved. These heterogeneous supersaturated SAMs (SHSAMs), with PCE (7.62%) exceeding that of PEDOT:PSS IFL, are found to be 17% denser and enhances PCE by 54% versus comparable devices with homogeneous SAM IFLs due to enhanced charge selectivity and collection. In Chapter 4, libraries of electron affinities (EAs) of widely used conductive polymers are constructed by cyclic voltammetry (CV) in conventional and LiB media. The EAs of the conductive polymer films measured via CV in conventional (EAC) and Li+ battery (EAB) media could be linearly correlated by EAB = (1

Three-dimensional multi-phase flow computational fluid dynamics model for analysis of transport phenomena and thermal stresses in PEM fuel cells

Energy Technology Data Exchange (ETDEWEB)

Maher, A.R.; Al-Baghdadi, S. [International Technological Univ., London (United Kingdom). Dept. of Mechanical Engineering; Haroun, A.K.; Al-Janabi, S. [Babylon Univ., Babylon (Iraq). Dept. of Mechanical Engineering

2007-07-01

Fuel cell technology is expected to play an important role in meeting the growing demand for distributed generation because it can convert the chemical energy of a clean fuel directly into electrical energy. An operating fuel cell has varying local conditions of temperature, humidity, and power generation across the active area of the fuel cell in 3D. This paper presented a model that was developed to improve the basic understanding of the transport phenomena and thermal stresses in PEM fuel cells, and to investigate the behaviour of polymer membrane under hygro and thermal stresses during the cell operation. This comprehensive 3D, multiphase, non-isothermal model accounts for the major transport phenomena in a PEM fuel cell, notably convective and diffusive heat and mass transfer; electrode kinetics; transport and phase change mechanism of water; and potential fields. The model accounts for the liquid water flux inside the gas diffusion layers by viscous and capillary forces and can therefore predict the amount of liquid water inside the gas diffusion layers. This study also investigated the key parameters affecting fuel cell performance including geometry, materials and operating conditions. The model considers the many interacting, complex electrochemical, transport phenomena, thermal stresses and deformation that cannot be studied experimentally. It was concluded that the model can provide a computer-aided tool for the design and optimization of future fuel cells with much higher power density and lower cost. 21 refs., 2 tabs., 14 figs.

A Quantitative Exploration of the Effect of Interfacial Phenomena on the Thermomechanical Properties of Polymer Nanocomposites

Science.gov (United States)

Natarajan, Bharath

Polymer nanocomposites (PNC) are complex material systems in which the prevailing length scales, i.e., the particle size, radii of gyration of the polymer and the interparticle spacing, converge. This convergence leads to an increased dominance of the interface polymer over bulk properties, when compared to conventional "microcomposites". The development of fascinating nanoscopic filler materials (C60, nanotubes, graphene, quantum dots) along with this potential gain in interfacial area has fueled the expansion of PNCs. Nanocomposites literature has demonstrated a myriad of potential chemistries and self assembled structures that could significantly impact a diverse range of applications. However, most noteworthy results in this field are serendipitous and/or are outcomes of resource-intensive "trial and error" experiments supplemented by intuition. Intuition suggests, qualitatively, that the properties of PNCs depend on the individual properties of the participating species, the interphase and the spatial distribution of filler particles. However, the individual roles of these parameters are difficult to identify, since they are interrelated due to their co-dependence on the chemical constitution of the filler and matrix. A quantitative unifying picture is yet to emerge and the commercialization of this material class has been severely hampered by the lack of design rules and structure-property constitutive relationships that would aid in the prediction of bulk properties. In this thesis, a quantitative understanding of interfacial phenomena was sought and structure-property relationships between the filler/matrix interface chemistry and the dispersion and thermomechanical properties of PNCs were obtained by systematic experiments on 2 distinct kinds of nanocomposite systems (a) Enthalpic short silane modified fillers and (b) Entropic long polymer chain grafted filler embedded PNCs. In order to quantitatively understand the role of enthalpic compatibility, an

Modelling of melting and solidification transport phenomena during hypothetical NPP severe accidents

International Nuclear Information System (INIS)

Sarler, B.

1992-01-01

A physical and mathematical framework to deal with the transport phenomena occuring during melting and solidification of the hypothetical NPP severe accidents is presented. It concentrates on the transient temperature, velocity, and species concentration distributions during such events. The framework is based on the Mixture Continuum Formulation of the components and phases, cast in the boundary-domain integral shape structured by the fundamental solution of the Laplace equation. The formulation could cope with various solid-liquid sub-systems through the inclusion of the specific closure relations. The deduced system of boundary-domain integral equations for conservation of mass, energy, momentum, and species could be solved by the boundary element discrete approximative method. (author) [sl

Nanophenomena at surfaces fundamentals of exotic condensed matter phenomena

CERN Document Server

Michailov, Michail

2011-01-01

This book presents the state of the art in nanoscale surface physics. It outlines contemporary trends in the field covering a wide range of topical areas: atomic structure of surfaces and interfaces, molecular films and polymer adsorption, biologically inspired nanophysics, surface design and pattern formation, and computer modeling of interfacial phenomena. Bridging 'classical' and 'nano' concepts, the present volume brings attention to the physical background of exotic condensed-matter properties. The book is devoted to Iwan Stranski and Rostislaw Kaischew, remarkable scientists, who played

Wavelet analysis of interfacial waves in cocurrent two-phase flow in horizontal duct

International Nuclear Information System (INIS)

Kondo, Masaya; Kukita, Yutaka

1996-07-01

Wavelet analysis was applied to spatially-growing interfacial waves in a cocurrent gas/liquid two-phase flow. The wave growth plays a key role in the transition from stratified-wavy to slug flow, which is an important phenomena in many engineering applications. Of particular interest to the present study was the quick growth or decay of particular waves which were observed in experiments together with the general growth of waves with distance in the flow direction. Among the several wavelet functions tested in the present study, the Morlet wavelet and the Gabor function were found to have spectral and spatial resolutions suitable to the analysis of interfacial wave data taken by the authors. The analysis revealed that 1) the spectral components composing the interfacial waves are propagating at different phase velocities which agree to the theoretical velocities of deep-water waves, 2) the group velocity of the waves also agrees to the deep-water theory, and 3) the quick growth and decay of particular waves occur as a result of the superposition of spectral components with different phase velocities. (author)

Phonon Transport at Crystalline Si/Ge Interfaces: The Role of Interfacial Modes of Vibration

Science.gov (United States)

Gordiz, Kiarash; Henry, Asegun

2016-01-01

We studied the modal contributions to heat conduction at crystalline Si and crystalline Ge interfaces and found that more than 15% of the interface conductance arises from less than 0.1% of the modes in the structure. Using the recently developed interface conductance modal analysis (ICMA) method along with a new complimentary methodology, we mapped the correlations between modes, which revealed that a small group of interfacial modes, which exist between 12–13 THz, exhibit extremely strong correlation with other modes in the system. It is found that these interfacial modes (e.g., modes with large eigen vectors for interfacial atoms) are enabled by the degree of anharmonicity near the interface, which is higher than in the bulk, and therefore allows this small group of modes to couple to all others. The analysis sheds light on the nature of localized vibrations at interfaces and can be enlightening for other investigations of localization. PMID:26979787

Transport Phenomena in Gel

Directory of Open Access Journals (Sweden)

Masayuki Tokita

2016-05-01

Full Text Available Gel becomes an important class of soft materials since it can be seen in a wide variety of the chemical and the biological systems. The unique properties of gel arise from the structure, namely, the three-dimensional polymer network that is swollen by a huge amount of solvent. Despite the small volume fraction of the polymer network, which is usually only a few percent or less, gel shows the typical properties that belong to solids such as the elasticity. Gel is, therefore, regarded as a dilute solid because its elasticity is much smaller than that of typical solids. Because of the diluted structure, small molecules can pass along the open space of the polymer network. In addition to the viscous resistance of gel fluid, however, the substance experiences resistance due to the polymer network of gel during the transport process. It is, therefore, of importance to study the diffusion of the small molecules in gel as well as the flow of gel fluid itself through the polymer network of gel. It may be natural to assume that the effects of the resistance due to the polymer network of gel depends strongly on the network structure. Therefore, detailed study on the transport processes in and through gel may open a new insight into the relationship between the structure and the transport properties of gel. The two typical transport processes in and through gel, that is, the diffusion of small molecules due to the thermal fluctuations and the flow of gel fluid that is caused by the mechanical pressure gradient will be reviewed.

R-ES-ONAN--CE

Indian Academy of Sciences (India)

Mathematics, Engineering: Turbulence, stability of fluid flows, two phase flow, thermal science, biochemical engineering, polymer engineering, chemical reactor analysis, transport phenomena, interfacial phenomena, process metallurgy, physi- cal metallurgy, ceramics, composite materials and computer science or ...

Transport phenomena in materials processing---1990

International Nuclear Information System (INIS)

Bishop, B.J.; Lior, N.; Lavine, A.; Flik, M.; Karwe, M.V.; Bergman, T.L.; Beckermann, C.; Charmchi, M.

1990-01-01

The papers contained in this volume represent a wide range of current research interests in processes such as food and polymer processing, casting, welding, machining, laser cutting, and superconductor processing. This volume includes papers presented in four sessions: Heat Transfer in Materials Processing; Thermal Phenomena in Superconductor Processing; Heat Transfer in Food and Polymer Processing; Heat Transfer in CAsting and Welding

The application of the Chebyshev-spectral method in transport phenomena

CERN Document Server

Guo, Weidong; Narayanan, Ranga

2012-01-01

Transport phenomena problems that occur in engineering and physics are often multi-dimensional and multi-phase in character.  When taking recourse to numerical methods the spectral method is particularly useful and efficient. The book is meant principally to train students and non-specialists  to use the spectral method for solving problems that model fluid flow in closed geometries with heat or mass transfer.  To this aim the reader should bring a working knowledge of fluid mechanics and heat transfer and should be readily conversant with simple concepts of linear algebra including spectral decomposition of matrices as well as solvability conditions for inhomogeneous problems.  The book is neither meant to supply a ready-to-use program that is all-purpose nor to go through all manners of mathematical proofs.  The focus in this tutorial is on the use of the spectral methods for space discretization, because this is where most of the difficulty lies. While time dependent problems are also of great interes...

Interfacial area and interfacial transfer in two-phase systems. DOE final report

Energy Technology Data Exchange (ETDEWEB)

Ishii, Mamoru; Hibiki, T.; Revankar, S.T.; Kim, S.; Le Corre, J.M.

2002-07-01

In the two-fluid model, the field equations are expressed by the six conservation equations consisting of mass, momentum and energy equations for each phase. The existence of the interfacial transfer terms is one of the most important characteristics of the two-fluid model formulation. The interfacial transfer terms are strongly related to the interfacial area concentration and to the local transfer mechanisms such as the degree of turbulence near interfaces. This study focuses on the development of a closure relation for the interfacial area concentration. A brief summary of several problems of the current closure relation for the interfacial area concentration and a new concept to overcome the problem are given.

Adsorption phenomena and anchoring energy in nematic liquid crystals

CERN Document Server

Barbero, Giovanni

2005-01-01

Despite the large quantity of phenomenological information concerning the bulk properties of nematic phase liquid crystals, little is understood about the origin of the surface energy, particularly the surface, interfacial, and anchoring properties of liquid crystals that affect the performance of liquid crystal devices. Self-contained and unique, Adsorption Phenomena and Anchoring Energy in Nematic Liquid Crystals provides an account of new and established results spanning three decades of research into the problems of anchoring energy and adsorption phenomena in liquid crystals.The book contains a detailed discussion of the origin and possible sources of anchoring energy in nematic liquid crystals, emphasizing the dielectric contribution to the anchoring energy in particular. Beginning with fundamental surface and anchoring properties of liquid crystals and the definition of the nematic phase, the authors explain how selective ion adsorption, dielectric energy density, thickness dependence, and bias voltage...

Organic/inorganic electrochromic nanocomposites with various interfacial interactions: A review

Energy Technology Data Exchange (ETDEWEB)

Xiong, Shanxin, E-mail: xiongsx@xust.edu.cn; Yin, Siyuan; Wang, Yuyun; Kong, Zhenzhen; Lan, Jinpeng; Zhang, Runlan; Gong, Ming; Wu, Bohua; Chu, Jia; Wang, Xiaoqin

2017-07-15

Highlights: • We review the effects of interfacial interactions in electrochromic nanocomposites. • Interfacial interactions are useful for film fabrication and property-enhancement. • The strong interaction can enhance the electron conduction and structural strength. • The weak interactions exist widely between organic and inorganic phases. • Multiple weak interactions can provide various performance-adjusting approaches. - Abstract: Electrochromic properties of organic or inorganic materials can be improved through preparing organic/inorganic electrochromic nanocomposites. In electrochromic nanocomposites, the interfacial interactions between the organic and inorganic phases play three important roles in preparation and application of the nanocomposites. Firstly, the interfacial interactions result in stable molecular structures. Secondly, they also improve the electron conduction and ion transport process in the nanocomposites. Thirdly, they enhance the electrochemical and electrochromic properties of the nanocomposites. In this paper, we review the common interfacial interactions including covalent bond, coordination bond, electrostatic interaction, hydrogen bond and π-π stacking interaction between the organic and inorganic phases in the electrochromic nanocomposites. The preparation method, the relationship between the structure and properties, and the mechanism of modulation of electrochromic effect in the nanocomposites with various interfacial interactions are surveyed. The strong interfacial interaction, e.g., covalent bond, is helpful for obtaining electrochromic nanocomposites with high electron conduction and high structural strength. However it is very complicated to construct covalent bond between the organic and inorganic phases. Another strong interfacial interaction, the coordination bond is mainly confined to preparation of electrochromic complex of metal ion and pyridine derivative. While, the weak interfacial interactions, e

Organic/inorganic electrochromic nanocomposites with various interfacial interactions: A review

International Nuclear Information System (INIS)

Xiong, Shanxin; Yin, Siyuan; Wang, Yuyun; Kong, Zhenzhen; Lan, Jinpeng; Zhang, Runlan; Gong, Ming; Wu, Bohua; Chu, Jia; Wang, Xiaoqin

2017-01-01

Highlights: • We review the effects of interfacial interactions in electrochromic nanocomposites. • Interfacial interactions are useful for film fabrication and property-enhancement. • The strong interaction can enhance the electron conduction and structural strength. • The weak interactions exist widely between organic and inorganic phases. • Multiple weak interactions can provide various performance-adjusting approaches. - Abstract: Electrochromic properties of organic or inorganic materials can be improved through preparing organic/inorganic electrochromic nanocomposites. In electrochromic nanocomposites, the interfacial interactions between the organic and inorganic phases play three important roles in preparation and application of the nanocomposites. Firstly, the interfacial interactions result in stable molecular structures. Secondly, they also improve the electron conduction and ion transport process in the nanocomposites. Thirdly, they enhance the electrochemical and electrochromic properties of the nanocomposites. In this paper, we review the common interfacial interactions including covalent bond, coordination bond, electrostatic interaction, hydrogen bond and π-π stacking interaction between the organic and inorganic phases in the electrochromic nanocomposites. The preparation method, the relationship between the structure and properties, and the mechanism of modulation of electrochromic effect in the nanocomposites with various interfacial interactions are surveyed. The strong interfacial interaction, e.g., covalent bond, is helpful for obtaining electrochromic nanocomposites with high electron conduction and high structural strength. However it is very complicated to construct covalent bond between the organic and inorganic phases. Another strong interfacial interaction, the coordination bond is mainly confined to preparation of electrochromic complex of metal ion and pyridine derivative. While, the weak interfacial interactions, e

An interpretation of passive containment cooling phenomena

Energy Technology Data Exchange (ETDEWEB)

Chung, Bum-Jin [Ministry of Science & Technology, Kyunggi-Do (Korea, Democratic People`s Republic of); Kang, Chang-Sun, [Seoul National Univ. (Korea, Democratic People`s Republic of)

1995-09-01

A simplified interpretation model for the cooling capability of the Westinghouse type PCCS is proposed in this paper. The PCCS domain was phenomenologically divided into 3 regions; water entrance effect region, asymptotic region, and air entrance effect region. The phenomena in the asymptotic region is focused in this paper. Due to the very large height to thickness ratio of the water film, the length of the asymptotic region is estimated to be over 90% of the whole domain. Using the analogy between heat and mass transfer phenomena in a turbulent situation, a new dependent variable combining temperature and vapor mass fraction was defined. The similarity between the PCCS phenomena, which contains the sensible and latent heat transfer, and the buoyant air flow on a vertical heated plate is derived. The modified buoyant coefficient and thermal conductivity were defined. Using these newly defined variable and coefficients, the modified correlation for the interfacial heat fluxes and the ratios of latent heat transfer to sensible heat transfer is established. To verify the accuracy of the correlation, the results of this study were compared with the results of other numerical analyses performed for the same configuration and they are well within the range of 15% difference.

Interfacial phenomena in the reactions of Al-B, Al-Ti-B, and Al-Zr-B alloys with KF-AlF3 and NaF-AlF3 melts

International Nuclear Information System (INIS)

Lee, M.S.; Terry, B.S.; Grieveson, P.

1993-01-01

The interfacial phenomena occurring during the contacting of liquid Al-B, Al-Ti-B, and Al-Zr-B melts with KF-AlF 3 liquid fluxes have been investigated by optical examination of quenched metal drops previously immersed in the liquid fluxes. Reactions in the Al-B/KF-AlF 3 system involve the formation of metastable AlB 12 at the metal/flux interface. At high KBF 4 levels in the flux, the AlB 12 is dispersed in the flux and also at low KBF 4 levels in the metal. Reactions in the Al-Ti-B/KF-AlF 3 system involve the formation of TiB 2 , which may be dispersed in either the metal or the flux depending upon the composition of the flux. The results obtained for the Al-Ti-B/NaF-AlF 3 and Al-Zr-B/KF-AlF 3 systems were similar to those observed for the Al-Ti-B/KF-AlF 3 system

THE IMPORTANCE OF LIMIT SOLUTIONS & TEMPORAL AND SPATIAL SCALES IN THE TEACHING OF TRANSPORT PHENOMENA

Directory of Open Access Journals (Sweden)

SÁVIO LEANDRO BERTOLI

2016-07-01

Full Text Available In the engineering courses the field of Transport Phenomena is of significant importance and it is in several disciplines relating to Fluid Mechanics, Heat and Mass Transfer. In these disciplines, problems involving these phenomena are mathematically formulated and analytical solutions are obtained whenever possible. The aim of this paper is to emphasize the possibility of extending aspects of the teaching-learning in this area by a method based on time scales and limit solutions. Thus, aspects relative to the phenomenology naturally arise during the definition of the scales and / or by determining the limit solutions. Aspects concerning the phenomenology of the limit problems are easily incorporated into the proposed development, which contributes significantly to the understanding of physics inherent in the mathematical modeling of each limiting case studied. Finally the study aims to disseminate the use of the limit solutions and of the time scales in the general fields of engineering.

A time-of-flight neutron reflectometer for surface and interfacial studies

International Nuclear Information System (INIS)

Penfold, J.; Ward, R.C.; Williams, W.G.

1987-03-01

A time-of-flight neutron reflectometer constructed for surface and interfacial studies, and installed at the ISIS pulsed neutron source, is described. One of its important design features is its inclined incident beam, since this allows both liquid and solid surface phenomena to be investigated. Measurements are presented to show the performance of the instrument, and new representative results, which include studies of liquid surfaces, Langmuir-Blodgett films, and thin film multilayers, are included as illustrations of the scientific potential of the method. (author)

Numerical analysis of interfacial growth and deformation in horizontal stratified two-phase flow by lattice Boltzmann method

International Nuclear Information System (INIS)

Ebihara, Ken-ichi

2005-03-01

Two-phase flow is one of the important phenomena in nuclear reactors and heat exchangers at nuclear plants. It is desired for the optimum design and safe operation of such equipment to understand and predict the two-phase flow phenomenon by numerical analysis. In the present, the two-fluid model is widely used for the numerical analysis of two-phase flow. The numerical analysis method using the two-fluid model solves macroscopic hydrodynamic equations, in which fluid is regarded as continuum, with the boundary conditions at the wall, the inlet and outlet, and the interface between two phases. Since the interfacial and the wall boundary conditions utilized by this method are given as the model, such as the flow regime map and correlation, which is usually constructed on the basis of experimental results, the accuracy of the two-phase flow analysis using the two-fluid model depends on that of the utilized model or the experiment result for modeling. Tremendous progress of the computer performance and the development of new computational methods make the numerical simulation of two-phase flow with the interfacial motion possible in resent years. In such circumstances, the lattice-gas method and the lattice Boltzmann method, which represent fluid by many particles or the particle distribution function on the spatial lattice, was proposed in 1990s and these methods are applied to the numerical simulation of two-phase flow. The main feature of the two-phase fluid model of those methods is the capability of the simulation of two-phase flow without the procedure for tracking the interfacial position and shape owing to the inlet-particle potential generating the interface. Therefore it is expected that the lattice-gas method and the lattice Boltzmann method possess the predictability of the experiment by the numerical analysis of two-phase flow as well as the possibility of giving the substitute of the flow regime map and the correlation used by the two-fluid model. In this

Clarification of complex phenomena in nuclear plants present status and future trend of fluid analysis by cellular automaton methods

International Nuclear Information System (INIS)

Kato, Yasuyoshi

1999-01-01

Since most of complex phenomena comprise of various elementary processes e.g., fluid flow, heat conduction, phase transition, chemical reaction, structural deformation, and these processes interact each other nonlinearly, the complex phenomena cannot be easily clarified by such the conventional topdown approaches as describe phenomena by using differential equations. In contrast to the topdown approaches where the differential equations are located at the top of the analysis procedures, these are bottomup approaches where phenomena are reproduced by local interaction of particles on cells. Cellular automata are one of the typical bottomup approaches. The basic principle, computer simulation results, and massively parallel processors for the cellular automata are reviewed and perspectives of the bottomup approach are discussed on clarification of the complex phenomena in nuclear plants. The computer simulations mainly deal with fluid flows and phase interfacial phenomena. (author)

Unusual interfacial phenomena at a surface of fullerite and carbon nanotubes

International Nuclear Information System (INIS)

Gun’ko, Vladimir M.; Turov, Vladimir V.; Schur, Dmitry V.; Zarko, Vladimir I.; Prykhod’ko, Gennady P.; Krupska, Tetyana V.; Golovan, Alina P.; Skubiszewska-Zięba, Jadwiga; Charmas, Barbara; Kartel, Mykola T.

2015-01-01

Highlights: • Interfacial behavior of polar and nonpolar adsorbates vs. structure of fullerite and MWCNT. • Confined space effects on the characteristics of water bound to carbons. • Broadening of "1H NMR spectra of water adsorbed to carbons toward strong downfield and upfield shifts. • Strongly and weakly associated and strongly and weakly bound waters. • Decreased activity of bound water as a solvent. - Abstract: Interactions of water, methane, HCl, C_6H_6, F_3CCOOD, and hyaluronic acid with fullerite C_6_0/C_7_0 and multi-walled carbon nanotubes (MWCNT) were studied in various media using "1H NMR spectroscopy. The materials were characterized using microscopy, differential scanning calorimetry, Raman spectroscopy, and quantum chemical methods. Water with weakly (WAW) and strongly (SAW) associated molecules bound to fullerite demonstrates unusual downfield shifts δ_H < 18 ppm. WAW in contrast to SAW cannot dissolve acids. Water bound to MWCNT demonstrates the downfield shift smaller than that observed for fullerite. Fullerite possesses low porosity due dense packing of fullerenes in molecular crystals. Therefore, noticeable adsorption is observed only for compounds, which are capable for intercalation (benzene, toluene, water), but nitrogen cannot be adsorbed by fullerite. For MWCNT with much looser structure than that of fullerite, pre-adsorbed water weakly affects methane adsorption. An increase in pre-adsorption of water results in decrease in adsorption of methane onto MWCNT.

Effect of the surface roughness on interfacial properties of carbon fibers reinforced epoxy resin composites

International Nuclear Information System (INIS)

Song Wei; Gu Aijuan; Liang Guozheng; Yuan Li

2011-01-01

The effect of the surface roughness on interfacial properties of carbon fibers (CFs) reinforced epoxy (EP) resin composite is studied. Aqueous ammonia was applied to modify the surfaces of CFs. The morphologies and chemical compositions of original CFs and treated CFs (a-CFs) were characterized by Atomic Force Microscopy (AFM), and X-ray Photoelectron Spectroscopy (XPS). Compared with the smooth surface of original CF, the surface of a-CF has bigger roughness; moreover, the roughness increases with the increase of the treating time. On the other hand, no obvious change in chemical composition takes place, indicating that the treating mechanism of CFs by aqueous ammonia is to physically change the morphologies rather than chemical compositions. In order to investigate the effect of surface roughness on the interfacial properties of CF/EP composites, the wettability and Interfacial Shear Strength (IFSS) were measured. Results show that with the increase of the roughness, the wettabilities of CFs against both water and ethylene glycol improves; in addition, the IFSS value of composites also increases. These attractive phenomena prove that the surface roughness of CFs can effectively overcome the poor interfacial adhesions between CFs and organic matrix, and thus make it possible to fabricate advanced composites based on CFs.

Kinetic theory and transport phenomena

CERN Document Server

Soto, Rodrigo

2016-01-01

This textbook presents kinetic theory, which is a systematic approach to describing nonequilibrium systems. The text is balanced between the fundamental concepts of kinetic theory (irreversibility, transport processes, separation of time scales, conservations, coarse graining, distribution functions, etc.) and the results and predictions of the theory, where the relevant properties of different systems are computed. The book is organised in thematic chapters where different paradigmatic systems are studied. The specific features of these systems are described, building and analysing the appropriate kinetic equations. Specifically, the book considers the classical transport of charges, the dynamics of classical gases, Brownian motion, plasmas, and self-gravitating systems, quantum gases, the electronic transport in solids and, finally, semiconductors. Besides these systems that are studied in detail, concepts are applied to some modern examples including the quark–gluon plasma, the motion of bacterial suspen...

Modeling of the Transport Phenomena in Passive Direct Methanol Fuel Cells Using a Two-Phase Anisotropic Model

Directory of Open Access Journals (Sweden)

Zheng Miao

2014-04-01

Full Text Available The transport phenomena in a passive direct methanol fuel cell (DMFC were numerically simulated by the proposed two-dimensional two-phase nonisothermal mass transport model. The anisotropic transport characteristic and deformation of the gas diffusion layer (GDL were considered in this model. The natural convection boundary conditions were adopted for the transport of methanol, oxygen, and heat at the GDL outer surface. The effect of methanol concentration in the reservoir on cell performance was examined. The distribution of multiphysical fields in the membrane electrode assembly (MEA, especially in the catalyst layers (CLs, was obtained and analyzed. The results indicated that transport resistance for the methanol mainly existed in the MEA while that for oxygen and heat was primarily due to natural convection at the GDL outer surface. Because of the relatively high methanol concentration, the local reaction rate in CLs was mainly determined by the overpotential. Methanol concentration between 3 M and 4 M was recommended for passive liquid feed DMFC in order to achieve a balance between the cell performance and the methanol crossover.

Frontiers in transport phenomena research and education: Energy systems, biological systems, security, information technology and nanotechnology

Energy Technology Data Exchange (ETDEWEB)

Bergman, T.L.; Faghri, A. [Department of Mechanical Engineering, The University of Connecticut, Storrs, CT 06269-3139 (United States); Viskanta, R. [School of Mechanical Engineering, Purdue University, West Lafayette, IN 47907-2088 (United States)

2008-09-15

A US National Science Foundation-sponsored workshop entitled ''Frontiers in Transport Phenomena Research and Education: Energy Systems, Biological Systems, Security, Information Technology, and Nanotechnology'' was held in May of 2007 at the University of Connecticut. The workshop provided a venue for researchers, educators and policy-makers to identify frontier challenges and associated opportunities in heat and mass transfer. Approximately 300 invited participants from academia, business and government from the US and abroad attended. Based upon the final recommendations on the topical matter of the workshop, several trends become apparent. A strong interest in sustainable energy is evident. A continued need to understand the coupling between broad length (and time) scales persists, but the emerging need to better understand transport phenomena at the macro/mega scale has evolved. The need to develop new metrology techniques to collect and archive reliable property data persists. Societal sustainability received major attention in two of the reports. Matters involving innovation, entrepreneurship, and globalization of the engineering profession have emerged, and the responsibility to improve the technical literacy of the public-at-large is discussed. Integration of research thrusts and education activities is highlighted throughout. Specific recommendations, made by the panelists with input from the international heat transfer community and directed to the National Science Foundation, are included in several reports. (author)

Interfacial effects in multilayers

International Nuclear Information System (INIS)

Barbee, T.W. Jr.

1998-01-01

Interfacial structure and the atomic interactions between atoms at interfaces in multilayers or nano-laminates have significant impact on the physical properties of these materials. A technique for the experimental evaluation of interfacial structure and interfacial structure effects is presented and compared to experiment. In this paper the impact of interfacial structure on the performance of x-ray, soft x-ray and extreme ultra-violet multilayer optic structures is emphasized. The paper is concluded with summary of these results and an assessment of their implications relative to multilayer development and the study of buried interfaces in solids in general

Lunar magma transport phenomena

Science.gov (United States)

Spera, Frank J.

1992-01-01

An outline of magma transport theory relevant to the evolution of a possible Lunar Magma Ocean and the origin and transport history of the later phase of mare basaltic volcanism is presented. A simple model is proposed to evaluate the extent of fractionation as magma traverses the cold lunar lithosphere. If Apollo green glasses are primitive and have not undergone significant fractionation en route to the surface, then mean ascent rates of 10 m/s and cracks of widths greater than 40 m are indicated. Lunar tephra and vesiculated basalts suggest that a volatile component plays a role in eruption dynamics. The predominant vapor species appear to be CO CO2, and COS. Near the lunar surface, the vapor fraction expands enormously and vapor internal energy is converted to mixture kinetic energy with the concomitant high-speed ejection of vapor and pyroclasts to form lunary fire fountain deposits such as the Apollo 17 orange and black glasses and Apollo 15 green glass.

Interfacially controlled phenomena in the system K2CO3-KAlO2

International Nuclear Information System (INIS)

Cook, L.P.

1981-01-01

Potassium carbonate has become of special interest to a number of ceramists because of its use as ionizing seed material which is added to combustion gases to produce a conductive plasma in magnetohydrodynamic electrical power generators. In this high temperature environment, chemical interaction occurs not only with ceramic components of the system such as electrodes and insulators, but also with the mineral ash of the coal used to fuel the generator. As a result, potassium aluminate is an important component of the slags accummulating in such generators. The system K 2 CO 3 -KAlO 2 is under investigation as part of a more general study of potassium carbonate - slag interaction. This note is a summary of some preliminary observations on the phase equilibria of K 2 CO 3 -KAlO 2 with focus on the unusual melting behavior of Kat''CO 3 /KAlO 2 mixtures which appears to have its origin in interfacial interaction

Monte Carlo studies on the interfacial properties and interfacial structures of ternary symmetric blends with gradient copolymers.

Science.gov (United States)

Sun, Dachuan; Guo, Hongxia

2012-08-09

Using Monte Carlo simulation methods, the effects of the comonomer sequence distribution on the interfacial properties (including interfacial tension, interfacial thickness, saturated interfacial area per copolymer, and bending modulus) and interfacial structures (including chain conformations and comonomer distributions of the simulated copolymers at the interfaces) of a ternary symmetric blend containing two immiscible homopolymers and one gradient copolymer are investigated. We find that copolymers with a larger composition gradient width have a broader comonomer distribution along the interface normal, and hence more pronouncedly enlarge the interfacial thickness and reduce the interfacial tension. Furthermore, the counteraction effect, which arises from the tendency of heterogeneous segments in gradient copolymers to phase separate and enter their miscible phases to reduce the local enthalpy, decreases the stretching of copolymers along the interface normal direction. As a result, copolymers with a larger width of gradient composition can occupy a larger interfacial area and form softer monolayers at saturation and are more efficient in facilitating the formation of bicontinuous microemulsions. Additionally, chain length ratio, segregation strength, and interactions between homopolymers and copolymers can alter the interfacial character of gradient copolymers. There exists a strong coupling between the comonomer sequence distribution, chain conformation, and interfacial properties. Especially, bending modulus is mainly determined by the complicated interplay of interfacial copolymer density and interfacial chain conformation.

Engineering a spin-fet: spin-orbit phenomena and spin transport induced by a gate electric field

OpenAIRE

Cardoso, J. L.; Hernández-Saldaña, H.

2012-01-01

In this work, we show that a gate electric field, applied in the base of the field-effect devices, leads to inducing spin-orbit interactions (Rashba and linear Dresselhauss) and confines the transport electrons in a two-dimensional electron gas. On the basis of these phenomena we solve analytically the Pauli equation when the Rashba strength and the linear Dresselhaus one are equal, for a tuning value of the gate electric field $\\mathcal{E}_g^*$. Using the transfer matrix approach, we provide...

A solution-processed binary cathode interfacial layer facilitates electron extraction for inverted polymer solar cells.

Science.gov (United States)

Zhang, Xinyuan; Li, Zhiqi; Liu, Chunyu; Guo, Jiaxin; Shen, Liang; Guo, Wenbin

2018-03-15

The charge transfer and separation are significantly affected by the electron properties of the interface between the electron-donor layer and the carrier-transporting layer in polymer solar cells (PSCs). In this study, we investigate the electron extraction mechanism of PSCs with a low temperature solution-processed ZnO/PEI as electron transport layer. The incorporation of PEI layer can decrease the work function of ZnO and reduce interfacial barrier, which facilitates electron extraction and suppresses bimolecular recombination, leading to a significant performance enhancement. Furthermore, PEI layer can induce phase separation and passivite inorganic surface trap states as well as shift the interfacial energy offset between metal oxide and organic materials. This work offers a simple and effective way to improve the charge transporting property of organic photovoltaic devices. Copyright © 2017 Elsevier Inc. All rights reserved.

Insect flight on fluid interfaces: a chaotic interfacial oscillator

Science.gov (United States)

Mukundarajan, Haripriya; Prakash, Manu

2013-11-01

Flight is critical to the dominance of insect species on our planet, with about 98 percent of insect species having wings. How complex flight control systems developed in insects is unknown, and arboreal or aquatic origins have been hypothesized. We examine the biomechanics of aquatic origins of flight. We recently reported discovery of a novel mode of ``2D flight'' in Galerucella beetles, which skim along an air-water interface using flapping wing flight. This unique flight mode is characterized by a balance between capillary forces from the interface and biomechanical forces exerted by the flapping wings. Complex interactions on the fluid interface form capillary wave trains behind the insect, and produce vertical oscillations at the surface due to non-linear forces arising from deformation of the fluid meniscus. We present both experimental observations of 2D flight kinematics and a dynamic model explaining the observed phenomena. Careful examination of this interaction predicts the chaotic nature of interfacial flight and takeoff from the interface into airborne flight. The role of wingbeat frequency, stroke plane angle and body angle in determining transition between interfacial and fully airborne flight is highlighted, shedding light on the aquatic theory of flight evolution.

New modeling and experimental approaches for characterization of two-phase flow interfacial structure

International Nuclear Information System (INIS)

Ishii, Mamoru; Sun, Xiaodong

2004-01-01

This paper presents new experimental and modeling approaches in characterizing interfacial structures in gas-liquid two-phase flow. For the experiments, two objective approaches are developed to identify flow regimes and to obtain local interfacial structure data. First, a global measurement technique using a non-intrusive ring-type impedance void-meter and a self-organizing neural network is presented to identify the one-dimensional'' flow regimes. In the application of this measurement technique, two methods are discussed, namely, one based on the probability density function of the impedance probe measurement (PDF input method) and the other based on the sorted impedance signals, which is essentially the cumulative probability distribution function of the impedance signals (instantaneous direct signal input method). In the latter method, the identification can be made close to instantaneously since the required signals can be acquired over a very short time period. In addition, a double-sensor conductivity probe can also be used to obtain ''local'' flow regimes by using the instantaneous direct signal input method with the bubble chord length information. Furthermore, a newly designed conductivity probe with multiple double-sensor heads is proposed to obtain ''two-dimensional'' flow regimes across the flow channel. Secondly, a state-of-the-art four-sensor conductivity probe technique has been developed to obtain detailed local interfacial structure information. The four-sensor conductivity probe accommodates the double-sensor probe capability and can be applied in a wide range of flow regimes spanning from bubbly to churn-turbulent flows. The signal processing scheme is developed such that it categorizes the acquired parameters into two groups based on bubble cord length information. Furthermore, for the modeling of the interfacial structure characterization, the interfacial area transport equation proposed earlier has been studied to provide a dynamic and

Thermal transport across graphene and single layer hexagonal boron nitride

International Nuclear Information System (INIS)

Zhang, Jingchao; Hong, Yang; Yue, Yanan

2015-01-01

As the dimensions of nanocircuits and nanoelectronics shrink, thermal energies are being generated in more confined spaces, making it extremely important and urgent to explore for efficient heat dissipation pathways. In this work, the phonon energy transport across graphene and hexagonal boron-nitride (h-BN) interface is studied using classic molecular dynamics simulations. Effects of temperature, interatomic bond strength, heat flux direction, and functionalization on interfacial thermal transport are investigated. It is found out that by hydrogenating graphene in the hybrid structure, the interfacial thermal resistance (R) between graphene and h-BN can be reduced by 76.3%, indicating an effective approach to manipulate the interfacial thermal transport. Improved in-plane/out-of-plane phonon couplings and broadened phonon channels are observed in the hydrogenated graphene system by analyzing its phonon power spectra. The reported R results monotonically decrease with temperature and interatomic bond strengths. No thermal rectification phenomenon is observed in this interfacial thermal transport. Results reported in this work give the fundamental knowledge on graphene and h-BN thermal transport and provide rational guidelines for next generation thermal interface material designs

Heat science and transport phenomena in fuel cells; Thermique et phenomenes de transport dans les piles a combustible

Energy Technology Data Exchange (ETDEWEB)

Liberatore, P.M.; Boillot, M. [Laboratoire des Sciences du Genie Chimique de Nancy, 54 - Vandoeuvre-les-Nancy (France); Bonnet, C.; Didieerjean, S.; Lapicque, F.; Deseure, J.; Lottin, O.; Maillet, D.; Oseen-Senda, J. [Laboratoire d' Energetique et de Mecanique Theorique et Appliquee, 54 - Vandoeuvre Les Nancy (France); Alexandre, A. [Laboratoire d' Etudes Thermiques, ENSMA, 86 Poitiers (France); Topin, F.; Occelli, R.; Daurelle, J.V. [IUSTI / Polytech' Marseille, Institut universitaire des Systemes Thermiques Industriels Ecole, 13 - Marseille (France); Pauchet, J.; Feidt, M. [CEA Grenoble, Groupement pour la recherche sur les echangeurs thermiques (Greth), 38 (France); Voarino, C. [CEA Centre d' Etudes du Ripault, 37 - Tours (France); Morel, B.; Laurentin, J.; Bultel, Y.; Lefebvre-Joud, F. [CEA Grenoble, LEPMI, 38 (France); Auvity, B.; Lasbet, Y.; Castelain, C.; Peerohossaini, H. [Ecole Centrale de Nantes, Laboratoire de Thermocinetique de Nantes (LTN), 44 - Nantes (France)

2005-07-01

In this work are gathered the transparencies of the lectures presented at the conference 'heat science and transport phenomena in fuel cells'. The different lectures have dealt with 1)the gas distribution in the bipolar plates of a fuel cell: experimental studies and computerized simulations 2)two-phase heat distributors in the PEMFC 3)a numerical study of the flow properties of the backing layers on the transfers in a PEMFC 4)modelling of the heat and mass transfers in a PEMFC 5)two-phase cooling of the PEMFC with pentane 6)stationary thermodynamic model of the SOFC in the GECOPAC system 7)modelling of the internal reforming at the anode of the SOFC 8)towards a new thermal design of the PEMFC bipolar plates. (O.M.)

Modeling of isothermal bubbly flow with interfacial area transport equation and bubble number density approach

Energy Technology Data Exchange (ETDEWEB)

Sari, Salih [Hacettepe University, Department of Nuclear Engineering, Beytepe, 06800 Ankara (Turkey); Erguen, Sule [Hacettepe University, Department of Nuclear Engineering, Beytepe, 06800 Ankara (Turkey); Barik, Muhammet; Kocar, Cemil; Soekmen, Cemal Niyazi [Hacettepe University, Department of Nuclear Engineering, Beytepe, 06800 Ankara (Turkey)

2009-03-15

In this study, isothermal turbulent bubbly flow is mechanistically modeled. For the modeling, Fluent version 6.3.26 is used as the computational fluid dynamics solver. First, the mechanistic models that simulate the interphase momentum transfer between the gas (bubbles) and liquid (continuous) phases are investigated, and proper models for the known flow conditions are selected. Second, an interfacial area transport equation (IATE) solution is added to Fluent's solution scheme in order to model the interphase momentum transfer mechanisms. In addition to solving IATE, bubble number density (BND) approach is also added to Fluent and this approach is also used in the simulations. Different source/sink models derived for the IATE and BND models are also investigated. The simulations of experiments based on the available data in literature are performed by using IATE and BND models in two and three-dimensions. The results show that the simulations performed by using IATE and BND models agree with each other and with the experimental data. The simulations performed in three-dimensions give better agreement with the experimental data.

Modeling of isothermal bubbly flow with interfacial area transport equation and bubble number density approach

International Nuclear Information System (INIS)

Sari, Salih; Erguen, Sule; Barik, Muhammet; Kocar, Cemil; Soekmen, Cemal Niyazi

2009-01-01

In this study, isothermal turbulent bubbly flow is mechanistically modeled. For the modeling, Fluent version 6.3.26 is used as the computational fluid dynamics solver. First, the mechanistic models that simulate the interphase momentum transfer between the gas (bubbles) and liquid (continuous) phases are investigated, and proper models for the known flow conditions are selected. Second, an interfacial area transport equation (IATE) solution is added to Fluent's solution scheme in order to model the interphase momentum transfer mechanisms. In addition to solving IATE, bubble number density (BND) approach is also added to Fluent and this approach is also used in the simulations. Different source/sink models derived for the IATE and BND models are also investigated. The simulations of experiments based on the available data in literature are performed by using IATE and BND models in two and three-dimensions. The results show that the simulations performed by using IATE and BND models agree with each other and with the experimental data. The simulations performed in three-dimensions give better agreement with the experimental data

The Interfacial Thermal Conductance of Epitaxial Metal-Semiconductor Interfaces

Science.gov (United States)

Ye, Ning

Understanding heat transport at nanometer and sub-nanometer lengthscales is critical to solving a wide range of technological challenges related to thermal management and energy conversion. In particular, finite Interfacial Thermal Conductance (ITC) often dominates transport whenever multiple interfaces are closely spaced together or when heat originates from sources that are highly confined by interfaces. Examples of the former include superlattices, thin films, quantum cascade lasers, and high density nanocomposites. Examples of the latter include FinFET transistors, phase-change memory, and the plasmonic transducer of a heat-assisted magnetic recording head. An understanding of the physics of such interfaces is still lacking, in part because experimental investigations to-date have not bothered to carefully control the structure of interfaces studied, and also because the most advanced theories have not been compared to the most robust experimental data. This thesis aims to resolve this by investigating ITC between a range of clean and structurally well-characterized metal-semiconductor interfaces using the Time-Domain Thermoreflectance (TDTR) experimental technique, and by providing theoretical/computational comparisons to the experimental data where possible. By studying the interfaces between a variety of materials systems, each with unique aspects to their tunability, I have been able to answer a number of outstanding questions regarding the importance of interfacial quality (epitaxial/non-epitaxial interfaces), semiconductor doping, matching of acoustic and optical phonon band structure, and the role of phonon transport mechanisms apart from direct elastic transmission on ITC. In particular, we are able to comment on the suitability of the diffuse mismatch model (DMM) to describe the transport across epitaxial interfaces. To accomplish this goal, I studied interfacial thermal transport across CoSi2, TiSi2, NiSi and PtSi - Si(100) and Si(111), (silicides

Transport Phenomena and Interfacial Kinetics in Planar Microfluidic Membraneless Fuel Cells

Energy Technology Data Exchange (ETDEWEB)

Abruna, Hector Daniel [Cornell University

2013-08-01

Our work is focused on membraneless laminar flow fuel cells, an unconventional fuel cell technology, intended to create a system that not only avoids most typical fuel cell drawbacks, but also achieves the highest power density yet recorded for a non-H{sub 2} fuel cell. We have employed rigorous electrochemistry to characterize the high-energy- density fuel BH4-, providing important mechanistic insight for anode catalyst choice and avoiding deleterious side reactions. Numerous fuel cell oxidants, used in place of O{sub 2}, are compared in a detailed, uniform manner, and a powerful new oxidant, cerium ammonium nitrate (CAN), is described. The high-voltage BH{sub 4}{sup -}/CAN fuel/oxidant combination is employed in a membraneless, room temperature, laminar-flow fuel cell, with herringbone micromixers which provide chaotic-convective flow which, in turn, enhances both the power output and efficiency of the device. We have also been involved in the design of a scaled-up version of the membraneless laminar flow fuel cell intended to provide a 10W output.

Interfacial charge distributions in carbon-supported palladium catalysts

DEFF Research Database (Denmark)

Rao, Radhika G.; Blume, Raoul; Hansen, Thomas Willum

2017-01-01

Controlling the charge transfer between a semiconducting catalyst carrier and the supported transition metal active phase represents an elite strategy for fine turning the electronic structure of the catalytic centers, hence their activity and selectivity. These phenomena have been theoretically...... and experimentally elucidated for oxide supports but remain poorly understood for carbons due to their complex nanoscale structure. Here, we combine advanced spectroscopy and microscopy on model Pd/C samples to decouple the electronic and surface chemistry effects on catalytic performance. Our investigations reveal...... treatments can be used to tune the interfacial charge distribution, hereby providing a strategy to rationally design carbon-supported catalysts.Control over charge transfer in carbon-supported metal nanoparticles is essential for designing new catalysts. Here, the authors show that thermal treatments...

Colloids: a review of current knowledge with a view to application to phenomena of transportation within PWR; Colloides: point de vue sur les connaissances actuelles en vue d`une application aux phenomenes de transport dans les REP

Energy Technology Data Exchange (ETDEWEB)

Guinard, L.

1996-12-31

In an attempt to minimise dosimetry within the primary circuit of PWR units, research is being carried out into understanding the phenomena of transportation and deposition of corrosion products. It is therefore desirable to known the form of these corrosion products and the laws governing this form. It is generally considered that they are in soluble or particulate form. A third starts with a general presentation of colloids and goes on to define points which are useful, both on a theoretical and experimental level, in terms of application to phenomena of transportation within PWRs. (author). 69 refs., 30 figs., 6 tabs., 3 appends.

Experimental investigation on the droplet entrainment from interfacial waves in air-water horizontal stratified flow

International Nuclear Information System (INIS)

Bae, Byeong Geon; Yun, Byong Jo; Kim, Kyoung Du

2014-01-01

It was mainly due to the fact that droplet entrainment affects the Peak Cladding Temperature (PCT) of the nuclear fuel rod in the Postulated accident conditions of NPP. Recently, droplet entrainment in the horizontally arranged primary piping system for the NPP is of interest because it affects directly the steam binding phenomena in the steam generators. Pan and Hanratty correlation is the only applicable one for the droplet entrainment rate model for horizontal flow. Moreover, there are no efforts for the model development on the basis of the droplet entrainment principal and physics phenomena. More recently, Korea Atomic Energy Research Institute (KAERI) proposed a new mechanistic droplet generation model applicable in the horizontal pipe for the SPACE code. However, constitutive relations in this new model require three model coefficients which have not yet been decided. The purpose of present work is determining three model coefficients by visualization experiment. For these model coefficients, the major physical parameters regarding the interfacial disturbance wave should be measured in this experiments. There are the wave slope, liquid fraction, wave hypotenuse length, wave velocity, wave frequency, and wavelength in the major physical parameters. The experiment was conducted at an air water horizontal rectangular channel with the PIV system. In this study, the experimental conditions were stratified-way flow during the droplet generation. Three coefficients were determined based on several data related to the interfacial wave. Additionally, we manufactured the parallel wire conductance probe to measure the fluctuating water level over time, and compared the wave height measured by the parallel wire conductance probe and image processing from images taken by high speed camera. Experimental investigation was performed for droplet entrainment from phase interface wave in an air-water stratified flow. In the experiments, we measured major physical parameters

Establishing a Quantitative Functional Relationship between Capillary Pressure Saturation and Interfacial Area

International Nuclear Information System (INIS)

Carlo Montemagno

2002-01-01

We propose to continue our collaborative research focused on advanced technologies for subsurface contamination problems. Our approach combines new multi-phase flow theory, novel laboratory experiments, and non-traditional computational simulators to investigate practical approaches to include interfacial areas in descriptions of subsurface contaminant transport and remediation. Because all inter-phase mass transfer occurs at fluid-fluid interfaces, and it is this inter-phase mass transfer that leads to the difficult, long-term ground-water contamination problems, it is critical to include interfacial behavior in the problem description. This is currently lacking in all standard models of complex ground-water contamination problems. In our earlier project, we developed tools appropriate for inclusion of interfacial areas under equilibrium conditions. These include advanced laboratory techniques and targeted computational experiments that validated certain key theoretical conjecture s. However, it has become clear that to include interfacial behavior fully into a description of the multi-phase flow and contamination problems, the fully dynamic case must be considered. Therefore, we need to develop both experimental and computational tools that can capture the dynamic nature of interfacial movements. Development and application of such tools will allow the theory to be evaluated, and will lead to significant improvements in our understanding of complex subsurface contamination problems, thereby allowing us to develop and evaluate improved remediation technologies

Numerical simulation of mass and energy transport phenomena in solid oxide fuel cells

Energy Technology Data Exchange (ETDEWEB)

Arpino, F. [Dipartimento di Meccanica, Strutture, Ambiente e Territorio (DiMSAT), University of Cassino, via Di Biasio 43, Cassino (Italy); Massarotti, N. [Dipertimento per le Tecnologie (DiT), University of Naples ' ' Parthenope' ' , Centro Direzionale, isola C4, 80143 Napoli (Italy)

2009-12-15

Solid Oxide Fuel Cells (SOFCs) represent a very promising technology for near future energy conversion thanks to a number of advantages, including the possibility of using different fuels. In this paper, a detailed numerical model, based on a general mathematical description and on a finite element Characteristic based Split (CBS) algorithm code is employed to simulate mass and energy transport phenomena in SOFCs. The model predicts the thermodynamic quantity of interest in the fuel cell. Full details of the numerical solution obtained are presented both in terms of heat and mass transfer in the cell and in terms of electro-chemical reactions that occur in the system considered. The results obtained with the present algorithm is compared with the experimental data available in the literature for validation, showing an excellent agreement. (author)

Implementation of a new interfacial mass and energy transfer model in RETRAN-3D

International Nuclear Information System (INIS)

Macian, R.; Cebulh, P.; Coddington, P.; Paulsen, M.

1999-01-01

The RETRAN-3D MOD002.0 best estimate code includes a five-equation flow field model developed to deal with situations in which thermodynamic non-equilibrium phenomena are important. Several applications of this model to depressurization and pressurization transients showed serious convergence problems. An analysis of the causes for the numerical instabilities identified the models for interfacial heat and mass transfer as the source of the problems. A new interfacial mass and energy transfer model has thus been developed and implemented in RETRAN-3D. The heat transfer for each phase is equal to the product of the interfacial area density, a heat transfer coefficient and the temperature difference between the interface at saturation and the bulk temperature of the respective phase. However, in the context of RETRAN-3D, the vapor remains saturated in a two-phase volume, and no vapor heat transfer is thus calculated. The values of interfacial area density and heat transfer coefficient are obtained based on correlations appropriate for different flow regimes. A flow regime map, based on the work of Taitel and Dukler, with void fraction and mixture mass flux as map coordinates, is used to identify the flow regime present in a given volume. The new model has performed well when assessed against data from four experimental facilities covering depressurization, condensation and steady state void distribution. The results also demonstrate the viability of the approach followed to develop the new model for a five-equation based code. (author)

Study of phenomena of tracer transport and dispersion in fractured media

International Nuclear Information System (INIS)

Ippolito, Irene

1993-01-01

The objective of this research thesis is to present some transport phenomena according to two different approaches: firstly, the study of flows and tracing in a natural crack within a granitic site, and secondly, the study of flows of different geometries in model cracks, mainly by using techniques of tracer dispersion. The author first presents some properties of fractured media and elements of the theory of the phenomenon of dispersion. She notably discusses the reversibility of the Taylor dispersion which is the prevailing mechanism for simply connected geometries such as in the case of a flow between two continuous solid surfaces limiting a fracture. In the next chapters, the author reports the analysis of characteristics of local structures (mouths, roughnesses) of a single fracture by using echo dispersion. She reports experiments as well as Monte Carlo simulations performed on well defined geometries. In a parallel way, some characteristics measurements (rate-pressure, distribution of flows and tracing in transmission) and mechanical measurements of fracture deformation have been performed on a natural fracture in a granitic site [fr

Phenomena in thermal transport in fuels

International Nuclear Information System (INIS)

Chernatynskiy, A.; Tulenko, J.S.; Phillpot, S.R.; El-Azab, A.

2015-01-01

Thermal transport in nuclear fuels is a key performance metric that affects not only the power output, but is also an important consideration in potential accident situations. While the fundamental theory of the thermal transport in crystalline solids was extensively developed in the 1950's and 1960's, the pertinent analytic approaches contained significant simplifications of the physical processes. While these approaches enabled estimates of the thermal conductivity in bulk materials with microstructure, they were not comprehensive enough to provide the detailed guidance needed for the in-pile fuel performance. Rather, this guidance has come from data painfully accumulated over 50 years of experiments on irradiated uranium dioxide, the most widely used nuclear fuel. At this point, a fundamental theoretical understanding of the interplay between the microstructure and thermal conductivity of irradiated uranium dioxide fuel is still lacking. In this chapter, recent advances are summarised in the modelling approaches for thermal transport of uranium dioxide fuel. Being computational in nature, these modelling approaches can, at least in principle, describe in detail virtually all mechanisms affecting thermal transport at the atomistic level, while permitting the coupling of the atomistic-level simulations to the mesoscale continuum theory and thus enable the capture of the impact of microstructural evolution in fuel on thermal transport. While the subject of current studies is uranium dioxide, potential applications of the methods described in this chapter extend to the thermal performance of other fuel forms. (authors)

Development of Interfacial Structure in a Confined Air-Water Cap-Turbulent and Churn-Turbulent Flow

International Nuclear Information System (INIS)

Sun, X.; Kim, S.; Cheng, L.; Ishii, M.; Beus, S.G.

2001-01-01

The objective of the present work is to study and model the interfacial structure development of air-water two-phase flow in a confined test section. Experiments of a total of 9 flow conditions in a cap-turbulent and churn-turbulent flow regimes are carried out in a vertical air-water upward two-phase flow experimental loop with a test section of 20-cm in width and 1-cm in gap. The miniaturized four-sensor conductivity probes are used to measure local two-phase parameters at three different elevations for each flow condition. The bubbles captured by the probes are categorized into two groups in view of the two-group interfacial area transport equation, i.e., spherical/distorted bubbles as Group 1 and cap/churn-turbulent bubbles as Group 2. The acquired parameters are time-averaged local void fraction, interfacial velocity, bubble number frequency, interfacial area concentration, and bubble Sauter mean diameter for both groups of bubbles. Also, the line-averaged and area-averaged data are presented and discussed. The comparisons of these parameters at different elevations demonstrate the development of interfacial structure along the flow direction due to bubble interactions

Development of Interfacial Structure in a Confined Air-Water Cap-Turbulent and Churn-Turbulent Flow

International Nuclear Information System (INIS)

Xiaodong Sun; Seungjin Kim; Ling Cheng; Mamoru Ishii; Beus, Stephen G.

2002-01-01

The objective of the present work is to study and model the interfacial structure development of air-water two-phase flow in a confined test section. Experiments of a total of 9 flow conditions in cap-turbulent and churn-turbulent flow regimes are carried out in a vertical air-water upward two-phase flow experimental loop with a test section of 200-mm in width and 10-mm in gap. Miniaturized four-sensor conductivity probes are used to measure local two-phase parameters at three different elevations for each flow condition. The bubbles captured by the probes are categorized into two groups in view of the two-group interfacial area transport equation, i.e., spherical/distorted bubbles as Group 1 and cap/churn-turbulent bubbles as Group 2. The acquired parameters are time-averaged local void fraction, interfacial velocity, bubble number frequency, interfacial area concentration, and bubble Sauter mean diameter for both groups of bubbles. Also, the line-averaged and area-averaged data are presented and discussed. The comparisons of these parameters at different elevations demonstrate the development of interfacial structure along the flow direction due to bubble interactions. (authors)

Establishing a Quantitative Functional Relationship between Capillary Pressure Saturation and Interfacial Area; FINAL

International Nuclear Information System (INIS)

Carlo Montemagno

2002-01-01

We propose to continue our collaborative research focused on advanced technologies for subsurface contamination problems. Our approach combines new multi-phase flow theory, novel laboratory experiments, and non-traditional computational simulators to investigate practical approaches to include interfacial areas in descriptions of subsurface contaminant transport and remediation. Because all inter-phase mass transfer occurs at fluid-fluid interfaces, and it is this inter-phase mass transfer that leads to the difficult, long-term ground-water contamination problems, it is critical to include interfacial behavior in the problem description. This is currently lacking in all standard models of complex ground-water contamination problems. In our earlier project, we developed tools appropriate for inclusion of interfacial areas under equilibrium conditions. These include advanced laboratory techniques and targeted computational experiments that validated certain key theoretical conjecture s. However, it has become clear that to include interfacial behavior fully into a description of the multi-phase flow and contamination problems, the fully dynamic case must be considered. Therefore, we need to develop both experimental and computational tools that can capture the dynamic nature of interfacial movements. Development and application of such tools will allow the theory to be evaluated, and will lead to significant improvements in our understanding of complex subsurface contamination problems, thereby allowing us to develop and evaluate improved remediation technologies

Monte Carlo simulation of neutron transport phenomena

International Nuclear Information System (INIS)

Srinivasan, P.

2009-01-01

Neutron transport is one of the central problems in nuclear reactor related studies and other applied sciences. Some of the major applications of neutron transport include nuclear reactor design and safety, criticality safety of fissile material handling, neutron detector design and development, nuclear medicine, assessment of radiation damage to materials, nuclear well logging, forensic analysis etc. Most reactor and dosimetry studies assume that neutrons diffuse from regions of high to low density just like gaseous molecules diffuse to regions of low concentration or heat flow from high to low temperature regions. However while treatment of gaseous or heat diffusion is quite accurately modeled, treatment of neutron transport as simple diffusion is quite limited. In simple diffusion, the neutron trajectories are irregular, random and zigzag - where as in neutron transport low reaction cross sections (1 barn- 10 -24 cm 2 ) lead to long mean free paths which again depend on the nature and irregularities of the medium. Hence a more accurate representation of the neutron transport evolved based on the Boltzmann equation of kinetic gas theory. In fact the neutron transport equation is a linearized version of the Boltzmann gas equation based on neutron conservation with seven independent variables. The transport equation is difficult to solve except in simple cases amenable to numerical methods. The diffusion (equation) approximation follows from removing the angular dependence of the neutron flux

Kinetic phenomena in charged particle transport in gases, swarm parameters and cross section data

International Nuclear Information System (INIS)

Petrovic, Z Lj; Suvakov, M; Nikitovic, Z; Dujko, S; Sasic, O; Jovanovic, J; Malovic, G; Stojanovic, V

2007-01-01

In this review we discuss the current status of the physics of charged particle swarms, mainly electrons. The whole field is analysed mainly through its relationship to plasma modelling and illustrated by some recent examples developed mainly by our group. The measurements of the swarm coefficients and the availability of the data are briefly discussed. More time is devoted to the development of complete electron-molecule cross section sets along with recent examples such as NO, CF 4 and HBr. We extend the discussion to the availability of ion and fast neutral data and how swarm experiments may serve to provide new data. As a point where new insight into the kinetics of charge particle transport is provided, the role of kinetic phenomena is discussed and recent examples are listed. We focus here on giving two examples on how non-conservative processes make dramatic effects in transport, the negative absolute mobility and the negative differential conductivity for positrons in argon. Finally we discuss the applicability of swarm data in plasma modelling and the relationship to other fields where swarm experiments and analysis make significant contributions. (topical review)

Understanding Interfacial Alignment in Solution Coated Conjugated Polymer Thin Films

International Nuclear Information System (INIS)

Qu, Ge; Zhao, Xikang; Newbloom, Gregory M.; Zhang, Fengjiao; Mohammadi, Erfan

2017-01-01

Domain alignment in conjugated polymer thin films can significantly enhance charge carrier mobility. However, the alignment mechanism during meniscus-guided solution coating remains unclear. Furthermore, interfacial alignment has been rarely studied despite its direct relevance and critical importance to charge transport. In this study, we uncover a significantly higher degree of alignment at the top interface of solution coated thin films, using a donor–acceptor conjugated polymer, poly(diketopyrrolopyrrole-co-thiopheneco- thieno[3,2-b]thiophene-co-thiophene) (DPP2T-TT), as the model system. At the molecular level, we observe in-plane π–π stacking anisotropy of up to 4.8 near the top interface with the polymer backbone aligned parallel to the coating direction. The bulk of the film is only weakly aligned with the backbone oriented transverse to coating. At the mesoscale, we observe a well-defined fibril-like morphology at the top interface with the fibril long axis pointing toward the coating direction. Significantly smaller fibrils with poor orientational order are found on the bottom interface, weakly aligned orthogonal to the fibrils on the top interface. The high degree of alignment at the top interface leads to a charge transport anisotropy of up to 5.4 compared to an anisotropy close to 1 on the bottom interface. We attribute the formation of distinct interfacial morphology to the skin-layer formation associated with high Peclet number, which promotes crystallization on the top interface while suppressing it in the bulk. As a result, we further infer that the interfacial fibril alignment is driven by the extensional flow on the top interface arisen from increasing solvent evaporation rate closer to the meniscus front.

Diffusion phenomena of cells and biomolecules in microfluidic devices.

Science.gov (United States)

Yildiz-Ozturk, Ece; Yesil-Celiktas, Ozlem

2015-09-01

Biomicrofluidics is an emerging field at the cross roads of microfluidics and life sciences which requires intensive research efforts in terms of introducing appropriate designs, production techniques, and analysis. The ultimate goal is to deliver innovative and cost-effective microfluidic devices to biotech, biomedical, and pharmaceutical industries. Therefore, creating an in-depth understanding of the transport phenomena of cells and biomolecules becomes vital and concurrently poses significant challenges. The present article outlines the recent advancements in diffusion phenomena of cells and biomolecules by highlighting transport principles from an engineering perspective, cell responses in microfluidic devices with emphases on diffusion- and flow-based microfluidic gradient platforms, macroscopic and microscopic approaches for investigating the diffusion phenomena of biomolecules, microfluidic platforms for the delivery of these molecules, as well as the state of the art in biological applications of mammalian cell responses and diffusion of biomolecules.

Transport phenomena and kinetic theory applications to gases, semiconductors, photons, and biological systems

CERN Document Server

Gabetta, Ester

2007-01-01

The study of kinetic equations related to gases, semiconductors, photons, traffic flow, and other systems has developed rapidly in recent years because of its role as a mathematical tool in many applications in areas such as engineering, meteorology, biology, chemistry, materials science, nanotechnology, and pharmacy. Written by leading specialists in their respective fields, this book presents an overview of recent developments in the field of mathematical kinetic theory with a focus on modeling complex systems, emphasizing both mathematical properties and their physical meaning. The overall presentation covers not only modeling aspects and qualitative analysis of mathematical problems, but also inverse problems, which lead to a detailed assessment of models in connection with their applications, and to computational problems, which lead to an effective link of models to the analysis of real-world systems. "Transport Phenomena and Kinetic Theory" is an excellent self-study reference for graduate students, re...

Ab-initio calculations of the hydrogen-uranium system: Surface phenomena, absorption, transport and trapping

International Nuclear Information System (INIS)

Taylor, Christopher D.; Scott Lillard, R.

2009-01-01

Density functional theory was applied to the initial steps of uranium hydriding: surface phenomena, absorption, bulk transport and trapping. H adsorbs exothermically to the (0 0 1) surface, yet H absorption into the bulk is endothermic, with off-center octahedral absorption having the lowest absorption energy of 0.39 eV, relative to molecular H 2 . H absorption in interstitial sites causes a local softening of the bulk modulus. Diffusion of H in unstrained α-U has a barrier of 0.6 eV. The energy of H absorption adjacent to the chemical impurities C, S, Si was lowered by an amount proportional to the size of the impurity atom, and the resulting lattice strain Si > S > C. Thus, impurities may promote hydriding by providing surfaces or prestrained zones for H uptake.

Transport Phenomena in Nanowires, Nanotubes, and Other Low-Dimensional Systems

KAUST Repository

Montes, Enrique

2017-01-01

Nanoscale materials are not new in either nature or physics. However, the recent technological improvements have given scientists new tools to understand and quantify phenomena that occur naturally due to quantum confinement effects. In general, these phenomena induce remarkable optical, magnetic, and electronic properties in nanoscale materials in contrast to their bulk counterpart. In addition, scientists have recently developed the necessary tools to control and exploit these properties in electronic devices, in particular field effect transistors, magnetic memories, and gas sensors. In the present thesis we implement theoretical and computational tools for analyzing the ground state and electronic transport properties of nanoscale materials and their performance in electronic devices. The ground state properties are studied within density functional theory using the SIESTA code, whereas the transport properties are investigated using the non-equilibrium Green\\'s functions formalism implemented in the SMEAGOL code. First we study Si-based systems, as Si nanowires are believed to be important building blocks of the next generation of electronic devices. We derive the electron transport properties of Si nanowires connected to Au electrodes and their dependence on the nanowire growth direction, diameter, and length. At equilibrium Au-nanowire distance we find strong electronic coupling between electrodes and nanowire, resulting in low contact resistance. For the tunneling regime, the decay of the conductance with the nanowire length is rationalized using the complex band structure. The nanowires grown along the (110) direction show the smallest decay and the largest conductance and current. Due to the high spin coherence in Si, Si nanowires represent an interesting platform for spin devices. Therefore, we built a magnetic tunneling junction by connecting a (110) Si nanowire to ferromagnetic Fe electrodes. We have find a substantial low bias magnetoresistance of

A molecular dynamics study of thermal transport in nanoparticle doped Argon like solid

Energy Technology Data Exchange (ETDEWEB)

Shahadat, Muhammad Rubayat Bin, E-mail: rubayat37@gmail.com; Ahmed, Shafkat; Morshed, A. K. M. M. [Department of Mechanical Engineering Bangladesh University of Engineering and Technology (BUET) Dhaka (Bangladesh)

2016-07-12

Interfacial phenomena such as mass and type of the interstitial atom, nano scale material defect influence heat transfer and the effect become very significant with the reduction of the material size. Non Equilibrium Molecular Dynamics (NEMD) simulation was carried out in this study to investigate the effect of the interfacial phenomena on solid. Argon like solid was considered in this study and LJ potential was used for atomic interaction. Nanoparticles of different masses and different molecular defects were inserted inside the solid. From the molecular simulation, it was observed that a large interfacial mismatch due to change in mass in the homogenous solid causes distortion of the phonon frequency causing increase in thermal resistance. Position of the doped nanoparticles have more profound effect on the thermal conductivity of the solid whereas influence of the mass ratio is not very significant. Interstitial atom positioned perpendicular to the heat flow causes sharp reduction in thermal conductivity. Structural defect caused by the molecular defect (void) also observed to significantly affect the thermal conductivity of the solid.

Advances in transport phenomena 2011

CERN Document Server

2014-01-01

This new volume of the annual review “Advances in Transport Phenomena” series contains three in-depth review articles on the microfluidic fabrication of vesicles, the dielectrophoresis field-flow fractionation for continuous-flow separation of particles and cells in microfluidic devices, and the thermodynamic analysis and optimization of heat exchangers, respectively.

Interfacial forces in aqueous media

CERN Document Server

van Oss, Carel J

2006-01-01

Thoroughly revised and reorganized, the second edition of Interfacial Forces in Aqueous Media examines the role of polar interfacial and noncovalent interactions among biological and nonbiological macromolecules as well as biopolymers, particles, surfaces, cells, and both polar and apolar polymers. The book encompasses Lifshitz-van der Waals and electrical double layer interactions, as well as Lewis acid-base interactions between colloidal entities in polar liquids such as water. New in this Edition: Four previously unpublished chapters comprising a new section on interfacial propertie

Thermal transport across solid-solid interfaces enhanced by pre-interface isotope-phonon scattering

Science.gov (United States)

Lee, Eungkyu; Luo, Tengfei

2018-01-01

Thermal transport across solid interfaces can play critical roles in the thermal management of electronics. In this letter, we use non-equilibrium molecular dynamics simulations to investigate the isotope effect on the thermal transport across SiC/GaN interfaces. It is found that engineered isotopes (e.g., 10% 15N or 71Ga) in the GaN layer can increase the interfacial thermal conductance compared to the isotopically pure case by as much as 23%. Different isotope doping features, such as the isotope concentration, skin depth of the isotope region, and its distance from the interface, are investigated, and all of them lead to increases in thermal conductance. Studies of spectral temperatures of phonon modes indicate that interfacial thermal transport due to low-frequency phonons (transport. This work may provide insights into interfacial thermal transport and useful guidance to practical material design.

Dentin-cement Interfacial Interaction

Science.gov (United States)

Atmeh, A.R.; Chong, E.Z.; Richard, G.; Festy, F.; Watson, T.F.

2012-01-01

The interfacial properties of a new calcium-silicate-based coronal restorative material (Biodentine™) and a glass-ionomer cement (GIC) with dentin have been studied by confocal laser scanning microscopy (CLSM), scanning electron microscopy (SEM), micro-Raman spectroscopy, and two-photon auto-fluorescence and second-harmonic-generation (SHG) imaging. Results indicate the formation of tag-like structures alongside an interfacial layer called the “mineral infiltration zone”, where the alkaline caustic effect of the calcium silicate cement’s hydration products degrades the collagenous component of the interfacial dentin. This degradation leads to the formation of a porous structure which facilitates the permeation of high concentrations of Ca2+, OH-, and CO32- ions, leading to increased mineralization in this region. Comparison of the dentin-restorative interfaces shows that there is a dentin-mineral infiltration with the Biodentine, whereas polyacrylic and tartaric acids and their salts characterize the penetration of the GIC. A new type of interfacial interaction, “the mineral infiltration zone”, is suggested for these calcium-silicate-based cements. PMID:22436906

Crystalline Molybdenum Oxide Thin-Films for Application as Interfacial Layers in Optoelectronic Devices

DEFF Research Database (Denmark)

Fernandes Cauduro, André Luis; dos Reis, Roberto; Chen, Gong

2017-01-01

The ability to control the interfacial properties in metal-oxide thin films through surface defect engineering is vital to fine-tune their optoelectronic properties and thus their integration in novel optoelectronic devices. This is exemplified in photovoltaic devices based on organic, inorganic...... or hybrid technologies, where precise control of the charge transport properties through the interfacial layer is highly important for improving device performance. In this work, we study the effects of in situ annealing in nearly stoichiometric MoOx (x ∼ 3.0) thin-films deposited by reactive sputtering. We...... with structural characterizations, this work addresses a novel method for tuning, and correlating, the optoelectronic properties and microstructure of device-relevant MoOx layers....

Interfacial chemistry in solvent extraction systems: Progress report for period April 1, 1986-March 31, 1987

International Nuclear Information System (INIS)

Neuman, R.D.

1986-11-01

Proton magnetic resonance spectroscopic, vapor pressure osmometric and Karl Fischer titrimetric measurements have provided support for our earlier findings obtained from interfacial tension and mass transfer experiments that reversed micelles are formed, under certain conditions, in the system HDEHP/n-hexane/CaCl 2 solution. These studies were further extended to include different organophosphorus acid (PC 88A), diluent (benzene), and metal ions (Co 2+ , Ni 2+ , and Zn 2+ ) to determine whether reversed micellization is a general phenomenon occurring in solvent extraction systems which employ organophosphorus acids. The data obtained so far, suggest that reversed micellization indeed is a general phenomenon operative in organophosphorus acid extractant systems. A new mass transfer cell has been constructed in order to investigate the metal distribution equilibria and extraction kinetics of Co, Ni and Zn using atomic absorption spectrophotometric technique. A quasi-elastic light-scattering apparatus has been installed to investigate aggregation phenomena in solvent extraction systems. Preliminary drop-interface coalescence studies were performed, and the results were correlated with those obtained from interfacial tension measurements. The laser heterodyne light-scattering apparatus for measurement of interfacial viscoelastic properties also has been set-up and is being optimized for high resolution measurements. 21 refs., 16 figs

Manipulation and control of the interfacial polarization in organic light-emitting diodes by dipolar doping

Directory of Open Access Journals (Sweden)

Lars Jäger

2016-09-01

Full Text Available Most of the commonly used electron transporting materials in organic light-emitting diodes exhibit interfacial polarization resulting from partially aligned permanent dipole moments of the molecules. This property modifies the internal electric field distribution of the device and therefore enables an earlier flat band condition for the hole transporting side, leading to improved charge carrier injection. Recently, this phenomenon was studied with regard to different materials and degradation effects, however, so far the influence of dilution has not been investigated. In this paper we focus on dipolar doping of the hole transporting material 4,4-bis[N-(1-naphthyl-N-phenylamino]-biphenyl (NPB with the polar electron transporting material tris-(8-hydroxyquinolate aluminum (Alq3. Impedance spectroscopy reveals that changes of the hole injection voltage do not scale in a simple linear fashion with the effective thickness of the doped layer. In fact, the measured interfacial polarization reaches a maximum value for a 1:1 blend. Taking the permanent dipole moment of Alq3 into account, an increasing degree of dipole alignment is found for decreasing Alq3 concentration. This observation can be explained by the competition between dipole-dipole interactions leading to dimerization and the driving force for vertical orientation of Alq3 dipoles at the surface of the NPB layer.

Manipulation and control of the interfacial polarization in organic light-emitting diodes by dipolar doping

Science.gov (United States)

Jäger, Lars; Schmidt, Tobias D.; Brütting, Wolfgang

2016-09-01

Most of the commonly used electron transporting materials in organic light-emitting diodes exhibit interfacial polarization resulting from partially aligned permanent dipole moments of the molecules. This property modifies the internal electric field distribution of the device and therefore enables an earlier flat band condition for the hole transporting side, leading to improved charge carrier injection. Recently, this phenomenon was studied with regard to different materials and degradation effects, however, so far the influence of dilution has not been investigated. In this paper we focus on dipolar doping of the hole transporting material 4,4-bis[N-(1-naphthyl)-N-phenylamino]-biphenyl (NPB) with the polar electron transporting material tris-(8-hydroxyquinolate) aluminum (Alq3). Impedance spectroscopy reveals that changes of the hole injection voltage do not scale in a simple linear fashion with the effective thickness of the doped layer. In fact, the measured interfacial polarization reaches a maximum value for a 1:1 blend. Taking the permanent dipole moment of Alq3 into account, an increasing degree of dipole alignment is found for decreasing Alq3 concentration. This observation can be explained by the competition between dipole-dipole interactions leading to dimerization and the driving force for vertical orientation of Alq3 dipoles at the surface of the NPB layer.

Electrochemically modulated liquid chromatography: Theoretical investigations and applications from the perspectives of chromatography and interfacial electrochemistry

Energy Technology Data Exchange (ETDEWEB)

Keller, David W. [Iowa State Univ., Ames, IA (United States)

2005-01-01

Electrochemically modulated liquid chromatography (EMLC) employs a conductive material as both a stationary phase for chromatographic separations and as a working electrode for performing electrochemistry experiments. This dual functionality gives EMLC the capacity to manipulate chromatographic separations by changing the potential applied (E_app) to the stationary phase with respect to an external reference. The ability to monitor retention as a function of E_app provides a means to chromatographically monitor electrosorption processes at solid-liquid interfaces. In this dissertation, the retention mechanism for EMLC is examined from the perspective of electrical double layer theory and interfacial thermodynamics. From the chromatographic data, it is possible to determine the interfacial excess (Λ) of a solute and changes in interfacial tension (dγ) as a function of both E_app and the supporting electrolyte concentration. Taken together, these two experimentally manipulated parameters can be examined within the context of the Gibbs adsorption equation to delineate the contribution of a variety of interfacial properties, including the charge of solute on the stationary phase and the potential of zero charge (PZC), to the mechanism behind EMLC-based retention. The chromatographic probing of interfacial phenomena is complemented by electroanalytical experiments that exploit the ability to monitor the electronic current flowing through an EMLC column. Cyclic voltammetry and chronoamperometry of an EMLC column are used to determine the electronic performance characteristics of an EMLC column. An electrochemical flow injection analysis of a column is provided in which the current required to maintain a constant E_app is monitored and provides a way to examine the influence that acetonitrile and supporting electrolyte composition, flow rate, column backpressure, and ionic strength have on the structure of electrified interfaces.

Single-Molecule Interfacial Electron Transfer

Energy Technology Data Exchange (ETDEWEB)

Lu, H. Peter [Bowling Green State Univ., Bowling Green, OH (United States). Dept. of Chemistry and Center for Photochemical Sciences

2017-11-28

This project is focused on the use of single-molecule high spatial and temporal resolved techniques to study molecular dynamics in condensed phase and at interfaces, especially, the complex reaction dynamics associated with electron and energy transfer rate processes. The complexity and inhomogeneity of the interfacial ET dynamics often present a major challenge for a molecular level comprehension of the intrinsically complex systems, which calls for both higher spatial and temporal resolutions at ultimate single-molecule and single-particle sensitivities. Combined single-molecule spectroscopy and electrochemical atomic force microscopy approaches are unique for heterogeneous and complex interfacial electron transfer systems because the static and dynamic inhomogeneities can be identified and characterized by studying one molecule at a specific nanoscale surface site at a time. The goal of our project is to integrate and apply these spectroscopic imaging and topographic scanning techniques to measure the energy flow and electron flow between molecules and substrate surfaces as a function of surface site geometry and molecular structure. We have been primarily focusing on studying interfacial electron transfer under ambient condition and electrolyte solution involving both single crystal and colloidal TiO₂ and related substrates. The resulting molecular level understanding of the fundamental interfacial electron transfer processes will be important for developing efficient light harvesting systems and broadly applicable to problems in fundamental chemistry and physics. We have made significant advancement on deciphering the underlying mechanism of the complex and inhomogeneous interfacial electron transfer dynamics in dyesensitized TiO₂ nanoparticle systems that strongly involves with and regulated by molecule-surface interactions. We have studied interfacial electron transfer on TiO₂ nanoparticle surfaces by using ultrafast single

Interfacial heat transfer - State of the art

International Nuclear Information System (INIS)

Yadigaroglu, G.

1987-01-01

Interfacial heat exchanges control the interfacial mass exchange rate, depend on the interfacial area, and are tied to the prediction of thermal nonequilibrium. The nature of the problem usually requires the formulation of mechanistic laws and precludes the general use of universal correlations. This is partly due to the fact that the length scale controlling the interfacial exchanges varies widely from one situation to another and has a strong influence on the exchange coefficients. Within the framework of the ''two-fluid models'', the exchanges occurring at the interfaces are explicitly taken into consideration by the jump condition linking the volumetric mass exchange (evaporation) rate between the phases, to the interfacial energy transfer rates

Interfacial and Surface Science | Materials Science | NREL

Science.gov (United States)

Science group within the Material Science Center. He oversees research studies of surfaces and interfaces Interfacial and Surface Science Interfacial and Surface Science Image of irregular-outlined, light address a broad range of fundamental and applied issues in surface and interfacial science that are

Two-Dimensional Layered Oxide Structures Tailored by Self-Assembled Layer Stacking via Interfacial Strain.

Science.gov (United States)

Zhang, Wenrui; Li, Mingtao; Chen, Aiping; Li, Leigang; Zhu, Yuanyuan; Xia, Zhenhai; Lu, Ping; Boullay, Philippe; Wu, Lijun; Zhu, Yimei; MacManus-Driscoll, Judith L; Jia, Quanxi; Zhou, Honghui; Narayan, Jagdish; Zhang, Xinghang; Wang, Haiyan

2016-07-06

Study of layered complex oxides emerge as one of leading topics in fundamental materials science because of the strong interplay among intrinsic charge, spin, orbital, and lattice. As a fundamental basis of heteroepitaxial thin film growth, interfacial strain can be used to design materials that exhibit new phenomena beyond their conventional forms. Here, we report a strain-driven self-assembly of bismuth-based supercell (SC) with a two-dimensional (2D) layered structure. With combined experimental analysis and first-principles calculations, we investigated the full SC structure and elucidated the fundamental growth mechanism achieved by the strain-enabled self-assembled atomic layer stacking. The unique SC structure exhibits room-temperature ferroelectricity, enhanced magnetic responses, and a distinct optical bandgap from the conventional double perovskite structure. This study reveals the important role of interfacial strain modulation and atomic rearrangement in self-assembling a layered singe-phase multiferroic thin film, which opens up a promising avenue in the search for and design of novel 2D layered complex oxides with enormous promise.

Interplay of interfacial noise and curvature-driven dynamics in two dimensions

Science.gov (United States)

Roy, Parna; Sen, Parongama

2017-02-01

We explore the effect of interplay of interfacial noise and curvature-driven dynamics in a binary spin system. An appropriate model is the generalized two-dimensional voter model proposed earlier [M. J. de Oliveira, J. F. F. Mendes, and M. A. Santos, J. Phys. A: Math. Gen. 26, 2317 (1993), 10.1088/0305-4470/26/10/006], where the flipping probability of a spin depends on the state of its neighbors and is given in terms of two parameters, x and y . x =0.5 andy =1 correspond to the conventional voter model which is purely interfacial noise driven, while x =1 and y =1 correspond to the Ising model, where coarsening is fully curvature driven. The coarsening phenomena for 0.5 x y =1 is studied in detail. The dynamical behavior of the relevant quantities show characteristic differences from both x =0.5 and 1. The most remarkable result is the existence of two time scales for x ≥xc where xc≈0.7 . On the other hand, we have studied the exit probability which shows Ising-like behavior with a universal exponent for any value of x >0.5 ; the effect of x appears in altering the value of the parameter occurring in the scaling function only.

Geochemical modelling: what phenomena are missing

International Nuclear Information System (INIS)

Jacquier, P.

1989-12-01

In the framework of safety assessment of radioactive waste disposal, retention phenomena are usually taken into account by the Kd concept. It is well recognized that this concept is not enough for safety assessment models, because of the several and strong assumptions which are involved in this kind of representation. One way to have a better representation of the retention phenomena, is to substitute for this Kd concept an explicit description of geochemical phenomena and then couple transport codes with geochemical codes in a fully or a two-step procedure. We use currently such codes, but the scope of this paper is to display the limits today of the geochemical modelling in connection with sites analysis for deep disposal. In this paper, we intend to give an overview of phenomena which are missing in the geochemical models, or which are not completely introduced in the models. We can distinguish, on one hand phenomena for which modelling concepts exist such as adsorption/desorption and, on the other hand, phenomena for which modelling concepts do not exist for the moment such as colloids, and complexation by polyelectrolyte solutions (organics). Moreover we have to take care of very low concentrations of radionuclides, which can be expected from the leaching processes in the repository. Under those conditions, some reactions may not occur. After a critical review of the involved phenomena, we intend to stress the main directions of the wishful evolution of the geochemical modelling. This evolution should improve substantially the quality of the above-mentioned site assessments

Interfacial spin-orbit splitting and current-driven spin torque in anisotropic tunnel junctions

KAUST Repository

Manchon, Aurelien

2011-05-17

Spin transport in magnetic tunnel junctions comprising a single magnetic layer in the presence of interfacial spin-orbit interaction (SOI) is investigated theoretically. Due to the presence of interfacial SOI, a current-driven spin torque can be generated at the second order in SOI, even in the absence of an external spin polarizer. This torque possesses two components, one in plane and one perpendicular to the plane of rotation, that can induce either current-driven magnetization switching from an in-plane to out-of-plane configuration or magnetization precessions, similar to spin transfer torque in spin valves. Consequently, it appears that it is possible to control the magnetization steady state and dynamics by either varying the bias voltage or electrically modifying the SOI at the interface.

Modelling of near-field radionuclide transport phenomena in a KBS-3V type of repository for nuclear waste with Goldsim Code - and verification against previous methods

International Nuclear Information System (INIS)

Pulkkanen, V.-M.; Nordman, H.

2010-03-01

Traditional radionuclide transport models overestimate significantly some phenomena, or completely ignore them. This motivates the development of new more precise models. As a result, this work is a description of commissioning of a new KBS-3V near-field radionuclide transport model, which has been done with a commercial software called GoldSim. According to earlier models, GoldSim model uses rz coordinates, but the solubilities of radionuclides have been treated more precisely. To begin with, the physical phenomena concerning near-field transport have been introduced according to GoldSim way of thinking. Also, the computational methods of GoldSim have been introduced and compared to methods used earlier. The actual verification of GoldSim model has been carried out by comparing the GoldSim results from simple cases to the corresponding results obtained with REPCOM, a software developed by VTT and used in several safety assessments. The results agree well. Finally, a few complicated cases were studied. In these cases, the REPCOM's limitations in handling of some phenomena become evident. The differences in the results are caused especially by the extension of the solubility limit to the whole computational domain, and the element-wise treatment of the solubilities which was used instead of nuclide-wise treatment. This work has been carried out as a special assignment to the former laboratory of Advanced Energy Systems in Helsinki University of Technology. The work was done at VTT. (orig.)

The effects of interfacial recombination and injection barrier on the electrical characteristics of perovskite solar cells

Directory of Open Access Journals (Sweden)

Lin Xing Shi

2018-02-01

Full Text Available Charge carrier recombination in the perovskite solar cells (PSCs has a deep influence on the electrical performance, such as open circuit voltage, short circuit current, fill factor and ultimately power conversion efficiency. The impacts of injection barrier, recombination channels, doping properties of carrier transport layers and light intensity on the performance of PSCs are theoretically investigated by drift-diffusion model in this work. The results indicate that due to the injection barrier at the interfaces of perovskite and carrier transport layer, the accumulated carriers modify the electric field distribution throughout the PSCs. Thus, a zero electric field is generated at a specific applied voltage, with greatly increases the interfacial recombination, resulting in a local kink of current density-voltage (J-V curve. This work provides an effective strategy to improve the efficiency of PSCs by pertinently reducing both the injection barrier and interfacial recombination.

Interfacial scattering effect on anisotropic magnetoresistance and anomalous Hall effect in Ta/Fe multilayers

KAUST Repository

Zhang, Qiang

2017-12-26

The effect of interfacial scattering on anisotropic magnetoresistance (AMR) and anomalous Hall effect (AHE) was studied in the (Ta12n/Fe36n)n multilayers, where the numbers give the thickness in nanometer and n is an integer from 1 to 12. The multilayer structure has been confirmed by the XRR spectra and STEM images of cross-sections. The magneto-transport properties were measured by four-point probe method in Hall bar shaped samples in the temperature range of 5 - 300 K. The AMR increases with n, which could be ascribed to the interfacial spin-orbit scattering. At 5 K, the longitudinal resistivity (ρ) increases by 6.4 times and the anomalous Hall resistivity (ρ) increases by 49.4 times from n =1 to n =12, indicative of the interfacial scattering effect. The skew-scattering, side-jump and intrinsic contributions to the AHE were separated successfully. As n increases from 1 to 12, the intrinsic contribution decreases because of the decaying crystallinity or finite size effect and the intrinsic contribution dominated the AHE for all samples. The side jump changes from negative to positive because the interfacial scattering and intralayer scattering in Fe layers both contribute to side jump in the AHE but with opposite sign.

Generalized transport model for phase transition with memory

International Nuclear Information System (INIS)

Chen, Chi; Ciucci, Francesco

2013-01-01

A general model for phenomenological transport in phase transition is derived, which extends Jäckle and Frisch model of phase transition with memory and the Cahn–Hilliard model. In addition to including interfacial energy to account for the presence of interfaces, we introduce viscosity and relaxation contributions, which result from incorporating memory effect into the driving potential. Our simulation results show that even without interfacial energy term, the viscous term can lead to transient diffuse interfaces. From the phase transition induced hysteresis, we discover different energy dissipation mechanism for the interfacial energy and the viscosity effect. In addition, by combining viscosity and interfacial energy, we find that if the former dominates, then the concentration difference across the phase boundary is reduced; conversely, if the interfacial energy is greater then this difference is enlarged.

Predictive modelling of edge transport phenomena in ELMy H-mode tokamak fusion plasmas

International Nuclear Information System (INIS)

Loennroth, J.-S.

2009-01-01

This thesis discusses a range of work dealing with edge plasma transport in magnetically confined fusion plasmas by means of predictive transport modelling, a technique in which qualitative predictions and explanations are sought by running transport codes equipped with models for plasma transport and other relevant phenomena. The focus is on high confinement mode (H-mode) tokamak plasmas, which feature improved performance thanks to the formation of an edge transport barrier. H-mode plasmas are generally characterized by the occurrence of edge localized modes (ELMs), periodic eruptions of particles and energy, which limit confinement and may turn out to be seriously damaging in future tokamaks. The thesis introduces schemes and models for qualitative study of the ELM phenomenon in predictive transport modelling. It aims to shed new light on the dynamics of ELMs using these models. It tries to explain various experimental observations related to the performance and ELM-behaviour of H-mode plasmas. Finally, it also tries to establish more generally the potential effects of ripple-induced thermal ion losses on H-mode plasma performance and ELMs. It is demonstrated that the proposed ELM modelling schemes can qualitatively reproduce the experimental dynamics of a number of ELM regimes. Using a theory-motivated ELM model based on a linear instability model, the dynamics of combined ballooning-peeling mode ELMs is studied. It is shown that the ELMs are most often triggered by a ballooning mode instability, which renders the plasma peeling mode unstable, causing the ELM to continue in a peeling mode phase. Understanding the dynamics of ELMs will be a key issue when it comes to controlling and mitigating the ELMs in future large tokamaks. By means of integrated modelling, it is shown that an experimentally observed increase in the ELM frequency and deterioration of plasma confinement triggered by external neutral gas puffing might be due to a transition from the second to

Interfacial electronic charge transfer and density of states in short period Cu/Cr multilayers; TOPICAL

International Nuclear Information System (INIS)

Barbee, T W; Bello, A F; Klepeis, J E; Van Buuren, T

1999-01-01

Nanometer period metallic multilayers are ideal structures to investigate electronic phenomena at interfaces between metal films since interfacial atoms comprise a large atomic fraction of the samples. The Cu/Cr binary pair is especially suited to study the interfaces in metals since these elements are mutually insoluble, thus eliminating mixing effects and compound formation and the lattice mismatch is very small. This allows the fabrication of high structural quality Cu/Cr multilayers that have a structure which can be approximated in calculations based on idealized atomic arrangements. The electronic structure of the Cu and the Cr layers in several samples of thin Cu/Cr multilayers were studied using x-ray absorption spectroscopy (XAS). Total electron yield was measured and used to study the white lines at the Cu L(sub 2) and L(sub 3) absorption edges. The white lines at the Cu absorption edges are strongly related to the unoccupied d-orbitals and are used to calculate the amount of charge transfer between the Cr and Cu atoms in interfaces. Analysis of the Cu white lines show a charge transfer of 0.026 electrons/interfacial Cu atom to the interfacial Cr atoms. In the Cu XAS spectra we also observe a van Hove singularity between the L(sub 2) and L(sub 3) absorption edges as expected from the structural analysis. The absorption spectra are compared to partial density of states obtained from a full-potential linear muffin-tin orbital calculation. The calculations support the presence of charge transfer and indicate that it is localized to the first two interfacial layers in both Cu and Cr

The Interfacial Transition Zone in Alkali-Activated Slag Mortars

Directory of Open Access Journals (Sweden)

Rackel eSan Nicolas

2015-12-01

Full Text Available The interfacial transition zone (ITZ is known to strongly influence the mechanical and transport properties of mortars and concretes. This paper studies the ITZ between siliceous (quartz aggregates and alkali activated slag binders in the context of mortar specimens. Backscattered electron images (BSE generated in an environmental scanning electron microscope (ESEM are used to identify unreacted binder components, reaction products and porosity in the zone surrounding aggregate particles, by composition and density contrast. X-ray mapping is used to exclude the regions corresponding to the aggregates from the BSE image of the ITZ, thus enabling analysis of only the binder phases, which are segmented into binary images by grey level discrimination. A distinct yet dense ITZ region is present in the alkali-activated slag mortars, containing a reduced content of unreacted slag particles compared to the bulk binder. The elemental analysis of this region shows that it contains a (C,N-A-S-H gel which seems to have a higher content of Na (potentially deposited through desiccation of the pore solution and a lower content of Ca than the bulk inner and outer products forming in the main binding region. These differences are potentially important in terms of long-term concrete performance, as the absence of a highly porous interfacial transition zone region is expected to provide a positive influence on the mechanical and transport properties of alkali-activated slag concretes.

Interfacial Engineering and Charge Carrier Dynamics in Extremely Thin Absorber Solar Cells

Science.gov (United States)

Edley, Michael

Photovoltaic energy is a clean and renewable source of electricity; however, it faces resistance to widespread use due to cost. Nanostructuring decouples constraints related to light absorption and charge separation, potentially reducing cost by allowing a wider variety of processing techniques and materials to be used. However, the large interfacial areas also cause an increased dark current which negatively affects cell efficiency. This work focuses on extremely thin absorber (ETA) solar cells that used a ZnO nanowire array as a scaffold for an extremely thin CdSe absorber layer. Photoexcited electrons generated in the CdSe absorber are transferred to the ZnO layer, while photogenerated holes are transferred to the liquid electrolyte. The transfer of photoexcited carriers to their transport layer competes with bulk recombination in the absorber layer. After charge separation, transport of charge carriers to their respective contacts must occur faster than interfacial recombination for efficient collection. Charge separation and collection depend sensitively on the dimensions of the materials as well as their interfaces. We demonstrated that an optimal absorber thickness can balance light absorption and charge separation. By treating the ZnO/CdSe interface with a CdS buffer layer, we were able to improve the Voc and fill factor, increasing the ETA cell's efficiency from 0.53% to 1.34%, which is higher than that achievable using planar films of the same material. We have gained additional insight into designing ETA cells through the use of dynamic measurements. Ultrafast transient absorption spectroscopy revealed that characteristic times for electron injection from CdSe to ZnO are less than 1 ps. Electron injection is rapid compared to the 2 ns bulk lifetime in CdSe. Optoelectronic measurements such as transient photocurrent/photovoltage and electrochemical impedance spectroscopy were applied to study the processes of charge transport and interfacial recombination

Interfacial Instabilities in Evaporating Drops

Science.gov (United States)

Moffat, Ross; Sefiane, Khellil; Matar, Omar

2007-11-01

We study the effect of substrate thermal properties on the evaporation of sessile drops of various liquids. An infra-red imaging technique was used to record the interfacial temperature. This technique illustrates the non-uniformity in interfacial temperature distribution that characterises the evaporation process. Our results also demonstrate that the evaporation of methanol droplets is accompanied by the formation of wave-trains in the interfacial temperature field; similar patterns, however, were not observed in the case of water droplets. More complex patterns are observed for FC-72 refrigerant drops. The effect of substrate thermal conductivity on the structure of the complex pattern formation is also elucidated.

Peculiarities of the radioactive particles transport phenomena in the facilitated diffusion processes

International Nuclear Information System (INIS)

Gavryushenko, D.A.; Sisojev, V.M.; Cherevko, K.V.; Vlasenko, T.S.

2017-01-01

The work is devoted to the up to date problem that is the description of the radioactive particle diffusion processes. One of the aims of the present study is to estimate the effects caused by the irradiation of the liquid systems on the ongoing transport processes. That can allow predicting the behavior of the liquid systems in the presence of the radioactive sources. The main objective of the present work is studying the radioactive particles diffusion phenomena with the possible facilitated diffusion processes being considered. The phenomena are studied based on the fundamental relations of the nonequilibrium statistical thermodynamics. The diffusive flows are evaluated with the special attention given to the accounting of the entropy effects due to the appearance of the new radioactive particles in the system. The developed approach is used to estimate the diffusive flow of the radioactive particles for the case of the plane-parallel pore with the semi-transparent walls. The choice of a model can be justified as it might be used to describe the production of the radioactive contaminated water when the radionuclide face the diffusion process after being washed from the radioactive wastes and the rests of the nuclear fuel. Within the suggested model it is shown that the diffusion coefficient depends on the structural properties of the liquid systems that might be changed under the influence of the irradiation. The obtained equations for calculating the diffusive flows show the definite stabilizing effect in respect to the concentration difference in between the boundaries of the plane-parallel pore. It leads to the decreased changes of the diffusive flow when the concentrations of the radioactive particles at the boundaries are changed in comparison with those observed for the constant diffusion coefficient. The observed behavior for the ideal solution model is explained by the entropy effects. The qualitative analysis of the possible influence of the changes in

Effect of Atmospheric Ions on Interfacial Water

Directory of Open Access Journals (Sweden)

Chien-Chang Kurt Kung

2014-11-01

Full Text Available The effect of atmospheric positivity on the electrical properties of interfacial water was explored. Interfacial, or exclusion zone (EZ water was created in the standard way, next to a sheet of Nafion placed horizontally at the bottom of a water-filled chamber. Positive atmospheric ions were created from a high voltage source placed above the chamber. Electrical potential distribution in the interfacial water was measured using microelectrodes. We found that beyond a threshold, the positive ions diminished the magnitude of the negative electrical potential in the interfacial water, sometimes even turning it to positive. Additionally, positive ions produced by an air conditioner were observed to generate similar effects; i.e., the electrical potential shifted in the positive direction but returned to negative when the air conditioner stopped blowing. Sometimes, the effect of the positive ions from the air conditioner was strong enough to destroy the structure of interfacial water by turning the potential decidedly positive. Thus, positive air ions can compromise interfacial water negativity and may explain the known negative impact of positive ions on health.

Probabilistic finite-size transport models for fusion: Anomalous transport and scaling laws

International Nuclear Information System (INIS)

Milligen, B.Ph. van; Sanchez, R.; Carreras, B.A.

2004-01-01

Transport in fusion plasmas in the low confinement mode is characterized by several remarkable properties: the anomalous scaling of transport with system size, stiff (or 'canonical') profiles, power degradation, and rapid transport phenomena. The present article explores the possibilities of constructing a unified transport model, based on the continuous-time random walk, in which all these phenomena are handled adequately. The resulting formalism appears to be sufficiently general to provide a sound starting point for the development of a full-blown plasma transport code, capable of incorporating the relevant microscopic transport mechanisms, and allowing predictions of confinement properties

Individual and collective motions: transport phenomena

International Nuclear Information System (INIS)

Richert, J.

The present lectures deal with the description of deep inelastic heavy ion reaction mechanism by means of transport concepts which were developed in statistical mechanics. The applicability of those concepts is analysed in terms of a hierarchy of characteristic times. The specificity of this time scale in the heavy ion framework is underlined. The derivation of transport coefficients out of the full dynamical formulation of the problem is shown through a random matrix model. The mechanism of mass and charge transfer between the ions as well as the generation of intrinsic angular momenta in the interacting fragments is formulated, quantitatively worked out and compared to some experimental results by using phenomenological approaches. Weak points of the theoretical approaches and disagreement between phenomenological models and experimental data are discussed. Open problems and unsolved questions are sketched in the final conclusions [fr

Molecular dynamics study on heat transport from single-walled carbon nanotubes to Si substrate

Energy Technology Data Exchange (ETDEWEB)

Feng, Ya; Zhu, Jie, E-mail: zhujie@iet.cn; Tang, Da-Wei

2015-02-06

In this paper, non-equilibrium molecular dynamics simulations were performed to investigate the heat transport between a vertically aligned single-walled carbon nanotube (SWNT) and Si substrate, to find out the influence of temperature and system sizes, including diameter and length of SWNT and measurements of substrate. Results revealed that high temperature hindered heat transport in SWNT itself but was a beneficial stimulus for heat transport at interface of SWNT and Si. Furthermore, the system sizes strongly affected the peaks in vibrational density of states of Si, which led to interfacial thermal conductance dependent on system sizes. - Highlights: • NEMD is performed to simulate the heat transport from SWNT to Si substrate. • We analyze both interfacial thermal conductance and thermal conductivity of SWNT. • High temperature is a beneficial stimulus for heat transport at the interface. • Interfacial thermal conductance strongly depends on the sizes of SWNT and substrate. • We calculate VDOS of C and Si atoms to analyze phonon couplings between them.

Interfacial binding of cutinase rather than its catalytic activity determines the steady state interfacial tension during oil drop lipid hydrolysis.

Science.gov (United States)

Flipsen, J A; van Schaick, M A; Dijkman, R; van der Hijden, H T; Verheij, H M; Egmond, M R

1999-02-01

Hydrolysis of triglycerides by cutinase from Fusarium solani pisi causes in oil drop tensiometer experiments a decrease of the interfacial tension. A series of cutinase variants with amino acid substitutions at its molecular surface yielded different values of the steady state interfacial tension. This tension value poorly correlated with the specific activity as such nor with the total activity (defined as the specific activity multiplied by the amount of enzyme bound) of the cutinase variants. Moreover, it appeared that at activity levels above 15% of that of wild type cutinase the contribution of hydrolysis to the decrease of the tension is saturating. A clear positive correlation was found between the interfacial tension plateau value and the interfacial binding of cutinase, as determined with attenuated total reflection Fourier transformed infrared spectroscopy (ATR-FTIR). These results indicate that the interfacial steady state level is not determined by the rate of hydrolysis, but mainly by the interfacial binding of cutinase.

Characterization of transport phenomena in porous transport layers using X-ray microtomography

Science.gov (United States)

Hasanpour, S.; Hoorfar, M.; Phillion, A. B.

2017-06-01

Among different methods available for estimating the transport properties of porous transport layers (PTLs) of polymer electrolyte membrane fuel cells, X-ray micro computed tomography (X-μCT) imaging in combination with image-based numerical simulation has been recognized as a viable tool. In this study, four commercially-available single-layer and dual-layer PTLs are analyzed using this method in order to compare and contrast transport properties between different PTLs, as well as the variability within a single sheet. Complete transport property datasets are created for each PTL. The simulation predictions indicate that PTLs with high porosity show considerable variability in permeability and effective diffusivity, while PTLs with low porosity do not. Furthermore, it is seen that the Tomadakis-Sotirchos (TS) analytical expressions for porous media match the image-based simulations when porosity is relatively low but predict higher permeability and effective diffusivity for porosity values greater than 80%. Finally, the simulations show that cracks within MPL of dual-layer PTLs have a significant effect on the overall permeability and effective diffusivity of the PTLs. This must be considered when estimating the transport properties of dual-layer PTLs. These findings can be used to improve macro-scale models of product and reactant transport within fuel cells, and ultimately, fuel cell efficiency.

Simulation of two-phase flows in vertical tubes with the CTFD code FLUBOX

International Nuclear Information System (INIS)

Graf, Udo; Papadimitriou, Pavlos

2007-01-01

The computational two-fluid dynamics (CTFD) code FLUBOX is developed at GRS for the multidimensional simulation of two-phase flows. The single-pressure two-fluid model is used as basis of the simulation. A basic mathematical property of the two-fluid model of FLUBOX is the hyperbolic character of the advection. The numerical solution methods of FLUBOX make explicit use of the hyperbolic structure of the coefficient matrices. The simulation of two-phase flow phenomena needs, apart from the conservation equations for each phase, an additional transport equation for the interfacial area concentration. The concentration of the interfacial area is one of the key parameters for the modeling of interfacial friction forces and interfacial transfer terms. A new transport equation for the interfacial area concentration is in development. It describes the dynamic change of the interfacial area concentration due to mass exchange and a force balance at the phase boundary. Results from FLUBOX calculations for different experiments of two-phase flows in vertical tubes are presented as part of the validation

Dynamics of water clusters confined in proteins: a molecular dynamics simulation study of interfacial waters in a dimeric hemoglobin.

Science.gov (United States)

Gnanasekaran, Ramachandran; Xu, Yao; Leitner, David M

2010-12-23

Water confined in proteins exhibits dynamics distinct from the dynamics of water in the bulk or near the surface of a biomolecule. We examine the water dynamics at the interface of the two globules of the homodimeric hemoglobin from Scapharca inaequivalvis (HbI) by molecular dynamics (MD) simulations, with focus on water-protein hydrogen bond lifetimes and rotational anisotropy of the interfacial waters. We find that relaxation of the waters at the interface of both deoxy- and oxy-HbI, which contain a cluster of 17 and 11 interfacial waters, respectively, is well described by stretched exponentials with exponents from 0.1 to 0.6 and relaxation times of tens to thousands of picoseconds. The interfacial water molecules of oxy-HbI exhibit slower rotational relaxation and hydrogen bond rearrangement than those of deoxy-HbI, consistent with an allosteric transition from unliganded to liganded conformers involving the expulsion of several water molecules from the interface. Though the interfacial waters are translationally and rotationally static on the picosecond time scale, they contribute to fast communication between the globules via vibrations. We find that the interfacial waters enhance vibrational energy transport across the interface by ≈10%.

Fast-ion transport during repetitive burst phenomena of toroidal Alfven eigenmodes in the Large Helical Device

International Nuclear Information System (INIS)

Nishiura, M.; Isobe, M.; Yamamoto, S.

2008-10-01

Alfven instabilities induced fast-ion losses have been directly observed for the first time by a newly developed scintillator lost ion probe (SLIP) in the Large Helical Device (LHD). The SLIP can measure the pitch angle and gyro radius of escaped fast ions toward loss region. Neutral beam driven Alfven Eigenmodes (AEs) are excited under the reactor relevant conditions: the ratio of fast ion (beam) speed υ b and Alfven speed υ A is more than 0.3 - 4.0. The beta value for fast ions is considered roughly to be ∼10%. Non-linear phenomena related to Alfven instabilities are observed under such conditions. During repetitive Toroidal Alfven Eigenmode (TAE) bursts, synchronized fast ion losses are observed by SLIP. From the orbit calculation the measured fast ion with pitch angle of 130 degrees and beam energy of 150 keV surely pass through the locations of TAE gaps. The orbit analysis found that the observed fast ions interact strongly with the excited TAEs. This result becomes the first experimental evidence of radial transport of fast ions predicted theoretically during TAE activities. In addition, from the correlation between stored energy degradation and fast-ion loss rate, it is found that fast-ion losses induced by TAE activities with low toroidal mode numbers categorize two phenomena without and with fast- ion loss enhancements, which indicate the fast-ion redistribution and loss. (author)

Interfacial reactions between titanium and borate glass

Energy Technology Data Exchange (ETDEWEB)

Brow, R.K. [Sandia National Labs., Albuquerque, NM (United States); Saha, S.K.; Goldstein, J.I. [Lehigh Univ., Bethlehem, PA (United States). Dept. of Materials Science

1992-12-31

Interfacial reactions between melts of several borate glasses and titanium have been investigated by analytical scanning electron microscopy (SEM) and x-ray photoelectron spectroscopy (XPS). A thin titanium boride interfacial layer is detected by XPS after short (30 minutes) thermal treatments. ASEM analyses after longer thermal treatments (8--120 hours) reveal boron-rich interfacial layers and boride precipitates in the Ti side of the interface.

Model of interfacial melting

DEFF Research Database (Denmark)

Mouritsen, Ole G.; Zuckermann, Martin J.

1987-01-01

A two-dimensional model is proposed to describe systems with phase transitions which take place in terms of crystalline as well as internal degrees of freedom. Computer simulation of the model shows that the interplay between the two sets of degrees of freedom permits observation of grain-boundar......-boundary formation and interfacial melting, a nonequilibrium process by which the system melts at the boundaries of a polycrystalline domain structure. Lipid membranes are candidates for systems with pronounced interfacial melting behavior....

Enhanced interfacial radiation-induced reaction for improving the interfacial adhesion of incompatible polymer blend PP/BR

International Nuclear Information System (INIS)

Liu Changhai; Yang Huili; Xu Jun

1995-01-01

γ-radiation induced interfacial changes of incompatible polymer isotactic polypropylene (PP) and cis1,4-polybutadiene (BR) blends containing polyfunctional monomer (PFM) triallyl isocyanurate (TAIC) were investigated. The results of the study are as following: PP is incompatible with BR; TAIC is hardly dissolved in both PP and BR; when blended with PP/BR, the concentration of TAIC in the interfacial region is higher than that in dispersion phase of BR or matrix of PP. The crosslinking and/or grafting of which TAIC occurred under radiation in the interfacial region anchored the dispersed BR phase to PP matrix. The interaction between adjacent phases is changed from sole van der Waals force to co-action of both chemical bond and molecular forces. Crosslinking between adjacent phases links the dispersed phase with PP matrix, and grafting in the boundary regions increases the thickness of interface. These result in a good interfacial adhesion between dispersed phase and matrix. (author)

Modelling of thermohydraulic emergency core cooling phenomena

International Nuclear Information System (INIS)

Yadigaroglu, G.; Andreani, M.; Lewis, M.J.

1990-10-01

The codes used in the early seventies for safety analysis and licensing were based either on the homogeneous model of two-phase flow or on the so-called separate-flow models, which are mixture models accounting, however, for the difference in average velocity between the two phases. In both cases the behavior of the mixture is prescribed a priori as a function of local parameters such as the mass flux and the quality. The modern best-estimate codes used for analyzing LWR LOCA's and transients are often based on a two-fluid or 6-equation formulation of the conservation equations. In this case the conservation equations are written separately for each phase; the mixture is allowed to evolve on its own, governed by the interfacial exchanges of mass, momentum and energy between the phases. It is generally agreed that such relatively sophisticated 6-equation formulations of two-phase flow are necessary for the correct modelling of a number of phenomena and situations arising in LWR accidental situations. They are in particular indispensible for the analysis of stratified or countercurrent flows and of situations in which large departures from thermal and velocity equilibrium exist. This report will be devoted to a discussion of the need for, the capacity and the limitations of the two-phase flow models (with emphasis on the 6-equation formulations) in modelling these two-phase flow and heat transfer phenomena and/or different core cooling situations. 18 figs., 1 tab., 72 refs

Study on the Mechanical and Interfacial Property of Injection Molded Fiber Reinforced Thermoplastics

OpenAIRE

王, 存涛

2014-01-01

Fiber reinforced polymer (FRP) composites have been used widely in the land transportation, aerospace, marine structures and characteristically conservative infrastructure construction industries and generally, the interface plays very important role in the properties of FRP materials. Therefore, this research studied the mechanical and interfacial property involved in the non-weld samples, weld samples and adhesive samples of insert moldings. Green composites as one of environment-friendly m...

Mixed Fluid Conditions: Capillary Phenomena

KAUST Repository

Santamarina, Carlos

2017-07-06

Mixed fluid phenomena in porous media have profound implications on soil-atmosphere interaction, energy geotechnology, environmental engineering and infrastructure design. Surface tension varies with pressure, temperature, solute concentration, and surfactant concentration; on the other hand, the contact angle responds to interfacial tensions, surface topography, invasion velocity, and chemical interactions. Interfaces are not isolated but interact through the fluid pressure and respond to external fields. Jumps, snap-offs and percolating wetting liquids along edges and crevices are ubiquitous in real, non-cylindrical porous networks. Pore- and macroscale instabilities together with pore structure variability-and-correlation favor fluid trapping and hinder recovery efficiency. The saturation-pressure characteristic curve is affected by the saturation-history, flow-rate, the mechanical response of the porous medium, and time-dependent reactive and diffusive processes; in addition, there are salient differences between unsaturation by internal gas nucleation and gas invasion. Capillary forces add to other skeletal forces in the porous medium and can generate open-mode discontinuities when the capillary entry pressure is high relative to the effective stress. Time emerges as an important variable in mixed-fluid conditions and common quasi-static analyses may fail to capture the system response.

Imaging unsteady three-dimensional transport phenomena

Indian Academy of Sciences (India)

2014-01-05

Jan 5, 2014 ... The image data can be jointly analysed with the physical laws governing transport and principles of image formation. Hence, with the experiment suitably carried out, three-dimensional physical domains with unsteady processes can be accommodated. Optical methods promise to breach the holy grail of ...

Diffusion and transport phenomena in a collisional magnetoplasma ...

Indian Academy of Sciences (India)

Boltzmann-transport equation is analytically solved for two-component magnetoplasma using Chapman-Enskog analysis to include collisional diffusion transport having anisotropies in both streaming velocity and temperature components. The modified collisional integrals are analytically solved with flux integrals and ...

Physical Basis for Interfacial Traction-Separation Models

International Nuclear Information System (INIS)

Neville R. Moody

2002-01-01

Many weapon components contain interfaces between dissimilar materials where cracks can initiate and cause failure. In recent years many researchers in the fracture community have adopted a cohesive zone model for simulating crack propagation (based upon traction-separation relations) Sandia is implementing this model in its ASCI codes. There is, however, one important obstacle to using a cohesive zone modeling approach. At the present time traction-separation relations are chosen in an ad hoc manner. The goal of the present work is to determine a physical basis for Traction-Separation (T-U) relations. This report presents results of a program aimed at determining the dependence of such relations on adhesive and bulk properties. The work focused on epoxy/solid interfaces, although the approach is applicable to a broad range of materials. Asymmetric double cantilevered beam and free surface film nanoindentation fracture toughness tests were used to generate a unique set of data spanning length scales, applied mode mixities, and yield (plastic) zone constraint. The crucial roles of crack tip plastic zone size and interfacial adhesion were defined by varying epoxy layer thickness and using coupling agents or special self-assembled monolayers in preparing the samples. The nature of the yield zone was probed in collaborative experiments run at the Advanced Photon Source. This work provides an understanding of the major phenomena governing polymer/solid interfacial fracture and identifies the essential features that must be incorporated in a T-U based cohesive zone failure model. We believe that models using physically based T-U relations provide a more accurate and widely applicable description of interface cracking than models using ad hoc relations. Furthermore, these T-U relations provide an essential tool for using models to tailor interface properties to meet design needs

Modelling of melting and solidification transport phenomena during hypothetical NPP severe accidents

Energy Technology Data Exchange (ETDEWEB)

Sarler, B [Inst. Jozef Stefan, Ljubljana (Slovenia)

1992-07-01

A physical and mathematical framework to deal with the transport phenomena occuring during melting and solidification of the hypothetical NPP severe accidents is presented. It concentrates on the transient temperature, velocity, and species concentration distributions during such events. The framework is based on the Mixture Continuum Formulation of the components and phases, cast in the boundary-domain integral shape structured by the fundamental solution of the Laplace equation. The formulation could cope with various solid-liquid sub-systems through the inclusion of the specific closure relations. The deduced system of boundary-domain integral equations for conservation of mass, energy, momentum, and species could be solved by the boundary element discrete approximative method. (author) [Slovenian] Predstavljeno je fizikalno in matematicno ogrodje za obravnavo prenosnih pojavov taljenja in strjevanja med hipoteticnimi tezkimi nezgodami v jedrskih elektrarnah. Osredotoceno je na popis neustaljene porazdelitve temperatur, hitrosti in koncentracij sestavin med taksnimi dogodki. Ogrodje temelji na formulaciji kontinuuma mesanice komponent in faz, v obliki robno obmocnih integralskih enacb, ki so sestavljena na podlagi fundamentalne resitve Laplace-ove enacbe. Formulacija lahko popisuje stevilne trdno-tekoce pod-sisteme na podlagi specificnih sklopitvenih relacij. Izpeljan sistem robno-obmocnih integralskih enacb za popis ohranitve mase, energije, gibalne kolicine in sestavin lahko resimo na podlagi diskretne aproksimativne metode robnih elementov. (author)

Lab-scale tests on ISV vapor transport phenomena

International Nuclear Information System (INIS)

Farnsworth, R.K.; Gardner, B.M.

1996-01-01

In situ vitrification (ISV) is a promising technology for remediating buried waste sites and contaminated soil sites. However, concerns exist that low soil permeabilities may limit vapor transport away from the advancing melt front and cause a melt expulsion that breaches ISV containment. As a result, two ISV lab tests were conducted at the Idaho National Engineering Laboratory (INEL) using INEL soil (permeability: 10 -6 cm/s) and a low permeability (10 -10 cm/s) clay material. The clay test also had a ceramic tube inserted vertically through the center of the area being melted to provide one-dimensional data on vapor transport. Results confirm that low soil permeabilities can limit vapor transport away from the advancing ISV melt front. In addition, peak pressures inside the ceramic tube were significantly greater than those outside the tube, indicating the importance of horizontal vapor transport around the advancing ISV melt front

Local measurement of interfacial area, interfacial velocity and liquid turbulence in two-phase flow

International Nuclear Information System (INIS)

Hibiki, T.; Hogsett, S.; Ishii, M.

1998-01-01

Double sensor probe and hotfilm anemometry methods were developed for measuring local flow characteristics in bubbly flow. The formulation for the interfacial area concentration measurement was obtained by improving the formulation derived by Kataoka and Ishii. The assumptions used in the derivation of the equation were verified experimentally. The interfacial area concentration measured by the double sensor probe agreed well with one by the photographic method. The filter to validate the hotfilm anemometry for measuring the liquid velocity and turbulent intensity in bubbly flow was developed based on removing the signal due to the passing bubbles. The local void fraction, interfacial area concentration, interfacial velocity, Sauter mean diameter, liquid velocity, and turbulent intensity of vertical upward air-water flow in a round tube with inner diameter of 50.8 mm were measured by using these methods. A total of 54 data sets were acquired consisting of three superficial gas flow rates, 0.039, 0.067, and 0.147 m/s, and three superficial liquid flow rates, 0.60, 1.00, and 1.30 m/s. The measurements were performed at the three locations: L/D=2, 32, and 62. This data is expected to be used for the development of reliable constitutive relations which reflect the true transfer mechanisms in two-phase flow. (author)

Toward control of the metal-organic interfacial electronic structure in molecular electronics: a first-principles study on self-assembled monolayers of pi-conjugated molecules on noble metals.

Science.gov (United States)

Heimel, Georg; Romaner, Lorenz; Zojer, Egbert; Brédas, Jean-Luc

2007-04-01

Self-assembled monolayers (SAMs) of organic molecules provide an important tool to tune the work function of electrodes in plastic electronics and significantly improve device performance. Also, the energetic alignment of the frontier molecular orbitals in the SAM with the Fermi energy of a metal electrode dominates charge transport in single-molecule devices. On the basis of first-principles calculations on SAMs of pi-conjugated molecules on noble metals, we provide a detailed description of the mechanisms that give rise to and intrinsically link these interfacial phenomena at the atomic level. The docking chemistry on the metal side of the SAM determines the level alignment, while chemical modifications on the far side provide an additional, independent handle to modify the substrate work function; both aspects can be tuned over several eV. The comprehensive picture established in this work provides valuable guidelines for controlling charge-carrier injection in organic electronics and current-voltage characteristics in single-molecule devices.

Magnetohydrodynamic flow phenomena

International Nuclear Information System (INIS)

Gerbeth, G.; Mutschke, G.; Eckert, S.

1995-01-01

The MHD group of the Institute of Safety Research performs basic studies on fluid dynamics and heat/mass transfer in fluids, particularly for electrically conducting fluids (liquid metals) exposed to external magnetic fields (Magnetohydrodynamics - MHD). Such a contactless influence on transport phenomena is of principal importance for a variety of applied problems including safety and design aspects in liquid metal cooled fusion reactors, fast reactors, and chemical systems. Any electrically conducting flow can be influenced without any contact by means of an external electromagnetic field. This, of course, can change the known hydromechanically flow patterns considerably. In the following two examples of such magnetic field influence are presented. (orig.)

Experimental measurement of the interfacial heat transfer coefficients of subcooled flow boiling using micro-thermocouple and double directional images

International Nuclear Information System (INIS)

Seong-Jin Kim; Goon-Cherl Park

2005-01-01

Full text of publication follows: Models or correlations for phase interface are needed to analyze the multi-phase flow. Interfacial heat transfer coefficients are important to constitute energy equation of multi-phase flow, specially. In subcooled boiling flow, bubble condensation at the bubble-liquid interface is a major mechanism of heat transfer within bulk subcooled liquid. Bubble collapse rates and temperatures of each phase are needed to determine the interfacial heat transfer coefficient for bubble condensation. Bubble collapse rates were calculated through image processing in single direction, generally. And in case of liquid bulk temperature, which has been obtained by general temperature sensor such as thermocouple, was used. However, multi-directional images are needed to analyze images due to limitations of single directional image processing. Also, temperature sensor, which has a fast response time, must be used to obtain more accurate interfacial heat transfer coefficient. Low pressure subcooled water flow experiments using micro-thermocouple and double directional image processing with mirrors were conducted to investigate bubble condensation phenomena and to modify interfacial heat transfer correlation. Experiments were performed in a vertical subcooled boiling flow of a rectangular channel. Bubble condensing traces with respect to time were recorded by high speed camera in double direction and bubble collapse rates were calculated by processing recorded digital images. Temperatures were measured by micro-thermocouple, which is a K-type with a 12.7 μm diameter. The liquid temperature was estimated by the developed algorithm to discriminate phases and find each phase temperature in the measured temperature including both liquid and bubble temperature. The interfacial heat transfer coefficient for bubble condensation was calculated from the bubble collapse rates and the estimated liquid temperature, and its correlation was modified. The modified

The Role of Shearing Energy and Interfacial Gibbs Free Energy in the Emulsification Mechanism of Waxy Crude Oil

Directory of Open Access Journals (Sweden)

Zhihua Wang

2017-05-01

Full Text Available Crude oil is generally produced with water, and the water cut produced by oil wells is increasingly common over their lifetime, so it is inevitable to create emulsions during oil production. However, the formation of emulsions presents a costly problem in surface process particularly, both in terms of transportation energy consumption and separation efficiency. To deal with the production and operational problems which are related to crude oil emulsions, especially to ensure the separation and transportation of crude oil-water systems, it is necessary to better understand the emulsification mechanism of crude oil under different conditions from the aspects of bulk and interfacial properties. The concept of shearing energy was introduced in this study to reveal the driving force for emulsification. The relationship between shearing stress in the flow field and interfacial tension (IFT was established, and the correlation between shearing energy and interfacial Gibbs free energy was developed. The potential of the developed correlation model was validated using the experimental and field data on emulsification behavior. It was also shown how droplet deformation could be predicted from a random deformation degree and orientation angle. The results indicated that shearing energy as the energy produced by shearing stress working in the flow field is the driving force activating the emulsification behavior. The deformation degree and orientation angle of dispersed phase droplet are associated with the interfacial properties, rheological properties and the experienced turbulence degree. The correlation between shearing stress and IFT can be quantified if droplet deformation degree vs. droplet orientation angle data is available. When the water cut is close to the inversion point of waxy crude oil emulsion, the interfacial Gibbs free energy change decreased and the shearing energy increased. This feature is also presented in the special regions where

Spin-transfer phenomena in layered magnetic structures: Physical phenomena and materials aspects

International Nuclear Information System (INIS)

Gruenberg, P.; Buergler, D.E.; Dassow, H.; Rata, A.D.; Schneider, C.M.

2007-01-01

During the past 20 years, layered structures consisting of ferromagnetic layers and spacers of various material classes with a thickness of only a few nanometers have revealed a variety of exciting and potentially very useful phenomena not present in bulk material. Representing distinct manifestations of spin-transfer processes, these phenomena may be categorized into interlayer exchange coupling (IEC), giant magnetoresistance (GMR), tunneling magnetoresistance (TMR), and the more recently discovered spin-transfer torque effect leading to current-induced magnetization switching (CIMS) and current-driven magnetization dynamics. These phenomena clearly confer novel material properties on magnetic layered structures with respect to the (magneto-)transport and the magnetostatic as well as magnetodynamic behavior. Here, we will first concentrate on the less well understood aspects of IEC across insulating and semiconducting interlayers and relate the observations to TMR in the corresponding structures. In this context, we will also discuss more recent advances in TMR due to the use of electrodes made from Heusler alloys and the realization of coherent tunneling in epitaxial magnetic tunneling junctions. Finally, we will review our results on CIMS in epitaxial magnetic nanostructures showing that normal and inverse CIMS can occur simultaneously in a single nanopillar device. In all cases discussed, material issues play a major role in the detailed understanding of the spin-transfer effects, in particular in those systems that yield the largest effects and are thus of utmost interest for applications

Study of the charge transport characteristics of dendrimer molecular thin films

Energy Technology Data Exchange (ETDEWEB)

Li, J.C., E-mail: jcli@mail.neu.edu.cn; Han, N.; Wang, S.S.; Ba, D.C.

2011-05-31

In this work, we systematically studied the electrical characteristics of two types of dendritic arylamine thin film devices. We observed that, for devices with different interfacial structures, their charge injection barriers and transport properties are obviously different. The smallest charge injection barrier is observed in dendrimer devices without charge-transfer interfacial layers. The Richardson-Schottky thermionic emission model can be well used to fit the experimental current-voltage characteristics at a lower voltage region. The charge injection barrier increases about 0.4 eV and 0.5 eV when a 1-decanethiol self-assembly layer and -CN terminated dendrimer thin films are inserted as the interfacial layer, respectively. It is shown that the molecule/electrode charge-transfer interfaces can largely affect the device charge injection/transport process and consequently change the device performance. In this case, the space charge limited conduction theory is more applicable to simulate the device conduction mechanism. Owing to its ultra-thin thickness, the self-assembly monolayer technique is proved to be an efficient approach in engineering the interfacial electronic structures of dendrimer thin film devices.

Study of the charge transport characteristics of dendrimer molecular thin films

International Nuclear Information System (INIS)

Li, J.C.; Han, N.; Wang, S.S.; Ba, D.C.

2011-01-01

In this work, we systematically studied the electrical characteristics of two types of dendritic arylamine thin film devices. We observed that, for devices with different interfacial structures, their charge injection barriers and transport properties are obviously different. The smallest charge injection barrier is observed in dendrimer devices without charge-transfer interfacial layers. The Richardson-Schottky thermionic emission model can be well used to fit the experimental current-voltage characteristics at a lower voltage region. The charge injection barrier increases about 0.4 eV and 0.5 eV when a 1-decanethiol self-assembly layer and -CN terminated dendrimer thin films are inserted as the interfacial layer, respectively. It is shown that the molecule/electrode charge-transfer interfaces can largely affect the device charge injection/transport process and consequently change the device performance. In this case, the space charge limited conduction theory is more applicable to simulate the device conduction mechanism. Owing to its ultra-thin thickness, the self-assembly monolayer technique is proved to be an efficient approach in engineering the interfacial electronic structures of dendrimer thin film devices.

Transient analysis of carbon monoxide transport phenomena and adsorption kinetics in HT-PEMFC during dynamic current extraction

International Nuclear Information System (INIS)

Raj, Kamal Abdul Rasheedj; Chan, Siew Hwa

2015-01-01

Highlights: • Increasing the fuel cell temperature reduces outlet CO concentration. • Increasing the CO inlet (initial) concentration increases outlet CO concentration. • Increasing current density step and dwell time increases outlet CO concentration. • Increasing in the CL and GDL porosities reduces outlet CO concentration. - Abstract: This paper investigates the transport phenomena of carbon monoxide (CO) and adsorption kinetics, in a high-temperature proton exchange membrane fuel cell (HT-PEMFC) during step-wise current extraction (step-change in current extraction). Step-wise current extraction is a common process done to accommodate a sudden power surge during an operation. Since HT-PEMFCs are capable of handling high impurity of CO, hydrogen fuel that is contaminated with trace amount of CO is usually considered for commercial benefits. Thus, a transient three-dimensional isothermal anodic electro-kinetic numerical model is developed to determine the effect of operating parameters such as fuel cell temperature, CO inlet (initial) concentration, step-change of current density and dwell time on the transport phenomena of CO and adsorption kinetics. In addition, geometrical factors such as the catalyst layer (CL) and gas diffusion layer (GDL) porosity are also varied as well. The results show that the above-mentioned operating parameters can affect the maximum CO concentration at the CL, especially at the outlet of the channel. Specifically, a reduction of fuel cell temperature can significantly increase the CO concentration near the outlet, while increasing CO inlet (initial) concentration, step-change amplitude of current density and current density dwell time can cause an increase in CO concentration at the outlet, albeit to different extent. In addition, the increase in the porosity of CL and GDL, results in the reduction of the maximum CO concentration at the outlet, albeit to different extent. In addition, the CO and hydrogen surface coverage

Microfluidics and microscale transport processes

CERN Document Server

Chakraborty, Suman

2012-01-01

With an intense focus on micro- and nanotechnology from a fluidic perspective, this book details the research activities in key directions on both the theoretical and experimental fronts. As part of the IIT Kharagpur Research Monograph series, the text discusses topics such as capillary transport in microchannels, fluid friction and heat transfer in microchannels, electrokinetics, and interfacial transport in nanochannels. It also covers nanoparticle transport in colloidal suspensions, bubble generation in microfluidic channels, micro-heat pipe, the lattice Boltzmann method for phase changing

TTF/TCNQ-based thin films and microcrystals. Growth and charge transport phenomena

Energy Technology Data Exchange (ETDEWEB)

Solovyeva, Vita

2011-05-26

The thesis adresses several problems related to growth and charge transport phenomena in thin films of TTF-TCNQ and (BEDT-TTF)TCNQ. The following main new problems are addressed: - The influence of thin-film specific factors, such as the substrate material and growth-induced defects, on the Peierls transition temperature in TTF-TCNQ thin films was studied; - finite-size effects in TTF-TCNQ were investigated by considering transport properties in TTF-TCNQ microcrystals. The influence of the size of the crystal on the Peierls transition temperature was studied. In this context a new method of microcontact fabrication was employed to favor the measurements; - an analysis of radiation-induced defects in TTF-TCNQ thin films and microcrystals was performed. It was demonstrated than an electron beam can induce appreciable damage to the sample such that its electronic properties are strongly modified; - a bilayer growth method was established to fabricate (BEDT-TTF)TCNQ from the gas phase. This newly developed bilayer growth method was showed to be suitable for testing (BEDT-TTF)TCNQ charge-transfer phase formation; - the structure of the formed (BEDT-TTF)TCNQ charge-transfer compounds was analyzed by using a wide range of experimental techniques. An overview and the description of the basic physical principles underlying charge-transfer compounds is given in chapter 2. Experimental techniques used for the growth and characterization of thin films and microcrystals are presented in chapter 3. Chapter 4 gives an overview of the physical properties of the studied organic materials. Chapter 5 discussed the experimental study of TTF-TCNQ thin films. he Peierls transition in TTF-TCNQ is a consequence of the quasi-one-dimensional structure of the material and depends on different factors, studied in chapters 5 and 6. In contradistinction to TTF-TTCNQ, the (BEDT-TTF)TCNQ charge-transfer compound crystallizes in several different modifications with different physical properties

Single-Molecule Interfacial Electron Transfer

Energy Technology Data Exchange (ETDEWEB)

Ho, Wilson [Univ. of California, Irvine, CA (United States)

2018-02-03

Interfacial electron transfer (ET) plays an important role in many chemical and biological processes. Specifically, interfacial ET in TiO₂-based systems is important to solar energy technology, catalysis, and environmental remediation technology. However, the microscopic mechanism of interfacial ET is not well understood with regard to atomic surface structure, molecular structure, bonding, orientation, and motion. In this project, we used two complementary methodologies; single-molecule fluorescence spectroscopy, and scanning-tunneling microscopy and spectroscopy (STM and STS) to address this scientific need. The goal of this project was to integrate these techniques and measure the molecular dependence of ET between adsorbed molecules and TiO₂ semiconductor surfaces and the ET induced reactions such as the splitting of water. The scanning probe techniques, STM and STS, are capable of providing the highest spatial resolution but not easily time-resolved data. Single-molecule fluorescence spectroscopy is capable of good time resolution but requires further development to match the spatial resolution of the STM. The integrated approach involving Peter Lu at Bowling Green State University (BGSU) and Wilson Ho at the University of California, Irvine (UC Irvine) produced methods for time and spatially resolved chemical imaging of interfacial electron transfer dynamics and photocatalytic reactions. An integral aspect of the joint research was a significant exchange of graduate students to work at the two institutions. This project bridged complementary approaches to investigate a set of common problems by working with the same molecules on a variety of solid surfaces, but using appropriate techniques to probe under ambient (BGSU) and ultrahigh vacuum (UCI) conditions. The molecular level understanding of the fundamental interfacial electron transfer processes obtained in this joint project will be important for developing efficient light harvesting

Radiation transport phenomena and modeling - part A: Codes

International Nuclear Information System (INIS)

Lorence, L.J.

1997-01-01

The need to understand how particle radiation (high-energy photons and electrons) from a variety of sources affects materials and electronics has motivated the development of sophisticated computer codes that describe how radiation with energies from 1.0 keV to 100.0 GeV propagates through matter. Predicting radiation transport is the necessary first step in predicting radiation effects. The radiation transport codes that are described here are general-purpose codes capable of analyzing a variety of radiation environments including those produced by nuclear weapons (x-rays, gamma rays, and neutrons), by sources in space (electrons and ions) and by accelerators (x-rays, gamma rays, and electrons). Applications of these codes include the study of radiation effects on electronics, nuclear medicine (imaging and cancer treatment), and industrial processes (food disinfestation, waste sterilization, manufacturing.) The primary focus will be on coupled electron-photon transport codes, with some brief discussion of proton transport. These codes model a radiation cascade in which electrons produce photons and vice versa. This coupling between particles of different types is important for radiation effects. For instance, in an x-ray environment, electrons are produced that drive the response in electronics. In an electron environment, dose due to bremsstrahlung photons can be significant once the source electrons have been stopped

p-Type semiconducting nickel oxide as an efficiency-enhancing anode interfacial layer in polymer bulk-heterojunction solar cells

Science.gov (United States)

Irwin, Michael D.; Buchholz, D. Bruce; Hains, Alexander W.; Chang, Robert P. H.; Marks, Tobin J.

2008-01-01

To minimize interfacial power losses, thin (5–80 nm) layers of NiO, a p-type oxide semiconductor, are inserted between the active organic layer, poly(3-hexylthiophene) (P3HT) + [6,6]-phenyl-C61 butyric acid methyl ester (PCBM), and the ITO (tin-doped indium oxide) anode of bulk-heterojunction ITO/P3HT:PCBM/LiF/Al solar cells. The interfacial NiO layer is deposited by pulsed laser deposition directly onto cleaned ITO, and the active layer is subsequently deposited by spin-coating. Insertion of the NiO layer affords cell power conversion efficiencies as high as 5.2% and enhances the fill factor to 69% and the open-circuit voltage (Voc) to 638 mV versus an ITO/P3HT:PCBM/LiF/Al control device. The value of such hole-transporting/electron-blocking interfacial layers is clearly demonstrated and should be applicable to other organic photovoltaics.

Charge Transport Phenomena in Peptide Molecular Junctions

International Nuclear Information System (INIS)

Luchini, A.; Petricoin, E.F.; Geho, D.H.; Liotta, L.A.; Long, D.P.; Vaisman, I.I.

2008-01-01

Inelastic electron tunneling spectroscopy (IETS) is a valuable in situ spectroscopic analysis technique that provides a direct portrait of the electron transport properties of a molecular species. In the past, IETS has been applied to small molecules. Using self-assembled nano electronic junctions, IETS was performed for the first time on a large polypeptide protein peptide in the phosphorylated and native form, yielding interpretable spectra. A reproducible 10-fold shift of the I/V characteristics of the peptide was observed upon phosphorylation. Phosphorylation can be utilized as a site-specific modification to alter peptide structure and thereby influence electron transport in peptide molecular junctions. It is envisioned that kinases and phosphatases may be used to create tunable systems for molecular electronics applications, such as biosensors and memory devices.

Mean free path dependent phonon contributions to interfacial thermal conductance

Energy Technology Data Exchange (ETDEWEB)

Tao, Yi; Liu, Chenhan; Chen, Weiyu; Cai, Shuang; Chen, Chen; Wei, Zhiyong; Bi, Kedong; Yang, Juekuan; Chen, Yunfei, E-mail: yunfeichen@seu.edu.cn

2017-06-15

Interfacial thermal conductance as an accumulation function of the phonon mean free path is rigorously derived from the thermal conductivity accumulation function. Based on our theoretical model, the interfacial thermal conductance accumulation function between Si/Ge is calculated. The results show that the range of mean free paths (MFPs) for phonons contributing to the interfacial thermal conductance is far narrower than that for phonons contributing to the thermal conductivity. The interfacial thermal conductance is mainly contributed by phonons with shorter MFPs, and the size effects can be observed only for an interface constructed by nanostructures with film thicknesses smaller than the MFPs of those phonons mainly contributing to the interfacial thermal conductance. This is why most experimental measurements cannot detect size effects on interfacial thermal conductance. A molecular dynamics simulation is employed to verify our proposed model. - Highlights: • A model to account for the interfacial thermal conductance as an accumulation function of phonon mean free path is proposed; • The model predicts that the range of mean free paths (MFPs) for phonons contributing to the interfacial thermal conductance is far narrower than that contributing to the thermal conductivity; • This model can be conveniently implemented to estimate the size effects on the interfacial thermal conductance for the interfaces formed by a nanostructure contacting a substrate.

Interfacial instability induced by a shock wave in a gas-liquid horizontal stratified system

International Nuclear Information System (INIS)

Sutradhar, S.C.; Chang, J.S.; Yoshida, H.

1987-01-01

The experiments are performed in a rectangular lucite duct equipped with the facility of generating shock waves. Piezo-type pressure transducers are used to monitor the strength and propagation velocity of the shock wave. As the liquid phase has high sound velocity, a prepulse wave system of flow amplitude travels in this phase at a speed faster than the principal shock wave. The magnitude of the transmitted wave in the liquid phase is estimated using a transmission coefficient for gas-liquid system. From the initial pressure ratio of the shock wave, the amplitude of the prepulse as well as the induced interfacial fluid velocity are calculated. The wave length and height of the ripples during the passage of the shock wave are estimated for a specific strength of shock wave moving through the phases. From the high speed photographs, the wave length of the ripples can be assessed. The interfacial friction factor is calculated using colebrook's equation for high speed flow. At least five distinct phenomena are observed to exist during the propagation of a shock wave. These are - (1) the energy carried by the pre-pulse is utilized in perturbing the interface; (2) shock wave induces a mass velocity at the interface; (3) the wavelength of the ripples at the interface is the product of induced interfacial mass velocity and the time period of the prepulse; (4) a portion of the liquid mass of the perturbed interface is entrained in the gas phase may be due to the hydrodynamic lift in that phase; and finally (5) waves with long wavelength are established at the interface

Impact of thermoelectric phenomena on phase-change memory performance metrics and scaling

International Nuclear Information System (INIS)

Lee, Jaeho; Asheghi, Mehdi; Goodson, Kenneth E

2012-01-01

The coupled transport of heat and electrical current, or thermoelectric phenomena, can strongly influence the temperature distribution and figures of merit for phase-change memory (PCM). This paper simulates PCM devices with careful attention to thermoelectric transport and the resulting impact on programming current during the reset operation. The electrothermal simulations consider Thomson heating within the phase-change material and Peltier heating at the electrode interface. Using representative values for the Thomson and Seebeck coefficients extracted from our past measurements of these properties, we predict a cell temperature increase of 44% and a decrease in the programming current of 16%. Scaling arguments indicate that the impact of thermoelectric phenomena becomes greater with smaller dimensions due to enhanced thermal confinement. This work estimates the scaling of this reduction in programming current as electrode contact areas are reduced down to 10 nm × 10 nm. Precise understanding of thermoelectric phenomena and their impact on device performance is a critical part of PCM design strategies. (paper)

Modelling the transport phenomena and texture changes of chicken breast meat during the roasting in a convective oven

DEFF Research Database (Denmark)

Rabeler, Felix; Feyissa, Aberham Hailu

2018-01-01

A numerical 3D model of coupled transport phenomena and texture changes during the roasting of chicken breast meat in a convection oven was developed. The model is based on heat and mass transfer coupled with the kinetics of temperature induced texture changes of chicken breast meat. The partial...... experimentally values. The developed model enables the prediction of the texture development inside the chicken meat as function of the process parameters. The model predictions and measured values show the clear effect of changing process settings on the texture profiles during the roasting process. Overall......, the developed model provides deep insights into the local and spatial texture changes of chicken breast meat during the roasting process that cannot be gained by experimentation alone....

The role of interfacial water layer in atmospherically relevant charge separation

Science.gov (United States)

Bhattacharyya, Indrani

Charge separation at interfaces is important in various atmospheric processes, such as thunderstorms, lightning, and sand storms. It also plays a key role in several industrial processes, including ink-jet printing and electrostatic separation. Surprisingly, little is known about the underlying physics of these charging phenomena. Since thin films of water are ubiquitous, they may play a role in these charge separation processes. This talk will focus on the experimental investigation of the role of a water adlayer in interfacial charging, with relevance to meteorologically important phenomena, such as atmospheric charging due to wave actions on oceans and sand storms. An ocean wave generates thousands of bubbles, which upon bursting produce numerous large jet droplets and small film droplets that are charged. In the 1960s, Blanchard showed that the jet droplets are positively charged. However, the charge on the film droplets was not known. We designed an experiment to exclusively measure the charge on film droplets generated by bubble bursting on pure water and aqueous salt solution surfaces. We measured their charge to be negative and proposed a model where a slight excess of hydroxide ions in the interfacial water layer is responsible for generating these negatively charged droplets. The findings from this research led to a better understanding of the ionic disposition at the air-water interface. Sand particles in a wind-blown sand layer, or 'saltation' layer, become charged due to collisions, so much so, that it can cause lightning. Silica, being hydrophilic, is coated with a water layer even under low-humidity conditions. To investigate the importance of this water adlayer in charging the silica surfaces, we performed experiments to measure the charge on silica surfaces due to contact and collision processes. In case of contact charging, the maximum charge separation occurred at an optimum relative humidity. On the contrary, in collisional charging process, no

Application of the Maxwell-Wagner-Hanai effective medium theory to the analysis of the interfacial polarization relaxations in conducting composite films

International Nuclear Information System (INIS)

Adohi, B J-P; Bouanga, C Vanga; Fatyeyeva, K; Tabellout, M

2009-01-01

A new approach to explain the interfacial polarization phenomenon in conducting composite films is proposed. HCl-doped poly(ethylene terephthalate) (PET) and polyamide-6 (PA-6) matrices with embedded polyaniline (PANI) particles as filler were investigated and analysed, combining dielectric spectroscopy and AFM electrical images with the effective medium theory analysis. Up to three relaxation peaks attributed to the interfacial polarization phenomena were detected in the studied frequency range (0.1 Hz-1 MHz). The AFM electrical images revealed that the doped PA-6/PANI composite can be modelled as a single-type particle medium and the PET/PANI one as a two-type particle medium. A simple dielectric loss expression was derived from the Maxwell-Wagner-Hanai mixture equation and was applied to the experimental data to identify the interfaces involved in each of the relaxation peaks. The parameter values (permittivity, conductivity, volume fraction of the PANI particles) were found to agree well with the measured one, hence validating the models.

Flow regime, void fraction and interfacial area transport and characteristics of co-current downward two-phase flow

Energy Technology Data Exchange (ETDEWEB)

Lokanathan, Manojkumar [School of Mechanical Engineering, Purdue University, 585 Purdue Mall, West Lafayette, IN 47907-2088 (United States); Hibiki, Takashi [School of Nuclear Engineering, Purdue University, 400 Central Drive, West Lafayette, IN 47907-2017 (United States)

2016-10-15

Highlights: • Downward flow regime maps and models were studied for 25.4 to 101.6 mm pipe diameters. • Effect of flow inlet on flow transition, void & interfacial area profile were studied. • Bubble void profiles were associated with the interfacial forces for downward flow. • Flow regime pressure drop and interfacial friction factor were studied. • The most applicable and accurate downward drift-flux correlation was determined. - Abstract: Downward two-phase flow is observed in light water reactor accident scenarios such as loss of coolant accident (LOCA) and loss of heat sink accident (LOHS) due to loss of feed water or a secondary pipe break. Hence, a comprehensive literature review has been performed for the co-current downward two-phase flow with information on the flow regime transitions and flow characteristics for each regime in the downward flow. The review compares the experimental data of the flow regime map and the current available transition models. Objectivity of the data varies on the method utilized as a certain degree of subjectivity is still present in the most objective method. Nevertheless, experimental data through subjective methods such as direct visualization or analysis of a wire mesh sensor (WMS) data were still studied in this review. Despite the wide range of flow regime data for numerous pipe sizes, a consensus was not reached for the effect of pipe sizes on flow regime transition. However, it is known that a larger pipe results in greater degree of coalescence at lower gas flow rates (Hibiki et al., 2004). The introduction of a flow straightener at the inlet led to less coring and fluid rotation and inevitably, reduced bubble coalescence. This also resulted in the disappearance of the kinematic shock wave phenomenon, contrary to an inlet without a flow straightener. The effect of flow inlet, flow location, pipe diameter and bubble interfacial forces on the radial distribution as well as bubble coalescence and breakup rate

Interfacial Energy and Fine Defect Structures for Incoherent Films

OpenAIRE

Cermelli, Paolo; Gurtin, Morton E.; Leoni, Giovanni

1999-01-01

This note summarizes recent results in which modern techniques of the calculus of variations are used to obtain qualitative features of film-substrate interfaces for a broad class of interfacial energies. In particular, we show that the existence of a critical thickness for incoherency and the formation of interfacial dislocations depend strongly on the convexity and smoothness of the interfacial energy function.

Antagonistic Phenomena in Network Dynamics

Science.gov (United States)

Motter, Adilson E.; Timme, Marc

2018-03-01

Recent research on the network modeling of complex systems has led to a convenient representation of numerous natural, social, and engineered systems that are now recognized as networks of interacting parts. Such systems can exhibit a wealth of phenomena that not only cannot be anticipated from merely examining their parts, as per the textbook definition of complexity, but also challenge intuition even when considered in the context of what is now known in network science. Here, we review the recent literature on two major classes of such phenomena that have far-reaching implications: (a) antagonistic responses to changes of states or parameters and (b) coexistence of seemingly incongruous behaviors or properties - both deriving from the collective and inherently decentralized nature of the dynamics. They include effects as diverse as negative compressibility in engineered materials, rescue interactions in biological networks, negative resistance in fluid networks, and the Braess paradox occurring across transport and supply networks. They also include remote synchronization, chimera states, and the converse of symmetry breaking in brain, power-grid, and oscillator networks as well as remote control in biological and bioinspired systems. By offering a unified view of these various scenarios, we suggest that they are representative of a yet broader class of unprecedented network phenomena that ought to be revealed and explained by future research.

Interfacial Tension and Surface Pressure of High Density Lipoprotein, Low Density Lipoprotein, and Related Lipid Droplets

DEFF Research Database (Denmark)

Ollila, O. H. S.; Lamberg, A.; Lehtivaara, M.

2012-01-01

) are essentially lipid droplets surrounded by specific proteins, their main function being to transport cholesterol. Interfacial tension and surface pressure of these particles are of great interest because they are related to the shape and the stability of the droplets and to protein adsorption at the interface....... Here we use coarse-grained molecular-dynamics simulations to consider a number of related issues by calculating the interfacial tension in protein-free lipid droplets, and in HDL and LDL particles mimicking physiological conditions. First, our results suggest that the curvature dependence......Lipid droplets play a central role in energy storage and metabolism on a cellular scale. Their core is comprised of hydrophobic lipids covered by a surface region consisting of amphiphilic lipids and proteins. For example, high and low density lipoproteins (HDL and LDL, respectively...

The influence of chemistry on severe accident phenomena in integral tests

International Nuclear Information System (INIS)

Hobbins, R.R.; Osetek, D.J.; Hagrman, D.L.

1988-01-01

The influence of chemical processes on severe accident phenomena in integral tests is reviewed and recommendations for areas of additional work are made. The results reviewed include those from tests conducted in the in-pile facilities at ACRR, PBF, and TREAT and the TMI-2 accident. Progress has been made in understanding the influence of chemistry on important severe accident phenomena such as core melt progression, hydrogen generation, aerosol generation and transport, and fission product release and transport (including revaporization). An example is the chemistry of volatile fission products, especially iodine and tellurium. Areas where understanding is inadequate are also apparent, such as chemical interactions between fission product vapors and aerosols. Influential chemical processes reviewed include oxidation by steam and interactions among control, structural, fuel, fission product, and aerosol materials

Controlling Interfacial Separation in Porous Structures by Void Patterning

Science.gov (United States)

Ghareeb, Ahmed; Elbanna, Ahmed

Manipulating interfacial response for enhanced adhesion or fracture resistance is a problem of great interest to scientists and engineers. In many natural materials and engineering applications, an interface exists between a porous structure and a substrate. A question that arises is how the void distribution in the bulk may affect the interfacial response and whether it is possible to alter the interfacial toughness without changing the surface physical chemistry. In this paper, we address this question by studying the effect of patterning voids on the interfacial-to-the overall response of an elastic plate glued to a rigid substrate by bilinear cohesive material. Different patterning categories are investigated; uniform, graded, and binary voids. Each case is subjected to upward displacement at the upper edge of the plate. We show that the peak force and maximum elongation at failure depend on the voids design and by changing the void size, alignment or gradation we may control these performance measures. We relate these changes in the measured force displacement response to energy release rate as a measure of interfacial toughness. We discuss the implications of our results on design of bulk heterogeneities for enhanced interfacial behavior.

Interfacial potential approach for Ag/ZnO (0001) interfaces

International Nuclear Information System (INIS)

Song Hong-Quan; Shen Jiang; Qian Ping; Chen Nan-Xian

2014-01-01

Systematic approaches are presented to extract the interfacial potentials from the ab initio adhesive energy of the interface system by using the Chen—Möbius inversion method. We focus on the interface structure of the metal (111)/ZnO (0001) in this work. The interfacial potentials of Ag—Zn and Ag—O are obtained. These potentials can be used to solve some problems about Ag/ZnO interfacial structure. Three metastable interfacial structures are investigated in order to check these potentials. Using the interfacial potentials we study the procedure of interface fracture in the Ag/ZnO (0001) interface and discuss the change of the energy, stress, and atomic structures in tensile process. The result indicates that the exact misfit dislocation reduces the total energy and softens the fracture process. Meanwhile, the formation and mobility of the vacancy near the interface are observed. (condensed matter: structural, mechanical, and thermal properties)

The analysis of interfacial waves

International Nuclear Information System (INIS)

Galimov, Azat Yu.; Drew, Donald A.; Lahey, Richard T.; Moraga, Francisco J.

2005-01-01

We present analytical results for stable stratified wavy two-phase flow and functional forms for the various interfacial force densities in a two-fluid model. In particular, we have derived analytically the components of the non-drag interfacial force density [Drew, D.A., Passman, S.L., 1998. Theory of Multicomponent Fluids. Springer-Verlag, New York; Nigmatulin, T.R., Drew, D.A., Lahey, R.T., Jr., 2000. An analysis of wavy annular flow. In: International Conference on Multiphase Systems, ICMS'2000, Ufa, Russia, June 15-17], Reynolds stress tensor, and the term, (p-bar cl i -p-bar cl )-bar α cl , where p-bar cl i is interfacial average pressure, p-bar cl the average pressure, and α cl is the volume fraction of the continuous liquid phase. These functional forms should be useful for assessing two-fluid closure relations and Computational Multiphase Fluid Dynamics (CMFD) numerical models for stratified wavy flows. Moreover, it appears that this approach can be generalized to other flow regimes (e.g., annular flows)

Exchange bias mediated by interfacial nanoparticles (invited)

Energy Technology Data Exchange (ETDEWEB)

Berkowitz, A. E., E-mail: aberk@ucsd.edu [Department of Physics, University of California, San Diego, La Jolla, California 92093 (United States); Center for Magnetic Recording Research, University of California, California 92093 (United States); Sinha, S. K. [Department of Physics, University of California, San Diego, La Jolla, California 92093 (United States); Fullerton, E. E. [Center for Magnetic Recording Research, University of California, California 92093 (United States); Smith, D. J. [Department of Physics, Arizona State University, Tempe, Arizona 85287 (United States)

2015-05-07

The objective of this study on the iconic exchange-bias bilayer Permalloy/CoO has been to identify those elements of the interfacial microstructure and accompanying magnetic properties that are responsible for the exchange-bias and hysteretic properties of this bilayer. Both epitaxial and polycrystalline samples were examined. X-ray and neutron reflectometry established that there existed an interfacial region, of width ∼1 nm, whose magnetic properties differed from those of Py or CoO. A model was developed for the interfacial microstructure that predicts all the relevant properties of this system; namely; the temperature and Permalloy thickness dependence of the exchange-bias, H{sub EX}, and coercivity, H{sub C}; the much smaller measured values of H{sub EX} from what was nominally expected; the different behavior of H{sub EX} and H{sub C} in epitaxial and polycrystalline bilayers. A surprising result is that the exchange-bias does not involve direct exchange-coupling between Permalloy and CoO, but rather is mediated by CoFe{sub 2}O{sub 4} nanoparticles in the interfacial region.

Probing Interfacial Water on Nanodiamonds in Colloidal Dispersion.

Science.gov (United States)

Petit, Tristan; Yuzawa, Hayato; Nagasaka, Masanari; Yamanoi, Ryoko; Osawa, Eiji; Kosugi, Nobuhiro; Aziz, Emad F

2015-08-06

The structure of interfacial water layers around nanoparticles dispersed in an aqueous environment may have a significant impact on their reactivity and on their interaction with biological species. Using transmission soft X-ray absorption spectroscopy in liquid, we demonstrate that the unoccupied electronic states of oxygen atoms from water molecules in aqueous colloidal dispersions of nanodiamonds have a different signature than bulk water. X-ray absorption spectroscopy can thus probe interfacial water molecules in colloidal dispersions. The impacts of nanodiamond surface chemistry and concentration on interfacial water electronic signature are discussed.

Nanoscale interfacial defect shedding in a growing nematic droplet.

Science.gov (United States)

Gurevich, Sebastian; Provatas, Nikolas; Rey, Alejandro

2017-08-01

Interfacial defect shedding is the most recent known mechanism for defect formation in a thermally driven isotropic-to-nematic phase transition. It manifests in nematic-isotropic interfaces going through an anchoring switch. Numerical computations in planar geometry established that a growing nematic droplet can undergo interfacial defect shedding, nucleating interfacial defect structures that shed into the bulk as +1/2 point defects. By extending the study of interfacial defect shedding in a growing nematic droplet to larger length and time scales, and to three dimensions, we unveil an oscillatory growth mode involving shape and anchoring transitions that results in a controllable regular distributions of point defects in planar geometry, and complex structures of disclination lines in three dimensions.

Uncertainty in RELAP5/MOD3.2 calculations for interfacial drag in downward two-phase flow

International Nuclear Information System (INIS)

Clark, Collin; Schlegel, Joshua P.; Hibiki, Takashi; Ishii, Mamoru; Kinoshita, Ikuo

2016-01-01

Highlights: • Uncertainty propagation is key for best estimate code reliability. • Uncertainty in drift flux correlations used to evaluate uncertainty in interfacial drag. • Bias and error have been compared for various models. - Abstract: RELAP5/MOD3.2 is a thermal-hydraulic system analysis code used to predict the response of nuclear reactor coolant systems in the event of certain accident scenarios. It is important that RELAP and other system analysis codes are able to accurately predict various two-phase flow phenomena, particularly the interfacial transfers between the liquid and gas phases. It is also important to understand how much uncertainty exists in these predictions due to uncertainties in the constitutive relations used to close the two-fluid model. In this paper, the uncertainty in the interfacial drag calculated by RELAP5/MOD3.2 due to errors in the drift-flux models used to close the model is evaluated and compared to the correlation developed by Goda et al. (2003). The case of downward flow is considered due to the importance of co-current and counter-current downward flow for predicting behavior in the downcomer of reactor systems during small-break Loss of Coolant Accidents (LOCAs) in nuclear reactor systems. The overall uncertainty in the interfacial force calculations due to error in the distribution parameter models were found to have a bias of +8.1% and error of 20.1% for the models used in RELAP5, and a bias of −30.8% and error of 23.1% for the correlation of Goda et al. (2003). However this analysis neglects the effects of compensating errors in the drift-flux parameters, as the drift velocity is assumed to be perfectly accurate. More physically meaningful results could be obtained if the distribution parameter and drift velocity were calculated directly from local phase concentration and velocity measurements, however no studies were available which included all of this information.

Critical Assessment of Effective Interfacial Potentials Based on a Density Functional Theory for Wetting Phenomena on Curved Substrates

Czech Academy of Sciences Publication Activity Database

Nold, A.; Malijevský, Alexandr; Kalliadasis, S.

2011-01-01

Roč. 197, č. 1 (2011), s. 185-191 ISSN 1951-6355 R&D Projects: GA AV ČR IAA400720710 Grant - others:EPSRC(GB) EP/E046029; FP7 ITN(XE) 214919; ERC(XE) 247301 Institutional research plan: CEZ:AV0Z40720504 Keywords : wetting phenomena * curved substrates * theory Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 1.562, year: 2011

Transient phenomena in multiphase flow

International Nuclear Information System (INIS)

Afgan, N.H.

1988-01-01

This book is devoted to formulation of the two-phase system. Emphasis is given to classical instantaneous equations of mass momentum and energy for local conditions and respective averaging procedures and their relevance to the structure of transfer laws. In formulating an equation for a two-velocity continuum, two-phase dispersed flow, two-velocity and local inertial effects associated with contraction and expansion of the mixture have been considered. Particular attention is paid to the effects of interface topology and area concentration as well as the latter's dependence on interfacial transfer laws. Also covered are low bubble concentrations in basic nonuniform unsteady flow where interactions between bubbles are negligible but where the effects of bubbles must still be considered. Special emphasis has been given to the pairwise interaction of the bubble and respective hydrodynamic equations describing the motion of a pair of spherical bubbles through a liquid This book introduces turbulence phenomena in two-phase flow and related problems of phase distribution in two-phase flow. This includes an extensive survey of turbulence and phase distribution models in transient two-phase flow. It is shown that if the turbulent structure of the continuous phase of bubbly two-phase is either measured or can be predicted, then the observed lateral phase distribution can be determined by using an multidimensional two-fluid model in which all lateral forces are properly modeled

Interfacial friction in low flowrate vertical annular flow

International Nuclear Information System (INIS)

Kelly, J.M.; Freitas, R.L.

1993-01-01

During boil-off and reflood transients in nuclear reactors, the core liquid inventory and inlet flowrate are largely determined by the interfacial friction in the reactor core. For these transients, annular flow occurs at relatively modest liquid flowrates and at the low heat fluxes typical of decay heat conditions. The resulting low vapor Reynolds numbers, are out of the data range used to develop the generally accepted interfacial friction relations for annular flow. In addition, most existing annular flow data comes from air/liquid adiabatic experiments with fully developed flows. By contrast, in a reactor core, the flow is continuously developing along the heated length as the vapor flowrate increases and the flow regimes evolve from bubbly to annular flow. Indeed, the entire annular flow regime may exist only over tens of L/D's. Despite these limitations, many of the advanced reactor safety analysis codes employ the Wallis model for interfacial friction in annular flow. Our analyses of the conditions existing at the end-of-reflood in the PERICLES tests have indicated that the Wallis model seriously underestimates the interfacial shear for low vapor velocity cocurrent upflow. To extend the annular flow data base to diabatic low flowrate conditions, the DADINE tests were re-analyzed. In these tests, both pressure drop and local cross-section averaged void fractions were measured. Thus, both the wall and interfacial shear can be deduced. Based on the results of this analysis, a new correlation is proposed for interfacial friction in annular flow. (authors). 5 figs., 12 refs

Interfacial crystalline structures in injection over-molded polypropylene and bond strength.

Science.gov (United States)

Yan, Bowen; Wu, Hong; Jiang, Genjie; Guo, Shaoyun; Huang, Jian

2010-11-01

This paper describes interfacial crystalline structures found in injection overmolded polypropylene components and the relationship of these structures to bond strength between the components. The combined effects of the development of hierarchical gradient structures and the particular thermomechanical environment near the interface on the interfacial crystalline structures were investigated in detail by PLM, SEM, DSC, WAXD, and infrared dichroism spectroscopy. The experimental results showed that during molding there was competitive formation of interfacial crystalline structures consisted of "shish-kebab" layer (SKL) and a transcrystalline layers (TCL). Variation in shear stress (controlled by injection pressure and injection speed) plays an important role in the formation of the SKL. The formation of TCL is influenced by the thermal environment, namely melt temperature and mold temperature. Increasing within certain limits, interfacial temperature and the thermal gradient near the interface promotes β-iPP growth. The relationship between interfacial crystalline structures and interfacial bond strength was established by lap shear measurement. The interfacial bond strength is improved by enhancing the formation of TCL, but reduced if SKL predominates.

Microfluidic ultralow interfacial tensiometry with magnetic particles.

Science.gov (United States)

Tsai, Scott S H; Wexler, Jason S; Wan, Jiandi; Stone, Howard A

2013-01-07

We describe a technique that measures ultralow interfacial tensions using paramagnetic spheres in a co-flow microfluidic device designed with a magnetic section. Our method involves tuning the distance between the co-flowing interface and the magnet's center, and observing the behavior of the spheres as they approach the liquid-liquid interface-the particles either pass through or are trapped by the interface. Using threshold values of the magnet-to-interface distance, we make estimates of the two-fluid interfacial tension. We demonstrate the effectiveness of this technique for measuring very low interfacial tensions, O(10(-6)-10(-5)) N m(-1), by testing solutions of different surfactant concentrations, and we show that our results are comparable with measurements made using a spinning drop tensiometer.

Interfacial patterns in magnetorheological fluids: Azimuthal field-induced structures.

Science.gov (United States)

Dias, Eduardo O; Lira, Sérgio A; Miranda, José A

2015-08-01

Despite their practical and academic relevance, studies of interfacial pattern formation in confined magnetorheological (MR) fluids have been largely overlooked in the literature. In this work, we present a contribution to this soft matter research topic and investigate the emergence of interfacial instabilities when an inviscid, initially circular bubble of a Newtonian fluid is surrounded by a MR fluid in a Hele-Shaw cell apparatus. An externally applied, in-plane azimuthal magnetic field produced by a current-carrying wire induces interfacial disturbances at the two-fluid interface, and pattern-forming structures arise. Linear stability analysis, weakly nonlinear theory, and a vortex sheet approach are used to access early linear and intermediate nonlinear time regimes, as well as to determine stationary interfacial shapes at fully nonlinear stages.

Interfacial adhesion of laser clad functionally graded materials

NARCIS (Netherlands)

Pei, Y. T.; Ocelik, V.; De Hosson, J. T. M.

2003-01-01

Specially designed samples of laser clad AlSi40 functionally graded materials (FGM) are made for evaluating the interfacial adhesion. To obtain the interfacial bond strength notches are made right at the interface of the FGMs. In-situ microstructural observations during straining in a field-emission

Interfacial adhesion of laser clad functionally graded materials

NARCIS (Netherlands)

De Hosson, JTM; Pei, YT; Ocelik, [No Value; Sudarshan, TS; Stiglich, JJ; Jeandin, M

2002-01-01

Specially designed samples of laser clad AlSi40 functionally graded materials (FGM) are made for evaluating the interfacial adhesion. To obtain the interfacial bond strength notches are made right at the interface of the FGMs. In-sitit microstructural observations during straining in an FEG-ESEM

Pore scale study of multiphase multicomponent reactive transport during CO2 dissolution trapping

Science.gov (United States)

Chen, Li; Wang, Mengyi; Kang, Qinjun; Tao, Wenquan

2018-06-01

Solubility trapping is crucial for permanent CO2 sequestration in deep saline aquifers. For the first time, a pore-scale numerical method is developed to investigate coupled scCO2-water two-phase flow, multicomponent (CO2(aq), H+, HCO3-, CO32- and OH-) mass transport, heterogeneous interfacial dissolution reaction, and homogeneous dissociation reactions. Pore-scale details of evolutions of multiphase distributions and concentration fields are presented and discussed. Time evolutions of several variables including averaged CO2(aq) concentration, scCO2 saturation, and pH value are analyzed. Specific interfacial length, an important variable which cannot be determined but is required by continuum models, is investigated in detail. Mass transport coefficient or efficient dissolution rate is also evaluated. The pore-scale results show strong non-equilibrium characteristics during solubility trapping due to non-uniform distributions of multiphase as well as slow mass transport process. Complicated coupling mechanisms between multiphase flow, mass transport and chemical reactions are also revealed. Finally, effects of wettability are also studied. The pore-scale studies provide deep understanding of non-linear non-equilibrium multiple physicochemical processes during CO2 solubility trapping processes, and also allow to quantitatively predict some important empirical relationships, such as saturation-interfacial surface area, for continuum models.

Chiral transport of neutrinos in supernovae

Directory of Open Access Journals (Sweden)

Yamamoto Naoki

2017-01-01

Full Text Available The conventional neutrino transport theory for core-collapse supernovae misses one key property of neutrinos: the left-handedness. The chirality of neutrinos modifies the hydrodynamic behavior at the macroscopic scale and leads to topological transport phenomena. We argue that such transport phenomena should play important roles in the evolution of core-collapse supernovae, and, in particular, lead to a tendency toward the inverse energy cascade from small to larger scales, which may be relevant to the origin of the supernova explosion.

Interfacial shear stress in stratified flow in a horizontal rectangular duct

International Nuclear Information System (INIS)

Lorencez, C.; Kawaji, M.; Murao, Y.

1995-01-01

Interfacial shear stress has been experimentally examined for both cocurrent and countercurrent stratified wavy flows in a horizontal interfacial shear stress from the measurements were examined and the results have been compared with existing correlations. Some differences were found in the estimated interfacial shear stress from the measurements were examined and the results have been compared with existing correlations. Some differences were found in the estimated interfacial shear stress values at high gas flow rates which could be attributed to the assumptions and procedures involved in each method. The interfacial waves and secondary motions were also found to have significant effects on the accuracy of Reynolds stress and turbulence kinetic energy extrapolation methods

Interfacial shear stress in stratified flow in a horizontal rectangular duct

Energy Technology Data Exchange (ETDEWEB)

Lorencez, C.; Kawaji, M. [Univ. of Toronto (Canada); Murao, Y. [Tokushima Univ. (Japan)] [and others

1995-09-01

Interfacial shear stress has been experimentally examined for both cocurrent and countercurrent stratified wavy flows in a horizontal interfacial shear stress from the measurements were examined and the results have been compared with existing correlations. Some differences were found in the estimated interfacial shear stress from the measurements were examined and the results have been compared with existing correlations. Some differences were found in the estimated interfacial shear stress values at high gas flow rates which could be attributed to the assumptions and procedures involved in each method. The interfacial waves and secondary motions were also found to have significant effects on the accuracy of Reynolds stress and turbulence kinetic energy extrapolation methods.

Transient interfacial tension and dilatational rheology of diffuse polymer-polymer interfaces

NARCIS (Netherlands)

Peters, G.W.M.; Zdravkov, A.N.; Meijer, H.E.H.

2005-01-01

We demonstrate the influence of molecular weight and molecular weightasymmetry across an interface on the transient behavior of the interfacial tension. The interfacial tension was measured as a function of time for a range of polymer combinations with a broadrange of interfacial properties using a

Liquid-liquid transfer phenomena studies coupled with redox reactions: back-extraction of nitrous acid in the presence of scavengers in aqueous phase

International Nuclear Information System (INIS)

K'zerho, R.

1998-01-01

This work deals with the investigation of redox reaction contribution to the kinetics of liquid-liquid transfer, in relation with PUREX reprocessing of spent nuclear fuel. The chemical system chosen concerns the tripping of nitrous acid from tributylphosphate organic phase into a nitric acid aqueous solution containing an 'anti-nitrous' component, namely hydrazinium nitrate. According to the abundant literature, a major attention is devoted to the very important role of interfacial phenomena on the kinetics of solvent extraction with tributylphosphate. Although, a suitable experimental technique is chosen, using a constant interfacial area cell of the ARMOLLEX-type. Furthermore, the effects of the hydrodynamical and the physico-chemical parameters on the extraction rate led to the identification of the extraction regime nature: diffusional, then chemical limitation. When no 'anti-nitrous' component is used, the diffusional resistance is found to be mainly located in the aqueous diffusion layer. The presence of hydrazinium nitrate into the aqueous solution has an overall accelerating effect on the rate of extraction, related to both a complete suppression of the aqueous diffusional resistance, and a very significant enhancement of the interfacial transfer of the nitrous acid, as a function of hydrazinium concentration. If the first effect could be expected because of the well known fast redox reaction in aqueous phase, the second phenomenon represents a quite original and new result which has never been explored before, to the best of our knowledge. A reaction mechanism is postulated and validated, taking into account the reactive effect of hydrazinium on the interfacial step. In order to support the drawn general patterns, different complementary studies were attempted. When hydroxyl-ammonium nitrate is used, a surprising interfacial transfer blockage is observed, pointing out the extreme performance and specificity of the common hydrazinium component. (author)

An improved interfacial bonding model for material interface modeling

Science.gov (United States)

Lin, Liqiang; Wang, Xiaodu; Zeng, Xiaowei

2016-01-01

An improved interfacial bonding model was proposed from potential function point of view to investigate interfacial interactions in polycrystalline materials. It characterizes both attractive and repulsive interfacial interactions and can be applied to model different material interfaces. The path dependence of work-of-separation study indicates that the transformation of separation work is smooth in normal and tangential direction and the proposed model guarantees the consistency of the cohesive constitutive model. The improved interfacial bonding model was verified through a simple compression test in a standard hexagonal structure. The error between analytical solutions and numerical results from the proposed model is reasonable in linear elastic region. Ultimately, we investigated the mechanical behavior of extrafibrillar matrix in bone and the simulation results agreed well with experimental observations of bone fracture. PMID:28584343

Modeling the effect of water vapor on the interfacial behavior of high-temperature air in contact with Fe20Cr surfaces

International Nuclear Information System (INIS)

Chialvo, Ariel A.; Brady, Michael P.; Keiser, James R.; Cole, David R.

2011-01-01

Highlights: → Atomistic view of the contrasting interfacial behavior between high-temperature dry- and wet-air in contact with stainless steels. → H 2 O preferentially adsorbs and displaces oxygen at the metal-fluid interface. → Findings are consistent with Ehlers et al.'s proposed competitive adsorption mechanism for the interpretation of the breakaway oxidation. → Significant impact of the inhomogeneous density distribution between the interfacial- and bulk-environments on the fluid transport. -- This work uses molecular dynamics simulation to provide an atomistic view of the contrasting interfacial behavior between high-temperature dry air and wet (10-40 vol.% water) air in contact with stainless steels. A key finding was that H 2 O preferentially adsorbs and displaces oxygen at the metal-fluid interface. We also discuss how these findings are consistent with Ehlers et al. proposed competitive adsorption mechanism for the interpretation of the breakaway oxidation, and highlight their impact on other properties.

Coupled Interfacial Tension and Phase Behavior Model Based on Micellar Curvatures

KAUST Repository

Torrealba, V. A.

2017-11-08

This article introduces a consistent and robust model that predicts interfacial tensions for all microemulsion Winsor types and overall compositions. The model incorporates film bending arguments and Huh\\'s equation and is coupled to phase behavior so that simultaneous tuning of both interfacial tension (IFT) and phase behavior is possible. The oil-water interfacial tension and characteristic length are shown to be related to each other through the hydrophilic-lipophilic deviation (HLD). The phase behavior is tied to the micelle curvatures, without the need for using the net average curvature (NAC). The interfacial tension model is related to solubilization ratios in order to introduce a coupled interfacial tension-phase behavior model for all phase environments. The approach predicts two- and three-phase interfacial tensions and phase behavior (i.e., tie lines and tie triangles) for changes in composition and HLD input parameters, such as temperature, pressure, surfactant structure, and oil equivalent alkane carbon number. Comparisons to experimental data show excellent fits and predictive capability.

POROUS MICROSTRUCTURE OF THE INTERFACIAL TRANSITION ZONE IN GEOPOLYMER COMPOSITES

Directory of Open Access Journals (Sweden)

Steinerová M.

2013-12-01

Full Text Available The study deals with a comparison of the differences in the structure, composition and micromechanical properties of a metakaolinite geopolymer composite matrix, inside and outside of the interfacial transition zone (ITZ with quartz grains of added silica sand. The microstructure is investigated by a measurement of the mercury porosimetry, microscopy and by a measurement in SEM and AFM, completed by Raman spectroscopy. Weaker mechanical properties, micropores in the ITZ, a higher concentration of Al atoms and hydroxyl groups than in the ambient matrix were detected. The water transport is probably the reason for the micropore formation, caused by disequilibrium in the course of solid-phase building from geopolymer dispersion.

Simulation studies of current transport in metal-insulator-semiconductor Schottky barrier diodes

International Nuclear Information System (INIS)

Chand, Subhash; Bala, Saroj

2007-01-01

The current-voltage characteristics of Schottky diodes with an interfacial insulator layer are analysed by numerical simulation. The current-voltage data of the metal-insulator-semiconductor Schottky diode are simulated using thermionic emission diffusion (TED) equation taking into account an interfacial layer parameter. The calculated current-voltage data are fitted into ideal TED equation to see the apparent effect of interfacial layer parameters on current transport. Results obtained from the simulation studies shows that with mere presence of an interfacial layer at the metal-semiconductor interface the Schottky contact behave as an ideal diode of apparently high barrier height (BH), but with same ideality factor and series resistance as considered for a pure Schottky contact without an interfacial layer. This apparent BH decreases linearly with decreasing temperature. The effects giving rise to high ideality factor in metal-insulator-semiconductor diode are analysed. Reasons for observed temperature dependence of ideality factor in experimentally fabricated metal-insulator-semiconductor diodes are analysed and possible mechanisms are discussed

Paranormal phenomena

Science.gov (United States)

Gaina, Alex

1996-08-01

Critical analysis is given of some paranormal phenomena events (UFO, healers, psychokinesis (telekinesis))reported in Moldova. It is argued that correct analysis of paranormal phenomena should be made in the framework of electromagnetism.

Tracer sorption and macroscopic transport in clay nano-pores: a lattice-Boltzmann study

International Nuclear Information System (INIS)

Levesque, Maximilien; Rotenberg, Benjamin; Duvail, Magali; Benichou, Olivier; Voituriez, Raphael; Pagonabarraga, Ignacio; Frenkel, Daan

2012-01-01

followed by making their associated moment to propagate between nodes of a lattice with a probability defined by evolution equations. This evolution with time gives access to macroscopic transport properties like the tracer effective diffusion coefficient. For now, however, the evolution equations do not satisfactorily account for sorption effects as they do not capture their chemical-specific nature. This is our goal to overtake this lack. We have introduced the specific adsorption and desorption mechanisms in the description of tracers transport. This has been done for neutral tracers, as a first step, by introducing a new possible event during the moment propagation of particles standing at solid-liquid interfacial nodes: they may adsorb (desorb) with a probability related to the adsorption and desorption rates of the underlying mechanism occurring at the molecular scale. In order to validate the method and to determine its numerical limitations, we have compared the Lattice-Boltzmann results to an analytical solution developed purposely in the simple geometry consisting of two parallel walls. This last solution comes from a stochastic approach of the longitudinal dynamics of a particle assumed to be driven by a Langevin equation accounting for bulk diffusion and for the adsorption-desorption rates defined above. It is finally shown how sorption phenomena affect the macroscopic transport properties of neutral tracers in geometries and regimes compatible with water in clay nano-pores. (authors)

Quantitative Determination on Ionic-Liquid-Gating Control of Interfacial Magnetism.

Science.gov (United States)

Zhao, Shishun; Zhou, Ziyao; Peng, Bin; Zhu, Mingmin; Feng, Mengmeng; Yang, Qu; Yan, Yuan; Ren, Wei; Ye, Zuo-Guang; Liu, Yaohua; Liu, Ming

2017-05-01

Ionic-liquid gating on a functional thin film with a low voltage has drawn a lot of attention due to rich chemical, electronic, and magnetic phenomena at the interface. Here, a key challenge in quantitative determination of voltage-controlled magnetic anisotropy (VCMA) in Au/[DEME] + [TFSI] - /Co field-effect transistor heterostructures is addressed. The magnetic anisotropy change as response to the gating voltage is precisely detected by in situ electron spin resonance measurements. A reversible change of magnetic anisotropy up to 219 Oe is achieved with a low gating voltage of 1.5 V at room temperature, corresponding to a record high VCMA coefficient of ≈146 Oe V -1 . Two gating effects, the electrostatic doping and electrochemical reaction, are distinguished at various gating voltage regions, as confirmed by X-ray photoelectron spectroscopy and atomic force microscopy experiments. This work shows a unique ionic-liquid-gating system for strong interfacial magnetoelectric coupling with many practical advantages, paving the way toward ion-liquid-gating spintronic/electronic devices. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Helium Bubbles Cavitation Phenomena in Pb-15.7Li and Potential Impact on Tritium Transport Behaviour in HCLL Breeding Channels

International Nuclear Information System (INIS)

Sedano, L. A.

2007-01-01

COMPU task is devoted to develop a Process Flow Diagram (PFD) modelling tool for DEMO tritium cycle for HCLL and HCPB blanket lines for DEMO. At the actual stage of definition of HCLL blanket design line this global objective requires to progress specifically on the physical reliability of tritium transport assessments at blanket design level. A rough reliability assessment with the identify cation of physical phenomena determining permeation rates into the coolant was tentatively advanced in COMPU Task Deliverable 1. In HCLL design, the tritium diffusion in the alloy under the flow conditions and radiation effects in Pb15.7Li can be theoretically justifies ed as the rate limiting processes for tritium transfer into the coolant. This Deliverable 2 focuses on the analysis of a specific radiation effect: the potential role of helium bubbles in Pb15.7Li, the discussion of its implications on tritium assessment for HCLL design and consequently the analysis of its quantitative impact (as cycle input) on HCLL PFD tritium cycle design. Thus, the contents of this report investigate: (1) the rationality of the consideration on HCLL design of helium bubble cavitation phenomena in irradiated Pb15.7Li channels on the base of fundamental analysis (He solution states in Pb15.7Li) from empirical clues provided by Pb15.7Li irradiation tests, (2) a preliminary rough He-bubble cavitation design assessment and bases for a more precise FEM calculation for helium bubble cavitation phenomena in HCLL blanket channels, (3) the analysis of direct experimental data and numerical developments needed for a precise cavitation assessment and (4) a proposal of the lay-out and general specifications of an integral proof-of-principle Cavitation Experiment (Cevitex) of Helium in Pb15.7Li. (Author) 40 refs

Helium Bubbles Cavitation Phenomena in Pb-15.7Li and Potential Impact on Tritium Transport Behaviour in HCLL Breeding Channels

Energy Technology Data Exchange (ETDEWEB)

Sedano, L. A.

2007-09-27

COMPU task is devoted to develop a Process Flow Diagram (PFD) modelling tool for DEMO tritium cycle for HCLL and HCPB blanket lines for DEMO. At the actual stage of definition of HCLL blanket design line this global objective requires to progress specifically on the physical reliability of tritium transport assessments at blanket design level. A rough reliability assessment with the identify cation of physical phenomena determining permeation rates into the coolant was tentatively advanced in COMPU Task Deliverable 1. In HCLL design, the tritium diffusion in the alloy under the flow conditions and radiation effects in Pb15.7Li can be theoretically justifies ed as the rate limiting processes for tritium transfer into the coolant. This Deliverable 2 focuses on the analysis of a specific radiation effect: the potential role of helium bubbles in Pb15.7Li, the discussion of its implications on tritium assessment for HCLL design and consequently the analysis of its quantitative impact (as cycle input) on HCLL PFD tritium cycle design. Thus, the contents of this report investigate: (1) the rationality of the consideration on HCLL design of helium bubble cavitation phenomena in irradiated Pb15.7Li channels on the base of fundamental analysis (He solution states in Pb15.7Li) from empirical clues provided by Pb15.7Li irradiation tests, (2) a preliminary rough He-bubble cavitation design assessment and bases for a more precise FEM calculation for helium bubble cavitation phenomena in HCLL blanket channels, (3) the analysis of direct experimental data and numerical developments needed for a precise cavitation assessment and (4) a proposal of the lay-out and general specifications of an integral proof-of-principle Cavitation Experiment (Cevitex) of Helium in Pb15.7Li. (Author) 40 refs.

Directing energy transport in organic photovoltaic cells using interfacial exciton gates.

Science.gov (United States)

Menke, S Matthew; Mullenbach, Tyler K; Holmes, Russell J

2015-04-28

Exciton transport in organic semiconductors is a critical, mediating process in many optoelectronic devices. Often, the diffusive and subdiffusive nature of excitons in these systems can limit device performance, motivating the development of strategies to direct exciton transport. In this work, directed exciton transport is achieved with the incorporation of exciton permeable interfaces. These interfaces introduce a symmetry-breaking imbalance in exciton energy transfer, leading to directed motion. Despite their obvious utility for enhanced exciton harvesting in organic photovoltaic cells (OPVs), the emergent properties of these interfaces are as yet uncharacterized. Here, directed exciton transport is conclusively demonstrated in both dilute donor and energy-cascade OPVs where judicious optimization of the interface allows exciton transport to the donor-acceptor heterojunction to occur considerably faster than when relying on simple diffusion. Generalized systems incorporating multiple exciton permeable interfaces are also explored, demonstrating the ability to further harness this phenomenon and expeditiously direct exciton motion, overcoming the diffusive limit.

Electromigration-induced drift in damascene and plasma-etched Al(Cu). II. Mass transport mechanisms in bamboo interconnects

Science.gov (United States)

Proost, Joris; Maex, Karen; Delacy, Luc

2000-01-01

We have discussed electromigration (EM)-induced drift in polycrystalline damascene versus reactive ion etched (RIE) Al(Cu) in part I. For polycrystalline Al(Cu), mass transport is well documented to occur through sequential stages : an incubation period (attributed to Cu depletion beyond a critical length) followed by the Al drift stage. In this work, the drift behavior of bamboo RIE and damascene Al(Cu) is analyzed. Using Blech-type test structures, mass transport in RIE lines was shown to proceed both by lattice and interfacial diffusion. The dominating mechanism depends on the Cu distribution in the line, as was evidenced by comparing as-patterned (lattice EM) and RTP-annealed (interface EM) samples. The interfacial EM only occurs at metallic interfaces. In that case, Cu alloying was observed to retard Al interfacial mass transport, giving rise to an incubation time. Although the activation energy for the incubation time was found similar to the one controlling Al lattice drift, for which no incubation time was observed, lattice EM is preferred over interfacial EM because it is insensitive to enhancing geometrical effects upon scaling. When comparing interfacial electromigration in RIE with bamboo damascene Al(Cu), with the incubation time rate controlling for both, the higher EM threshold observed for damascene was shown to be insufficient to compensate for its significantly increased Cu depletion rate, contrary to the case of polycrystalline Al(Cu) interconnects. Two factors were demonstrated to contribute. First, there are more metallic interfaces, intrinsically related to the use of wetting or barrier layers in recessed features. Second, specific to this study, the additional formation of TiAl3 at the trench sidewalls further enhanced the Cu depletion rate, and reduced the rate-controlling incubation time. A separate drift study on RIE via-type test structures indicated that it is very difficult to suppress interfacial mass transport in favor of lattice EM

Computing optimal interfacial structure of modulated phases

OpenAIRE

Xu, Jie; Wang, Chu; Shi, An-Chang; Zhang, Pingwen

2016-01-01

We propose a general framework of computing interfacial structures between two modulated phases. Specifically we propose to use a computational box consisting of two half spaces, each occupied by a modulated phase with given position and orientation. The boundary conditions and basis functions are chosen to be commensurate with the bulk structures. It is observed that the ordered nature of modulated structures stabilizes the interface, which enables us to obtain optimal interfacial structures...

The influence of interfacial properties on two-phase liquid flow of organic contaminants in groundwater

International Nuclear Information System (INIS)

Hayes, K.F.; Demond, A.H.

1991-09-01

The purpose of this project is to investigate how changes in interfacial chemical properties affect two-phase transport relationships. Specifically, the objective is to develop a quantitative means that will enable the prediction of changes in the capillary pressure-saturation relationship, a fundamental constitutive relationship in multiphase flow, from changes in interfacial properties, such as adsorption and electrophoretic mobility, through a knowledge of their effect on wettability. The information presented here summarizes the progress we have made in the past eight months of the second project period. Working with a system composed of air-water-silica-cetyltrimethylammonium bromide (CTAB), we have obtained a relationship between degree of adsorption and the surface charge of silica (as measured by electrophoretic mobility), and the drainage and imbibition capillary pressure relationships of system. The bulk of this report describes the completed set of measurements for the air-water-silica-CTAB system at pH 6. We are currently working on a comparable set of measurements for the xylene-water-silica-CTAB system at pH 6. Described here are the interfacial tension, contact angle and preliminary drainage capillary pressure measurements. Our work to date shows a dependence of surface properties on pH. Consequently, in the coming year, we will also complete a set of measurements at another pH value to show the effect of pH on capillary pressure relationships

Spin-transport-phenomena in metals, semiconductors, and insulators

Energy Technology Data Exchange (ETDEWEB)

Althammer, Matthias Klaus

2012-07-19

Assuming that one could deterministically inject, transport, manipulate, store and detect spin information in solid state devices, the well-established concepts of charge-based electronics could be transferred to the spin realm. This thesis explores the injection, transport, manipulation and storage of spin information in metallic conductors, semiconductors, as well as electrical insulators. On the one hand, we explore the spin-dependent properties of semiconducting zinc oxide thin films deposited via laser-molecular beam epitaxy (laser-MBE). After demonstrating that the zinc oxide films fabricated during this thesis have excellent structural, electrical, and optical properties, we investigate the spin-related properties by optical pump/probe, electrical injection/optical detection, and all electrical spin valve-based experiments. The two key results from these experiments are: (i) Long-lived spin states with spin dephasing times of 10 ns at 10 K related to donor bound excitons can be optically addressed. (ii) The spin dephasing times relevant for electrical transport-based experiments are {<=} 2 ns at 10 K and are correlated with structural quality. On the other hand we focus on two topics of current scientific interest: the comparison of the magnetoresistance to the magnetothermopower of conducting ferromagnets, and the investigation of pure spin currents generated in ferromagnetic insulator/normal metal hybrid structures. We investigate the magnetoresistance and magnetothermopower of gallium manganese arsenide and Heusler thin films as a function of external magnetic field orientation. Using a series expansion of the resistivity and Seebeck tensors and the inherent symmetry of the sample's crystal structure, we show that a full quantitative extraction of the transport tensors from such experiments is possible. Regarding the spin currents in ferromagnetic insulator/normal metal hybrid structures we studied the spin mixing conductance in yttrium iron garnet

Transport phenomena in the edge of Alcator C-Mod plasmas

International Nuclear Information System (INIS)

Terry, J.L.; Basse, N.P.; Cziegler, I.; Greenwald, M.; LaBombard, B.; Edlund, E.M.; Hughes, J.W.; Lin, L.; Lin, Y.; Porkolab, M.; Veto, B.; Wukitch, S.J.; Grulke, O.; Zweben, S.J.; Sampsell, M.

2005-01-01

Two aspects of edge turbulence and transport in Alcator C-Mod are explored. The quasi-coherent mode, an edge fluctuation present in Enhanced Da H-mode plasmas, is examined with regard to its role in the enhanced particle transport found in these plasmas, its in/out asymmetry, its poloidal wave number, and its radial width and location. It is shown to play a dominant role in the perpendicular particle transport. The QCM is not observed at the inboard midplane, indicating that its amplitude there is significantly smaller than on the outboard side. The peak amplitude of the QCM is found just inside the separatrix, with a radial width ≥5 mm, leading to a non-zero amplitude outside the separatrix and qualitatively consistent with its transport enhancement. Also examined are the characteristics of the intermittent convective transport, associated with 'blobs' and typically occurring in the scrape-off-layer. The blobs are qualitatively similar in L- and H-mode. When their sizes, occurrence frequencies, and magnitudes are compared, it is found that the blob size may be somewhat smaller in ELMfree H-Mode, and blob frequency is similar. A clear difference is seen in the blob magnitude in the far SOL, with ELMfree H-mode showing a smaller perturbation there than L-mode. As the Greenwald density limit is approached (n/n GW ≥0.7), blobs are seen inside the separatrix, consistent with the observation that the high cross-field transport region, normally found in the far scrape-off, penetrates the closed flux surfaces at high n/n GW . (author)

Modeling diffusion-governed solidification of ternary alloys - Part 2: Macroscopic transport phenomena and macrosegregation.

Science.gov (United States)

Wu, M; Li, J; Ludwig, A; Kharicha, A

2014-09-01

Part 1 of this two-part investigation presented a multiphase solidification model incorporating the finite diffusion kinetics and ternary phase diagram with the macroscopic transport phenomena (Wu et al., 2013). In Part 2, the importance of proper treatment of the finite diffusion kinetics in the calculation of macrosegregation is addressed. Calculations for a two-dimensional (2D) square casting (50 × 50 mm 2 ) of Fe-0.45 wt.%C-1.06 wt.%Mn considering thermo-solutal convection and crystal sedimentation are performed. The modeling result indicates that the infinite liquid mixing kinetics as assumed by classical models (e.g., the Gulliver-Scheil or lever rule), which cannot properly consider the solute enrichment of the interdendritic or inter-granular melt at the early stage of solidification, might lead to an erroneous estimation of the macrosegregation. To confirm this statement, further theoretical and experimental evaluations are desired. The pattern and intensity of the flow and crystal sedimentation are dependent on the crystal morphologies (columnar or equiaxed); hence, the potential error of the calculated macrosegregation caused by the assumed growth kinetics depends on the crystal morphology. Finally, an illustrative simulation of an engineering 2.45-ton steel ingot is performed, and the results are compared with experimental results. This example demonstrates the model applicability for engineering castings regarding both the calculation efficiency and functionality.

An Equation-Type Approach for the Numerical Solution of the Partial Differential Equations Governing Transport Phenomena in Porous Media

KAUST Repository

Sun, Shuyu

2012-06-02

A new technique for the numerical solution of the partial differential equations governing transport phenomena in porous media is introduced. In this technique, the governing equations as depicted from the physics of the problem are used without extra manipulations. In other words, there is no need to reduce the number of governing equations by some sort of mathematical manipulations. This technique enables the separation of the physics part of the problem and the solver part, which makes coding more robust and could be used in several other applications with little or no modifications (e.g., multi-phase flow in porous media). In this method, one abandons the need to construct the coefficient matrix for the pressure equation. Alternatively, the coefficients are automatically generated within the solver routine. We show examples of using this technique to solving several flow problems in porous media.

An Equation-Type Approach for the Numerical Solution of the Partial Differential Equations Governing Transport Phenomena in Porous Media

KAUST Repository

Sun, Shuyu; Salama, Amgad; El-Amin, Mohamed

2012-01-01

A new technique for the numerical solution of the partial differential equations governing transport phenomena in porous media is introduced. In this technique, the governing equations as depicted from the physics of the problem are used without extra manipulations. In other words, there is no need to reduce the number of governing equations by some sort of mathematical manipulations. This technique enables the separation of the physics part of the problem and the solver part, which makes coding more robust and could be used in several other applications with little or no modifications (e.g., multi-phase flow in porous media). In this method, one abandons the need to construct the coefficient matrix for the pressure equation. Alternatively, the coefficients are automatically generated within the solver routine. We show examples of using this technique to solving several flow problems in porous media.

Experimental transport phenomena and optimization strategies for thermoelectrics

Energy Technology Data Exchange (ETDEWEB)

Ehrlich, A C; Gillespie, D J

1997-07-01

When a new and promising thermoelectric material is discovered, an effort is undertaken to improve its figure of merit. If the effort is to be more efficient than one of trial and error with perhaps some rule of thumb guidance then it is important to be able to make the connection between experimental data and the underlying material characteristics, electronic and phononic, that influence the figure of merit. Transport and fermiology experimental data can be used to evaluate these material characteristics and thus establish trends as a function of some controllable parameter, such as composition. In this paper some of the generic-materials characteristics, generally believed to be required for a high figure of merit, will be discussed in terms of the experimental approach to their evaluation and optimization. Transport and fermiology experiments will be emphasized and both will be outlined in what they can reveal and what can be obscured by the simplifying assumptions generally used in their interpretation.

Interfacial Shear Strength and Adhesive Behavior of Silk Ionomer Surfaces.

Science.gov (United States)

Kim, Sunghan; Geryak, Ren D; Zhang, Shuaidi; Ma, Ruilong; Calabrese, Rossella; Kaplan, David L; Tsukruk, Vladimir V

2017-09-11

The interfacial shear strength between different layers in multilayered structures of layer-by-layer (LbL) microcapsules is a crucial mechanical property to ensure their robustness. In this work, we investigated the interfacial shear strength of modified silk fibroin ionomers utilized in LbL shells, an ionic-cationic pair with complementary ionic pairing, (SF)-poly-l-glutamic acid (Glu) and SF-poly-l-lysine (Lys), and a complementary pair with partially screened Coulombic interactions due to the presence of poly(ethylene glycol) (PEG) segments and SF-Glu/SF-Lys[PEG] pair. Shearing and adhesive behavior between these silk ionomer surfaces in the swollen state were probed at different spatial scales and pressure ranges by using functionalized atomic force microscopy (AFM) tips as well as functionalized colloidal probes. The results show that both approaches were consistent in analyzing the interfacial shear strength of LbL silk ionomers at different spatial scales from a nanoscale to a fraction of a micron. Surprisingly, the interfacial shear strength between SF-Glu and SF-Lys[PEG] pair with partially screened ionic pairing was greater than the interfacial shear strength of the SF-Glu and SF-Lys pair with a high density of complementary ionic groups. The difference in interfacial shear strength and adhesive strength is suggested to be predominantly facilitated by the interlayer hydrogen bonding of complementary amino acids and overlap of highly swollen PEG segments.

Curvature dependence of the electrolytic liquid-liquid interfacial tension

NARCIS (Netherlands)

Bier, Markus; de Graaf, J.; Zwanikken, J.W.; van Roij, R.H.H.G.

2009-01-01

The interfacial tension of a liquid droplet surrounded by another liquid in the presence of microscopic ions is studied as a function of the droplet radius. An analytical expression for the interfacial tension is obtained within a linear Poisson–Boltzmann theory and compared with numerical results

Interfacial stresses in strengthened beam with shear cohesive zone ...

Indian Academy of Sciences (India)

The results of parametric study are compared with those of Smith and Teng. They confirm the accuracy of the proposed approach in predicting both interfacial shear and normal stresses. Keywords. Strengthened beam; interfacial stresses; cohesive zone; shear deformation. 1. Introduction. The FRP plates can be either ...

Interfacial shear behavior of composite flanged concrete beams

Directory of Open Access Journals (Sweden)

Moataz Awry Mahmoud

2014-08-01

Full Text Available Composite concrete decks are commonly used in the construction of highway bridges due to their rapid constructability. The interfacial shear transfer between the top slab and the supporting beams is of great significance to the overall deck load carrying capacity and performance. Interfacial shear capacity is directly influenced by the distribution and the percentage of shear connectors. Research and design guidelines suggest the use of two different approaches to quantify the required interfacial shear strength, namely based on the maximum compressive forces in the flange at mid span or the maximum shear flow at the supports. This paper investigates the performance of flanged reinforced concrete composite beams with different shear connector’s distribution and reinforcing ratios. The study incorporated both experimental and analytical programs for beams. Key experimental findings suggest that concentrating the connectors at the vicinity of the supports enhances the ductility of the beam. The paper proposes a simple and straight forward approach to estimate the interfacial shear capacity that was proven to give good correlation with the experimental results and selected code provisions. The paper presents a method to predict the horizontal shear force between precast beams and cast in-situ slabs.

Liquid-liquid interfacial tension of electrolyte solutions

OpenAIRE

Bier, Markus; Zwanikken, Jos; van Roij, Rene

2008-01-01

It is theoretically shown that the excess liquid-liquid interfacial tension between two electrolyte solutions as a function of the ionic strength I behaves asymptotically as O(- I^0.5) for small I and as O(+- I) for large I. The former regime is dominated by the electrostatic potential due to an unequal partitioning of ions between the two liquids whereas the latter regime is related to a finite interfacial thickness. The crossover between the two asymptotic regimes depends sensitively on mat...

Cold welding of organic light emitting diode: Interfacial and contact models

Directory of Open Access Journals (Sweden)

J. Asare

2016-06-01

Full Text Available This paper presents the results of an analytical and computational study of the contacts and interfacial fracture associated with the cold welding of Organic Light Emitting diodes (OLEDs. The effects of impurities (within the possible interfaces are explored for contacts and interfacial fracture between layers that are relevant to model OLEDs. The models are used to study the effects of adhesion, pressure, thin film layer thickness and dust particle modulus (between the contacting surfaces on contact profiles around impurities between cold-welded thin films. The lift-off stage of thin films (during cold welding is then modeled as an interfacial fracture process. A combination of adhesion and interfacial fracture theories is used to provide new insights for the design of improved contact and interfacial separation during cold welding. The implications of the results are discussed for the design and fabrication of cold welded OLED structures.

Small scale laboratory studies of flow and transport phenomena in pores and fractures: Phase II. Progress report, 3rd year continuation proposal, and work plan

Energy Technology Data Exchange (ETDEWEB)

Wilson, J.L.

1994-05-01

Small scale laboratory experiments, equipped with an ability to actually observe behavior on the pore level using microscopy, provide an economical and easily understood scientific tool to help us validate concepts and assumptions about the transport of contaminants, and offers the propensity to discover heretofore unrecognized phenomena or behavior. The main technique employs etched glass micromodels, composed of two etched glass plates, sintered together, to form a two dimensional network of three dimensional pores. Flow and transport behavior is observed on a pore or pore network level, and recorder on film and video tape. This technique is coupled with related column studies. These techniques have been used to study multiphase flow, colloid transport and most recently bacteria transport. The project has recently moved to the Bacteria Transport Subprogram, and efforts have been redirected to support that Subprogram and its collaborative field experiment. We proposed to study bacteria transport factors of relevance to the field experiment, using micromodels and other laboratory techniques. Factors that may be addressed include bacteria characteristics (eg, hydrophobicity), pore size and shape, permeability heterogeneity, surface chemistry (eg, iron oxide coatings), surface chemistry heterogeneity, active versus resting cell bacteria, and mixed bacteria populations. In other work we will continue to examine the effects of fluid-fluid interfaces on bacteria transport, and develop a new assay for bacteria hydrophobicity. Finally we will collaborate on characterization of the field site, and the design, operation, and interpretation of the field experiment.

Magneto-transport phenomena in metal/SiO2/n(p)-Si hybrid structures

Science.gov (United States)

Volkov, N. V.; Tarasov, A. S.; Rautskii, M. V.; Lukyanenko, A. V.; Bondarev, I. A.; Varnakov, S. N.; Ovchinnikov, S. G.

2018-04-01

Present review touches upon a subject of magnetotransport phenomena in hybrid structures which consist of ferromagnetic or nonmagnetic metal layer, layer of silicon oxide and silicon substrate with n- or p-type conductivity. Main attention will be paid to a number gigantic magnetotransport effects discovered in the devices fabricated on the base of the M/SiO2/n(p)-Si (M is ferromagnetic or paramagnetic metal) hybrid structures. These effects include bias induced dc magnetoresistance, gigantic magnetoimpedance, dc magnetoresistance induced by an optical irradiation and lateral magneto-photo-voltaic effect. The magnetoresistance ratio in ac and dc modes for some of our devices can exceed 106% in a magnetic field below 1 T. For lateral magneto-photo-voltaic effect, the relative change of photo-voltage in magnetic field can reach 103% at low temperature. Two types of mechanisms are responsible for sensitivity of the transport properties of the silicon based hybrid structures to magnetic field. One is related to transformation of the energy structure of the (donor) acceptor states including states near SiO2/n(p)-Si interface in magnetic field. Other mechanism is caused by the Lorentz force action. The features in behaviour of magnetotransport effects in concrete device depend on composition of the used structure, device topology and experimental conditions (bias voltage, optical radiation and others). Obtained results can be base for design of some electronic devices driven by a magnetic field. They can also provide an enhancement of the functionality for existing sensors.

Thermochemical conversion of biomass in smouldering combustion across scales: The roles of heterogeneous kinetics, oxygen and transport phenomena.

Science.gov (United States)

Huang, Xinyan; Rein, Guillermo

2016-05-01

The thermochemical conversion of biomass in smouldering combustion is investigated here by combining experiments and modeling at two scales: matter (1mg) and bench (100g) scales. Emphasis is put on the effect of oxygen (0-33vol.%) and oxidation reactions because these are poorly studied in the literature in comparison to pyrolysis. The results are obtained for peat as a representative biomass for which there is high-quality experimental data published previously. Three kinetic schemes are explored, including various steps of drying, pyrolysis and oxidation. The kinetic parameters are found using the Kissinger-Genetic Algorithm method, and then implemented in a one-dimensional model of heat and mass transfer. The predictions are validated with thermogravimetric and bench-scale experiments and then analyzed to unravel the role of heterogeneous reaction. This is the first time that the influence of oxygen on biomass smouldering is explained in terms of both chemistry and transport phenomena across scales. Copyright © 2016 The Authors. Published by Elsevier Ltd.. All rights reserved.

Investigation of the Mesoporous Metal-Organic Framework as a New Platform To Study the Transport Phenomena of Biomolecules.

Science.gov (United States)

Chen, Yao; Hong, Seongmin; Fu, Chung-Wei; Hoang, Tran; Li, Xiao; Valencia, Veronica; Zhang, Zhenjie; Perman, Jason A; Ma, Shengqian

2017-03-29

Mesoporous materials, Tb-mesoMOF and MCM-41, were used to study the transport phenomena of biomolecules entering the interior pores from solution. Vitamins B 12 and B 2 were successfully encapsulated into these mesoporous materials, whereas Tb-mesoMOF (0.33 g of B 12 /g, 0.01 g of B 2 /g) adsorbed a higher amount of vitamin per mass than MCM-41 (0.21 g of B 12 /g, 0.002 g of B 2 /g). The diffusion mechanism of the biomolecules entering Tb-mesoMOF was evaluated using a mathematical model. The Raman spectroscopy studies showed vitamin B 12 has been encapsulated within Tb-mesoMOF's pores, and evaluation of the peak shifts indicated strong interactions linking vitamin B 12 's pyrroline moiety with Tb-mesoMOF's triazine and benzoate rings. Because of these stronger interactions between the vitamins and Tb-mesoMOF, longer egress times were observed than with MCM-41.

Interfacial compatibility of polymer-based structures in electronics

OpenAIRE

Turunen, Markus P. K.

2004-01-01

Interfacial compatibility of dissimilar materials was investigated to achieve a better understanding of interfacial adhesion in metal/polymer/metal systems. Surface modifications of polymers were applied to improve the adhesion. The modified surfaces were characterised by scanning electron microscopy (SEM), atomic force microscopy (AFM), X-ray photoelectron spectroscopy (XPS) and contact angle measurements accompanied by surface free energy evaluations. The pull-off test was employed to asses...

Interfacial Properties of CZTS Thin Film Solar Cell

Directory of Open Access Journals (Sweden)

N. Muhunthan

2014-01-01

Full Text Available Cu-deficient CZTS (copper zinc tin sulfide thin films were grown on soda lime as well as molybdenum coated soda lime glass by reactive cosputtering. Polycrystalline CZTS film with kesterite structure was produced by annealing it at 500°C in Ar atmosphere. These films were characterized for compositional, structural, surface morphological, optical, and transport properties using energy dispersive X-ray analysis, glancing incidence X-ray diffraction, Raman spectroscopy, scanning electron microscopy, atomic force microscopy, UV-Vis spectroscopy, and Hall effect measurement. A CZTS solar cell device having conversion efficiency of ~0.11% has been made by depositing CdS, ZnO, ITO, and Al layers over the CZTS thin film deposited on Mo coated soda lime glass. The series resistance of the device was very high. The interfacial properties of device were characterized by cross-sectional SEM and cross-sectional HRTEM.

Required Equipment for Photo-Switchable Donor-Acceptor (D-A) Dyad Interfacial Self-Assembled Monolayers for Organic Photovoltaic Cells

Science.gov (United States)

2014-01-24

Interfacial Tuning via Electron-Blocking/Hole-Transport Layers and Indium Tin Oxide Surface Treatment in Bulk- Heterojunction Organic Photovoltaic Cells...devices Figure 3 shows the compounds we prepared to assemble on gold (Au) surfaces. Results of TPA-C60 dyads (1 and 2) self-assembled on Au electrodes...surface hydroxyl groups, respectively, we decided to prepare compounds 5-7 to attach as SAMs, see Figure 5. Difficulties and unexpected problems

Interfacial Micromechanics in Fibrous Composites: Design, Evaluation, and Models

Science.gov (United States)

Lei, Zhenkun; Li, Xuan; Qin, Fuyong; Qiu, Wei

2014-01-01

Recent advances of interfacial micromechanics in fiber reinforced composites using micro-Raman spectroscopy are given. The faced mechanical problems for interface design in fibrous composites are elaborated from three optimization ways: material, interface, and computation. Some reasons are depicted that the interfacial evaluation methods are difficult to guarantee the integrity, repeatability, and consistency. Micro-Raman study on the fiber interface failure behavior and the main interface mechanical problems in fibrous composites are summarized, including interfacial stress transfer, strength criterion of interface debonding and failure, fiber bridging, frictional slip, slip transition, and friction reloading. The theoretical models of above interface mechanical problems are given. PMID:24977189

Temperature and compositional dependence of solid-liquid interfacial energy: application of the Cahn-Hilliard theory

International Nuclear Information System (INIS)

Shimizu, I.; Takei, Y.

2005-01-01

A simple thermodynamic method to estimate the solid-liquid interfacial energy (or interfacial tension) is proposed, based on the Cahn-Hilliard theory. In the model, the liquid is treated as a regular solution, and the interfacial layers are assumed to have liquid-like thermodynamic properties. In eutectic systems, interfacial adsorption occurs within a few atomic layers, and interfacial energy monotonously increases with decreasing concentration of the solid species in the liquid phase. If non-ideal atomic interaction is strong and the liquid immiscibility region appears in the phase diagrams (this is the case of monotectic systems), the interfacial thickness drastically increases and the interfacial energy is reduced around the immiscibility gap

Transport phenomena of macro and micro flows behind orifice and flow accelerated corrosion

International Nuclear Information System (INIS)

Fujisawa, Nobuyuki; Hayase, Toshiyuki; Ohara, Taku; Ikohagi, Toshiaki

2008-01-01

This paper describes experiment and numerical simulations for macro and micro flows behind an orifice model in a square pipe, which are carried from the viewpoint of flow accelerated corrosion (FAC). The measurements of velocity field behind the orifice model were carried out using particle image velocimetry, and the variations of velocity field with respect to the accuracy of the orifice position were studied. It is found that the reattachment behavior of the flow is highly influenced by the orifice position, which is a critical problem for predicting the pipe thinning phenomena by FAC. The DNS simulation was also conducted for calculating the macro flow behind the orifice. The result suggests that the DNS simulation is applicable to the prediction of pipe thinning macro flow for highly aged nuclear plant. The micro flow simulation can predict the pipe thinning phenomena near the wall. (author)

Interfacial Area and Interfacial Transfer in Two-Phase Flow Systems (Volume I. Chapters 1-5)

Energy Technology Data Exchange (ETDEWEB)

Guo, T.; Park, J.; Kojasoy, G.

2003-03-15

Experiments were performed on horizontal air-water bubbly two-phase flow, axial flow, stratified wavy flow, and annular flow. Theoretical studies were also undertaken on interfacial parameters for a horizontal two-phase flow.

Interfacial Area and Interfacial Transfer in Two-Phase Flow Systems (Volume IV. Chapters 15-19)

Energy Technology Data Exchange (ETDEWEB)

Guo, T.; Park, J.; Kojasoy, G.

2003-03-15

Experiments were performed on horizontal air-water bubbly two-phase flow, axial flow, stratified wavy flow, and annular flow. Theoretical studies were also undertaken on interfacial parameters for a horizontal two-phase flow.

Interfacial Area and Interfacial Transfer in Two-Phase Flow Systems (Volume II. Chapters 6-10)

Energy Technology Data Exchange (ETDEWEB)

Guo, T.; Park, J.; Kojasoy, G.

2003-03-15

Experiments were performed on horizontal air-water bubbly two-phase flow, axial flow, stratified wavy flow, and annular flow. Theoretical studies were also undertaken on interfacial parameters for a horizontal two-phase flow.

Interfacial Area and Interfacial Transfer in Two-Phase Flow Systems (Volume III. Chapters 11-14)

Energy Technology Data Exchange (ETDEWEB)

Guo, T.; Park, J.; Kojasoy, G.

2003-03-15

Experiments were performed on horizontal air-water bubbly two-phase flow, axial flow, stratified wavy flow, and annular flow. Theoretical studies were also undertaken on interfacial parameters for a horizontal two-phase flow.

Molecular dynamics study on interfacial thermal conductance of unirradiated and irradiated SiC/C

International Nuclear Information System (INIS)

Wang, Qingyu; Wang, Chenglong; Zhang, Yue; Li, Taosheng

2014-01-01

SiC f /SiC composite materials have been considered as candidate structural materials for several types of advanced nuclear reactors. Both experimental and computer simulations studies have revealed the degradation of thermal conductivity for this material after irradiation. The objective of this study is to investigate the effect of SiC/graphite interface structure and irradiation on the interfacial thermal conductance by using molecular dynamics simulation. Five SiC/graphite composite models were created with different interface structures, and irradiation was introduced near the interfaces. Thermal conductance was calculated by means of reverse-NEMD method. Results show that there is a positive correlation between the interfacial energy and interfacial C–Si bond quantity, and irradiated models showed higher interfacial energy compared with their unirradiated counterparts. Except the model with graphite atom plane parallel to the interface, the interfacial thermal conductance of unirradiated and irradiated (1000 eV) models, increases as the increase of interfacial energy, respectively. For all irradiated models, lattice defects are of importance in impacting the interfacial thermal conductance depending on the interface structure. For the model with graphite layer parallel to the interface, the interfacial thermal conductance increased after irradiation, for the other models the interfacial thermal conductance decreased. The vibrational density of states of atoms in the interfacial region was calculated to analyze the phonon mismatch at the interface

Two-relaxation-time lattice Boltzmann method and its application to advective-diffusive-reactive transport

Science.gov (United States)

Yan, Zhifeng; Yang, Xiaofan; Li, Siliang; Hilpert, Markus

2017-11-01

The lattice Boltzmann method (LBM) based on single-relaxation-time (SRT) or multiple-relaxation-time (MRT) collision operators is widely used in simulating flow and transport phenomena. The LBM based on two-relaxation-time (TRT) collision operators possesses strengths from the SRT and MRT LBMs, such as its simple implementation and good numerical stability, although tedious mathematical derivations and presentations of the TRT LBM hinder its application to a broad range of flow and transport phenomena. This paper describes the TRT LBM clearly and provides a pseudocode for easy implementation. Various transport phenomena were simulated using the TRT LBM to illustrate its applications in subsurface environments. These phenomena include advection-diffusion in uniform flow, Taylor dispersion in a pipe, solute transport in a packed column, reactive transport in uniform flow, and bacterial chemotaxis in porous media. The TRT LBM demonstrated good numerical performance in terms of accuracy and stability in predicting these transport phenomena. Therefore, the TRT LBM is a powerful tool to simulate various geophysical and biogeochemical processes in subsurface environments.

Tuning the Interfacial Mechanical Behaviors of Monolayer Graphene/PMMA Nanocomposites.

Science.gov (United States)

Wang, Guorui; Dai, Zhaohe; Liu, Luqi; Hu, Hai; Dai, Qing; Zhang, Zhong

2016-08-31

The van der Waals (vdW) force dominated interface between graphene and polymer matrix creates weak points in the mechanical sense. Chemical functionalization was expected to be an effective approach in transfer of the outstanding performance of graphene across multiple length scales up to the macroscopic level, due to possible improvements in the interfacial adhesion. However, published works showed the contradiction that improvements, insensitivity, or even worsening of macro-mechanical performance have all been reported in graphene-based polymer nanocomposites. Particularly central cause of such discrepancy is the variations in graphene/polymer interfacial chemistry, which is critical in nanocomposites with vast interfacial area. Herein, O3/H2O gaseous mixture was utilized to oxidize monolayer graphene sheet with controlled functionalization degrees. Hydrogen bonds (H bonds) are expected to form between oxidized graphene sheet/poly(methyl methacrylate) (PMMA) at the interface. On the basis of in situ tensile-micro Raman spectroscopy, the impacts of bonding types (vdW and H-bonds) on both key interfacial parameters (such as interfacial shear strength and critical length) and failure modes of graphene/PMMA nanocomposite were clarified for the first time at the microscopic level. Our results show that owing to improved interfacial interaction via H bonds, the interface tends to be stiffening and strengthening. Moreover, the mechanical properties of the functionalized graphene/PMMA interface will be set by the competition between the enhanced interfacial adhesion and the degraded elastic modulus of graphene, which was caused by structural defects in the graphene sheet during the functionalization process and could lead to catastrophic failure of graphene sheets in our experimental observation. Our results will be helpful to design various nanofiller-based nanocomposites with high mechanical performance.

Electron heat transport studies using transient phenomena in ASDEX Upgrade

International Nuclear Information System (INIS)

Jacchia, A.; Angioni, C.; Manini, A.; Ryter, F.; Apostoliceanu, M.; Conway, G.; Fahrbach, H.-U.; Kirov, K.K.; Leuterer, F.; Reich, M.; Sutttrop, W.; Cirant, S.; Mantica, P.; De Luca, F.; Weiland, J.

2005-01-01

Experiments in tokamaks suggest that a critical gradient length may cause the resilient behavior of T e profiles, in the absence of ITBs. This agrees in general with ITG/TEM turbulence physics. Experiments in ASDEX Upgrade using modulation techniques with ECH and/or cold pulses demonstrate the existence of a threshold in R/L Te when T e >T i and T e ≤T i . For T e >T i linear stability analyses indicate that electron heat transport is dominated by TEM modes. They agree in the value of the threshold (both T e and n e ) and for the electron heat transport increase above the threshold. The stabilization of TEM modes by collisions yielded by gyro-kinetic calculations, which suggests a transition from TEM to ITG dominated transport at high collisionality, is experimentally demonstrated by comparing heat pulse and steady-state diffusivities. For the T e ∼T i discharges above the threshold the resilience, normalized by T e 3/2 , is similar to that of the TEM dominated cases, despite very different conditions. The heat pinch predicted by fluid modeling of ITG/TEM turbulence is investigated by perturbative transport in off-axis ECH-heated discharges. (author)

Interfacial behavior of alkaline protease at the air-water and oil-water interfaces

Science.gov (United States)

Zhang, Jian; Li, Yanyan; Wang, Jing; Zhang, Yue

2018-03-01

The interfacial behavior of alkaline protease at the air-water and n-hexane-water interfaces was investigated using interfacial tension, dilatational rheology and dynamic light scattering. Additionally, different adsorption models which are Langmuir, Frumkin, Reorientation-A and Reorientation-R were used to fitting the data of equilibrium interfacial tension for further understanding the interfacial behavior of alkaline protease. Data fitting of the equilibrium interfacial tension was achieved by IsoFit software. The results show that the molecules arrangement of the alkaline protease at the n-hexane-water interface is more tightly than at the air-water interface. The data were further analyzed to indicate that the hydrophobic chains of alkaline protease penetrate into oil phase deeper than the air phase. Also data indicate that the electrostatic interactions and hydrophobic interactions at the n-hexane-water interface are stronger than at the air-water interface within molecules of the alkaline protease. Based on comprehensive analysis of the adsorption kinetics and interfacial rheological properties, interfacial structures mechanism of alkaline protease at n-hexane-water and air-water interfaces was proposed.

On the inclusion of the interfacial area between phases in the physical and mathematical description of subsurface multiphase flow. 1998 annual progress report

International Nuclear Information System (INIS)

Gray, W.G.; Soll, W.E.; Tompson, A.

1998-01-01

'Improved capabilities for modeling multiphase flow in the subsurface requires that several aspects of the system which impact the flow and transport processes be more properly accounted for. A distinguishing feature of multiphase flow in comparison to single phase flow is the existence of interfaces between fluids. At the microscopic (pore) scale, these interfaces are known to influence system behavior by supporting non-zero stresses such that the pressures in adjacent phases are not equal. In problems of interphase transport at the macroscopic (core) scale, knowledge of the total amount of interfacial area in the system provides a clue to the effectiveness of the communication between phases. Although interfacial processes are central to multiphase flow physics, their treatment in traditional porous-media theories has been implicit rather than explicit; and no attempts have been made to systematically account for the evolution of the interfacial area in dynamic systems or to include the dependence of constitutive functions, such as capillary pressure, on the interfacial area. This project implements a three-pronged approach to assessing the importance of various features of multiphase flow to its description. The research contributes to the improved understanding and precise physical description of multiphase subsurface flow by combining: (1) theoretical derivation of equations, (2) lattice Boltzmann modeling of hydrodynamics to identify characteristics and parameters, and (3) solution of the field-scale equations using a discrete numerical method to assess the advantages and disadvantages of the complete theory. This approach includes both fundamental scientific inquiry and a path for inclusion of the scientific results obtained in a technical tool that will improve assessment capabilities for multiphase flow situations that have arisen due to the introduction of organic materials in the natural environment. This report summarizes work after 1.5 years of a 3

Determination of Interfacial Area in Gas-Liquid Two Phase by Light Transmission

International Nuclear Information System (INIS)

Ghiasi, H.; Safekordi, A. A.; Babazadeh Shareh, F.

2012-01-01

The purpose of the present paper is to develop light beam method to measurement of interfacial area in a rectangular gas-liquid bubble column. Total interfacial area can be determined in bubble column filled by transparent liquid by light transmission method. According to pervious researches, the fraction of parallel light is function of interfacial area and optical path length that these two parameters imply Transmission Number or N T . The drop diameters were measured in the range of 2.2 to 5 mm, and in this range, the specific area is found to depend only upon the light transmission. Three different systems with various liquid phases have been used in this work. It had been proved that light transmission method for dilute suspension or stationary gas phase has a good consequence. In this work, good agreement between actual and calculated interfacial area proves that light transmission method would be able to determine interfacial area in multiple scattering, and it is possible to use earlier mathematic model to measure interfacial area in multiple scattering in gas-liquid bubble columns.

Center for low-gravity fluid mechanics and transport phenomena

Science.gov (United States)

Kassoy, D. R.; Sani, R. L.

1991-01-01

Research projects in several areas are discussed. Mass transport in vapor phase systems, droplet collisions and coalescence in microgravity, and rapid solidification of undercooled melts are discussed.

Interfacial stabilities of high-temperature composite materials

International Nuclear Information System (INIS)

Chang, Y.A.; DeKock, J.; Zhang, M.X.; Kieschke, R.

1993-01-01

The thermodynamic and kinetic principles necessary to control interfacial reactions between the matrix and reinforcement in composite materials are presented. The concept of interfacial control has been applied to Ti-based/Al 2 O 3 composite. Results are presented which include estimated diffusivities for the reaction in β-Ti/Al 2 O 3 composites, estimated phase relationships for the systems Ti-Al-O, Ti-Y-O, Nb-Y-O and Nb-Al-O at 1100 C, and a coating scheme for αAl 2 O 3 fibers. 71 refs

Interfacial Properties of EXXPRO(TM) and General Purpose Elastomers

Science.gov (United States)

Zhang, Y.; Rafailovich, M.; Sokolov, Jon; Qu, S.; Ge, S.; Ngyuen, D.; Li, Z.; Peiffer, D.; Song, L.; Dias, J. A.; McElrath, K. O.

1998-03-01

EXXPRO(Trademark) elastomers are used for tires and many other applications. This elastomer (denoted as BIMS) is a random copolymer of p-methylstyrene (MS) and polyisobutylene (I) with varying degrees of PMS content and bromination (B) on the p-methyl group. BIMS is impermeable to gases, and has good heat, ozone and flex resistance. Very often general purpose elastomers are blended with BIMS. The interfacial width between polybutadiene and BIMS is a sensitive function of the Br level and PMS content. By neutron reflectivity (NR), we studied the dynamics of interface formation as a function of time and temperature for BIMS with varying degrees of PMS and Br. We found that in addition to the bulk parameters, the total film thickness and the proximity of an interactive surface can affect the interfacial interaction rates. The interfacial properties can also be modified by inclusion of particles, such as carbon black (a filler component in tire rubbers). Results will be presented on the relation between the interfacial width as measured by NR and compatibilization studies via AFM and LFM.

Transport phenomena in sharply contrasting media with a diffusion barrier

International Nuclear Information System (INIS)

Dvoretskaya, O A; Kondratenko, P S

2011-01-01

Using the advection–diffusion equation, we analytically study contaminant transport in a sharply contrasting medium with a diffusion barrier due to localization of a contaminant source in a low-permeability medium. Anomalous diffusion behavior and a crossover between different transport regimes are observed. The diffusion barrier results in exponential attenuation of the source power, retardation of the contaminant plume growth and modification of the concentration distribution at large distances. (paper)

DNA Nanotechnology-Enabled Interfacial Engineering for Biosensor Development.

Science.gov (United States)

Ye, Dekai; Zuo, Xiaolei; Fan, Chunhai

2018-06-12

Biosensors represent biomimetic analytical tools for addressing increasing needs in medical diagnosis, environmental monitoring, security, and biodefense. Nevertheless, widespread real-world applications of biosensors remain challenging due to limitations of performance, including sensitivity, specificity, speed, and reproducibility. In this review, we present a DNA nanotechnology-enabled interfacial engineering approach for improving the performance of biosensors. We first introduce the main challenges of the biosensing interfaces, especially under the context of controlling the DNA interfacial assembly. We then summarize recent progress in DNA nanotechnology and efforts to harness DNA nanostructures to engineer various biological interfaces, with a particular focus on the use of framework nucleic acids. We also discuss the implementation of biosensors to detect physiologically relevant nucleic acids, proteins, small molecules, ions, and other biomarkers. This review highlights promising applications of DNA nanotechnology in interfacial engineering for biosensors and related areas.

Interfacial trap states in junctions of molecular semiconductors

International Nuclear Information System (INIS)

Schlettwein, D.; Oekermann, T.; Jaeger, N.; Armstrong, N.R.; Woehrle, D.

2002-01-01

Interfacial states that were established in contacts of molecular semiconductors with aqueous electrolytes or in contacts with another organic semiconductor as a solid film were analyzed by photoelectrochemical experiments and by photoelectron spectroscopy. A crucial role of such states was indicated in the interfacial charge transfer and recombination kinetics of light-induced charge carriers and also in the energetic alignment in the solid contacts. Unsubstituted zinc-phthalocyanine (PcZn) served as model compound. The role of chemical interactions in the establishment of these interfacial states was investigated by use of different reaction partners, i.e., different redox couples in the electrolyte contacts and molecular semiconductors of different ionization potential in the solid contacts. Implications of these results for the use of organic semiconductor thin films in devices of molecular electronics and of dye molecules in dye-sensitized solar cells were also discussed

Studies of local degradation phenomena in composite cathodes for lithium-ion batteries

International Nuclear Information System (INIS)

Kerlau, Marie; Marcinek, Marek; Srinivasan, Venkat; Kostecki, Robert M.

2007-01-01

LiNi 0.8 Co 0.15 Al 0.05 O 2 and LiNi 1/3 Co 1/3 Mn 1/3 O 2 composite cathodes were cycled in model cells to study interfacial phenomena that could lead to electrode degradation. Ex situ spectroscopic analysis of the tested cathodes, which suffered substantial power and capacity loss, showed that the state of charge (SOC) of oxide particles on the cathode surface was highly non-uniform despite the deep discharge of the Li-ion cell at the end of the test. The inconsistent kinetic behavior of individual oxide particles was attributed to the degradation of electronic pathways within the composite cathodes. A simple theoretical model based on a distributed network showed that an increase of the contact resistance between composite electrode particles may be responsible for non-uniform local kinetic behavior of individual oxide particles and the overall degradation of electrochemical performance of composite electrodes

Maxwell Prize Talk: Scaling Laws for the Dynamical Plasma Phenomena

Science.gov (United States)

Ryutov, Livermore, Ca 94550, Usa, D. D.

2017-10-01

The scaling and similarity technique is a powerful tool for developing and testing reduced models of complex phenomena, including plasma phenomena. The technique has been successfully used in identifying appropriate simplified models of transport in quasistationary plasmas. In this talk, the similarity and scaling arguments will be applied to highly dynamical systems, in which temporal evolution of the plasma leads to a significant change of plasma dimensions, shapes, densities, and other parameters with respect to initial state. The scaling and similarity techniques for dynamical plasma systems will be presented as a set of case studies of problems from various domains of the plasma physics, beginning with collisonless plasmas, through intermediate collisionalities, to highly collisional plasmas describable by the single-fluid MHD. Basic concepts of the similarity theory will be introduced along the way. Among the results discussed are: self-similarity of Langmuir turbulence driven by a hot electron cloud expanding into a cold background plasma; generation of particle beams in disrupting pinches; interference between collisionless and collisional phenomena in the shock physics; similarity for liner-imploded plasmas; MHD similarities with an emphasis on the effect of small-scale (turbulent) structures on global dynamics. Relations between astrophysical phenomena and scaled laboratory experiments will be discussed.

An arbitrary Lagrangian-Eulerian method for interfacial flows with insoluble surfactants

Science.gov (United States)

Yang, Xiaofeng

Interfacial flows, fluid flows involving two or more fluids that do not mix, are common in many natural and industrial processes such as rain drop formation, crude oil recovery, polymer blending, fuel spray formation, and so on. Surfactants (surface active substances) play an important role in such processes because they significantly change the interfacial dynamics. In this thesis, an arbitrary Lagrangian-Eulerian (ALE) method has been developed to numerically simulate interfacial flows with insoluble surfactants. The interface is captured using a coupled level set and volume of fluid method. To evolve the surfactant concentration, the method directly tracks the surfactant mass and the interfacial area. The surfactant concentration, which determines the local surface tension through an equation of state, is then computed as surfactant mass per interfacial area. By directly tracking the surfactant mass, the method conserves the surfactant mass exactly. To accurately approximate the interfacial area, the fluid interface is reconstructed using piecewise parabolas. The evolution of the level set function, volume fraction, interfacial area, and the surfactant mass is performed using an ALE approach. The fluid flow is governed by Stokes equations, which are solved using a finite element method. The surface forces are included in the momentum equation using a continuum surface stress formulation. To efficiently resolve the complex interfacial dynamics, interfacial regions of high surface curvature, and near contact regions between two interacting interfaces, the grid near the interface is adaptively refined. The method is extendible to axisymmetric and 3D spaces, and can be coupled with other flow solvers, such as Navier-Stokes and viscoelastic flow solvers, as well. The method has been applied to study the effect of surfactants on drop deformation and breakup in an extensional flow. Drop deformation results are compared with available experimental and theoretical

Interfacial thermal degradation in inverted organic solar cells

International Nuclear Information System (INIS)

Greenbank, William; Hirsch, Lionel; Wantz, Guillaume; Chambon, Sylvain

2015-01-01

The efficiency of organic photovoltaic (OPV) solar cells is constantly improving; however, the lifetime of the devices still requires significant improvement if the potential of OPV is to be realised. In this study, several series of inverted OPV were fabricated and thermally aged in the dark in an inert atmosphere. It was demonstrated that all of the devices undergo short circuit current-driven degradation, which is assigned to morphology changes in the active layer. In addition, a previously unreported, open circuit voltage-driven degradation mechanism was observed that is highly material specific and interfacial in origin. This mechanism was specifically observed in devices containing MoO 3 and silver as hole transporting layers and electrode materials, respectively. Devices with this combination were among the worst performing devices with respect to thermal ageing. The physical origins of this mechanism were explored by Rutherford backscattering spectrometry and atomic force microscopy and an increase in roughness with thermal ageing was observed that may be partially responsible for the ageing mechanism

Toward a CFD-grade database addressing LWR containment phenomena

International Nuclear Information System (INIS)

Paladino, Domenico; Andreani, Michele; Zboray, Robert; Dreier, Jörg

2012-01-01

Highlights: ► The SETH-2 PANDA tests have supplied data with CFD-grade on plumes and jets at large-scale. ► The PANDA tests have contributed to the understanding of phenomena with high safety relevance for LWRs. ► The analytical activities related increased confidence in the use of various computational tools for safety analysis. - Abstract: The large-scale, multi-compartment PANDA facility (located at PSI in Switzerland) is one of the state-of-the-art facilities which is continuously upgraded to progressively match the requirements of CFD-grade experiments. Within the OECD/SETH projects, the PANDA facility has been used for the creation of an experimental database on basic containment phenomena e.g. gas mixing, transport, stratification, condensation. In the PANDA tests, these phenomena are driven by large scale plumes or jets. In the paper is presented a selection of the SETH PANDA experimental results. Examples of analytical activities performed at PSI using the GOTHIC, CFX-4 and CFX-5 codes will be used to illustrate how the spatial and temporal resolutions of the measurement grid in PANDA tests are adequate for CFD code (and advanced containment codes) assessment and validation purposes.

Intermetallic Growth and Interfacial Properties of the Grain Refiners in Al Alloys

Science.gov (United States)

Li, Chunmei; Cheng, Nanpu; Chen, Zhiqian; Xie, Zhongjing; Hui, Liangliang

2018-01-01

Al3TM(TM = Ti, Zr, Hf, Sc) particles acting as effective grain refiners for Al alloys have been receiving extensive attention these days. In order to judge their nucleation behaviors, first-principles calculations are used to investigate their intermetallic and interfacial properties. Based on energy analysis, Al3Zr and Al3Sc are more suitable for use as grain refiners than the other two intermetallic compounds. Interfacial properties show that Al/Al3TM(TM = Ti, Zr, Hf, Sc) interfaces in I-ter interfacial mode exhibit better interface wetting effects due to larger Griffith rupture work and a smaller interface energy. Among these, Al/Al3Sc achieves the lowest interfacial energy, which shows that Sc atoms should get priority for occupying interfacial sites. Additionally, Sc-doped Al/Al3(Zr, Sc) interfacial properties show that Sc can effectively improve the Al/Al3(Zr, Sc) binding strength with the Al matrix. By combining the characteristics of interfaces with the properties of intermetallics, the core-shell structure with Al3Zr-core or Al3Zr(Sc1-1)-core encircled with an Sc-rich shell forms. PMID:29677155

Solid/liquid interfacial free energies in binary systems

Science.gov (United States)

Nason, D.; Tiller, W. A.

1973-01-01

Description of a semiquantitative technique for predicting the segregation characteristics of smooth interfaces between binary solid and liquid solutions in terms of readily available thermodynamic parameters of the bulk solutions. A lattice-liquid interfacial model and a pair-bonded regular solution model are employed in the treatment with an accommodation for liquid interfacial entropy. The method is used to calculate the interfacial segregation and the free energy of segregation for solid-liquid interfaces between binary solutions for the (111) boundary of fcc crystals. The zone of compositional transition across the interface is shown to be on the order of a few atomic layers in width, being moderately narrower for ideal solutions. The free energy of the segregated interface depends primarily upon the solid composition and the heats of fusion of the component atoms, the composition difference of the solutions, and the difference of the heats of mixing of the solutions.

Interfacial characteristics of hybrid nanocomposite under thermomechanical loading

Science.gov (United States)

Choyal, Vijay; Kundalwal, Shailesh I.

2017-12-01

In this work, an improved shear lag model was developed to investigate the interfacial characteristics of three-phase hybrid nanocomposite which is reinforced with microscale fibers augmented with carbon nanotubes on their circumferential surfaces. The shear lag model accounts for (i) radial and axial deformations of different transversely isotropic constituents, (ii) thermomechanical loads on the representative volume element (RVE), and (iii) staggering effect of adjacent RVEs. The results from the current newly developed shear lag model are validated with the finite element simulations and found to be in good agreement. This study reveals that the reduction in the maximum value of the axial stress in the fiber and the interfacial shear stress along its length become more pronounced in the presence of applied thermomechanical loads on the staggered RVEs. The existence of shear tractions along the RVE length plays a significant role in the interfacial characteristics and cannot be ignored.

Wavelength dependence of liquid-vapor interfacial tension of Ga

International Nuclear Information System (INIS)

Li Dongxu; Yang Bin; Rice, Stuart A.; Lin Binhua; Meron, Mati; Gebhardt, Jeff; Graber, Tim

2004-01-01

The wave-vector dependence of the liquid-vapor interfacial tension of Ga, γ(q), has been determined from diffuse x-ray scattering measurements. The ratio γ(q)/γ(0)=1 for q -1 decreases to 0.5 near q=0.22 Angstrom -1 , and increases strongly for larger q. The observed form for γ(q)/γ(0) is consistent with the prediction from the Mecke-Dietrich theory when the known stratified liquid-vapor interfacial density profile of Ga and a pseudopotential based pair interaction with appropriate asymptotic (r→∞) behavior are used. The detailed behavior of γ(q)/γ(0) depends on the particular forms of both the interfacial density profile and the asymptotic falloff of the atomic pair interaction

An Inverse Michaelis–Menten Approach for Interfacial Enzyme Kinetics

DEFF Research Database (Denmark)

Kari, Jeppe; Andersen, Morten; Borch, Kim

2017-01-01

Interfacial enzyme reactions are ubiquitous both in vivo and in technical applications, but analysis of their kinetics remains controversial. In particular, it is unclear whether conventional Michaelis–Menten theory, which requires a large excess of substrate, can be applied. Here, an extensive...... experimental study of the enzymatic hydrolysis of insoluble cellulose indeed showed that the conventional approach had a limited applicability. Instead we argue that, unlike bulk reactions, interfacial enzyme catalysis may reach a steady-state condition in the opposite experimental limit, where...... for kinetic analyses of interfacial enzyme reactions and that its analogy to established theory provides a bridge to the accumulated understanding of steady-state enzyme kinetics. Finally, we show that the ratio of parameters from conventional and inverted Michaelis–Menten analysis reveals the density...

Interfacial characterization of CVI-SiC/SiC composites

International Nuclear Information System (INIS)

Yang, W.; Kohyama, A.; Noda, T.; Katoh, Y.; Hinoki, T.; Araki, H.; Yu, J.

2002-01-01

The mechanical properties of the interfaces of two families of chemical vapor infiltration SiC/SiC composites, advanced Tyranno-SA and Hi-Nicalon fibers reinforced SiC/SiC composites with various carbon and SiC/C interlayers, were investigated by single fiber push-out/push-back tests. Interfacial debonding and fibers sliding mainly occurred adjacent to the first carbon layer on the fibers. The interfacial debonding strengths and frictional stresses for both Tyranno-SA/SiC and Hi-Nicalon/SiC composites were correlated with the first carbon layer thickness. Tyranno-SA/SiC composites exhibited much larger interfacial frictional stresses compared to Hi-Nicalon/SiC composites. This was assumed to be mainly contributed by the rather rough surface of the Tyranno-SA fiber

Morphological Instability in InAs/GaSb Superlattices due to Interfacial Bonds

International Nuclear Information System (INIS)

Li, J.H.; Moss, S.C.; Stokes, D.W.; Caha, O.; Bassler, K.E.; Ammu, S.L.; Bai, J.

2005-01-01

Synchrotron x-ray diffraction is used to compare the misfit strain and composition in a self-organized nanowire array in an InAs/GaSb superlattice with InSb interfacial bonds to a planar InAs/GaSb superlattice with GaAs interfacial bonds. It is found that the morphological instability that occurs in the nanowire array results from the large misfit strain that the InSb interfacial bonds have in the nanowire array. Based on this result, we propose that tailoring the type of interfacial bonds during the epitaxial growth of III-V semiconductor films provides a novel approach for producing the technologically important morphological instability in anomalously thin layers

Ultrasonic Guided Waves in Piezoelectric Layered Composite with Different Interfacial Properties

Directory of Open Access Journals (Sweden)

Xiao Chen

2011-01-01

Full Text Available Combining the propagation model of guided waves in a multilayered piezoelectric composite with the interfacial model of rigid, slip, and weak interfaces, the generalized dispersion characteristic equations of guided waves propagating in a piezoelectric layered composite with different interfacial properties are derived. The effects of the slip, weak, and delamination interfaces in different depths on the dispersion properties of the lowest-order mode ultrasonic guided wave are analyzed. The theory would be used to characterize the interfacial properties of piezoelectric layered composite nondestructively.

Mesoscale Interfacial Dynamics in Magnetoelectric Nanocomposites

Energy Technology Data Exchange (ETDEWEB)

Shashank, Priya [Virginia Polytechnic Inst. and State Univ. (Virginia Tech), Blacksburg, VA (United States)

2009-12-14

Biphasic composites are the key towards achieving enhanced magnetoelectric response. In order understand the control behavior of the composites and resultant symmetry of the multifunctional product tensors, we need to synthesized model material systems with the following features (i) interface formation through either deposition control or natural decomposition; (ii) a very high interphase-interfacial area, to maximize the ME coupling; and (iii) an equilibrium phase distribution and morphology, resulting in preferred crystallographic orientation relations between phases across the interphase-interfacial boundaries. This thought process guided the experimental evolution in this program. We initiated the research with the co-fired composites approach and then moved on to the thin film laminates deposited through the rf-magnetron sputtering and pulsed laser deposition process

Concentration polarization: Electrodeposition and transport phenomena at overlimiting current

DEFF Research Database (Denmark)

Nielsen, Christoffer Peder

a numerical sharp-interface model describing the electrode growth. This model differs from the established phase-field models, in that it is applicable at overlimiting current and implements electrode reactions in a consistent way. Comparison of the sharp-interface model to the results of the stability...... methods. The initial study concerns a fundamental problem in the study of concentration polarization at overlimiting current, namely the emergence of an extended space-charge region near the ion-selective interface. Based on the so-called quasi-uniform charge density assumption (QCD), we develop...... this coupled chemical and transport effect using two simple models of the reaction kinetics. The principal investigations are performed using numerical simulations, but in addition we derive an analytical model for the transport in the system. The analytical model reveals an important link between the current...

Transport Coefficients from Large Deviation Functions

Directory of Open Access Journals (Sweden)

Chloe Ya Gao

2017-10-01

Full Text Available We describe a method for computing transport coefficients from the direct evaluation of large deviation functions. This method is general, relying on only equilibrium fluctuations, and is statistically efficient, employing trajectory based importance sampling. Equilibrium fluctuations of molecular currents are characterized by their large deviation functions, which are scaled cumulant generating functions analogous to the free energies. A diffusion Monte Carlo algorithm is used to evaluate the large deviation functions, from which arbitrary transport coefficients are derivable. We find significant statistical improvement over traditional Green–Kubo based calculations. The systematic and statistical errors of this method are analyzed in the context of specific transport coefficient calculations, including the shear viscosity, interfacial friction coefficient, and thermal conductivity.

Transport Coefficients from Large Deviation Functions

Science.gov (United States)

Gao, Chloe; Limmer, David

2017-10-01

We describe a method for computing transport coefficients from the direct evaluation of large deviation function. This method is general, relying on only equilibrium fluctuations, and is statistically efficient, employing trajectory based importance sampling. Equilibrium fluctuations of molecular currents are characterized by their large deviation functions, which is a scaled cumulant generating function analogous to the free energy. A diffusion Monte Carlo algorithm is used to evaluate the large deviation functions, from which arbitrary transport coefficients are derivable. We find significant statistical improvement over traditional Green-Kubo based calculations. The systematic and statistical errors of this method are analyzed in the context of specific transport coefficient calculations, including the shear viscosity, interfacial friction coefficient, and thermal conductivity.

Direct observation of interfacial Au atoms on TiO₂ in three dimensions.

Science.gov (United States)

Gao, Wenpei; Sivaramakrishnan, Shankar; Wen, Jianguo; Zuo, Jian-Min

2015-04-08

Interfacial atoms, which result from interactions between the metal nanoparticles and support, have a large impact on the physical and chemical properties of nanoparticles. However, they are difficult to observe; the lack of knowledge has been a major obstacle toward unraveling their role in chemical transformations. Here we report conclusive evidence of interfacial Au atoms formed on the rutile (TiO2) (110) surfaces by activation using high-temperature (∼500 °C) annealing in air. Three-dimensional imaging was performed using depth-sectioning enabled by aberration-corrected scanning transmission electron microscopy. Results show that the interface between Au nanocrystals and TiO2 (110) surfaces consists of a single atomic layer with Au atoms embedded inside Ti-O. The number of interfacial Au atoms is estimated from ∼1-8 in an interfacial atomic column. Direct impact of interfacial Au atoms is observed on an enhanced Au-TiO2 interaction and the reduction of surface TiO2; both are critical to Au catalysis.

Research on the interfacial behaviors of plate-type dispersion nuclear fuel elements

Energy Technology Data Exchange (ETDEWEB)

Wang Qiming; Yan Xiaoqing [Department of Mechanics and Engineering Science, Fudan University, Shanghai 200433 (China); Ding Shurong, E-mail: dsr1971@163.co [Department of Mechanics and Engineering Science, Fudan University, Shanghai 200433 (China); Huo Yongzhong [Department of Mechanics and Engineering Science, Fudan University, Shanghai 200433 (China)

2010-04-01

The three-dimensional constitutive relations are constructed, respectively, for the fuel particles, the metal matrix and the cladding of dispersion nuclear fuel elements, allowing for the effects of large deformation and thermal-elastoplasticity. According to the constitutive relations, the method of modeling their irradiation behaviors in ABAQUS is developed and validated. Numerical simulations of the interfacial performances between the fuel meat and the cladding are implemented with the developed finite element models for different micro-structures of the fuel meat. The research results indicate that: (1) the interfacial tensile stresses and shear stresses for some cases will increase with burnup, but the relative stresses will decrease with burnup for some micro-structures; (2) at the lower burnups, the interfacial stresses increase with the particle sizes and the particle volume fractions; however, it is not the case at the higher burnups; (3) the particle distribution characteristics distinctly affect the interfacial stresses, and the face-centered cubic case has the best interfacial performance of the three considered cases.

Strong and reversible modulation of carbon nanotube-silicon heterojunction solar cells by an interfacial oxide layer.

Science.gov (United States)

Jia, Yi; Cao, Anyuan; Kang, Feiyu; Li, Peixu; Gui, Xuchun; Zhang, Luhui; Shi, Enzheng; Wei, Jinquan; Wang, Kunlin; Zhu, Hongwei; Wu, Dehai

2012-06-21

Deposition of nanostructures such as carbon nanotubes on Si wafers to make heterojunction structures is a promising route toward high efficiency solar cells with reduced cost. Here, we show a significant enhancement in the cell characteristics and power conversion efficiency by growing a silicon oxide layer at the interface between the nanotube film and Si substrate. The cell efficiency increases steadily from 0.5% without interfacial oxide to 8.8% with an optimal oxide thickness of about 1 nm. This systematic study reveals that formation of an oxide layer switches charge transport from thermionic emission to a mixture of thermionic emission and tunneling and improves overall diode properties, which are critical factors for tailoring the cell behavior. By controlled formation and removal of interfacial oxide, we demonstrate oscillation of the cell parameters between two extreme states, where the cell efficiency can be reversibly altered by a factor of 500. Our results suggest that the oxide layer plays an important role in Si-based photovoltaics, and it might be utilized to tune the cell performance in various nanostructure-Si heterojunction structures.

The molecular understanding of interfacial interactions of functionalized graphene and chitosan

International Nuclear Information System (INIS)

Zhang, Hong-ping; Luo, Xue-gang; Lin, Xiao-yan; Lu, Xiong; Tang, Youhong

2016-01-01

Graphical abstract: The type of the functional groups can be used to modulating interactions between graphene sheet and chitosan. - Highlights: • Investigate interfacial interactions between chitosan and functionalized graphene by DFT. • Observe covalent linkages between COOH-modified graphene and chitosan units. • Multi-functionalized graphene regulates the interfacial interactions with chitosan. • It is useful for guiding the preparation of graphene/chitosan composites. - Abstract: Graphene-reinforced chitosan scaffolds have been extensively studied for several years as promising hard tissue replacements. However, the interfacial interactions between graphene and chitosan are strongly related to the solubility, processability, and mechanical properties of graphene-reinforced chitosan (G–C) composites. The functionalization of graphene is regarded as the most effective way to improve the abovementioned properties of the G–C composite. In this study, the interfacial interactions between chitosan and functionalized graphene sheets with carboxylization (COOH-), amination (NH 2 -), and hydroxylation (OH-) groups were systematically studied at the electronic level using the method of ab initio simulations based on quantum mechanics theory and the observations were compared with reported experimental results. The covalent linkages between COOH-modified graphene and the chitosan units were demonstrated and the combination of multi-functionalization on graphene could regulate the interfacial interactions between graphene and the chitosan. The interfacial interactions between chitosan and properly functionalized graphene are critical for the preparation of G–C-based composites for tissue engineering scaffolds and other applications.

Interfacial Studies of Sized Carbon Fiber

International Nuclear Information System (INIS)

Shahrul, S. N.; Hartini, M. N.; Hilmi, E. A.; Nizam, A.

2010-01-01

This study was performed to investigate the influence of sizing treatment on carbon fiber in respect of interfacial adhesion in composite materials, Epolam registered 2025. Fortafil unsized carbon fiber was used to performed the experiment. The fiber was commercially surface treated and it was a polyacrylonitrile based carbon fiber with 3000 filament per strand. Epicure registered 3370 was used as basic sizing chemical and dissolved in two types of solvent, ethanol and acetone for the comparison purpose. The single pull out test has been used to determine the influence of sizing on carbon fiber. The morphology of carbon fiber was observed by atomic force microscopy (AFM) and scanning electron microscopy (SEM). The apparent interfacial strength IFSS values determined by pull out test for the Epicure registered 3370/ethanol sized carbon fiber pointed to a good interfacial behaviour compared to the Epicure registered 3370/acetone sized carbon fiber. The Epicure registered 3370/ethanol sizing agent was found to be effective in promoting adhesion because of the chemical reactions between the sizing and Epolam registered 2025 during the curing process. From this work, it showed that sized carbon fiber using Epicure registered 3370 with addition of ethanol give higher mechanical properties of carbon fiber in terms of shear strength and also provided a good adhesion between fiber and matrix compared to the sizing chemical that contain acetone as a solvent.

The Beasts' model of percolative transport

International Nuclear Information System (INIS)

Dubois, M.A.; Beaufume, P.; Fromont, B.

1991-12-01

A class of nonlinear dynamical systems is introduced: it is aimed to be a tool in order to study anomalous transport and percolation phenomena. We study a simple example of this system, and explore different regimes of transport exhibited

Ab initio theory of galvanomagnetic phenomena in ferromagnetic metals and disordered alloys

Czech Academy of Sciences Publication Activity Database

Turek, Ilja; Kudrnovský, Josef; Drchal, Václav

2012-01-01

Roč. 86, č. 1 (2012), 014405/1/-014405/8/ ISSN 1098-0121 R&D Projects: GA ČR(CZ) GAP204/11/1228 Institutional research plan: CEZ:AV0Z10100520 Institutional support: RVO:68081723 Keywords : electronic transport * galvanomagnetic phenomena Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.767, year: 2012

Polyindole/ carboxylated-multiwall carbon nanotube composites produced by in-situ and interfacial polymerization

International Nuclear Information System (INIS)

Joshi, Leela; Singh, Arun Kumar; Prakash, Rajiv

2012-01-01

Composites of polyindole (PIn), a conducting polymer, with carboxylated-multiwalled carbon nanotubes (c-MWCNT/PIn) were synthesized; the synthesis was done using (i) two miscible solvents (in-situ method) and (ii) two immiscible solvents (interfacial method). A tubular composite, with a uniform coating of the polymer over c-MWCNTs, was observed in the case of interfacial synthesis. However, the in-situ synthesis of c-MWCNT/PIn composites exhibited a densely packed spherical morphology, with c-MWCNT incorporated within the polymer spheres. The spherical morphology was probably obtained due to fast polymerization kinetics and the formation of micelles in case of in-situ polymerization, whereas tubular morphology was obtained in case of interfacial polymerization due to the sufficient time provided for the growth of polymer chains over the c-MWCNT surfaces. Nanoscale electrical properties of composites, in a metal/(c-MWCNT/PIn) configuration, were studied using current sensing atomic force microscopy. Interfacial c-MWCNT/PIn composite, on Al metal substrate, exhibited a typical rectifying diode behavior. This composite had manifested enormous potential for electronic applications and fabrication of nanoscale organic devices. Highlights: ► Polyindole/c-MWNT nanocomposites produced by in-situ and interfacial polymerization. ► Densely packed spherical morphology was observed in in-situ polymerization route. ► Tubular core-shell morphology was observed in interfacial polymerization route. ► Interfacial nanocomposite manifested a nano-schottky junction with Al metal.

Ultrathin Polyamide Membranes Fabricated from Free-Standing Interfacial Polymerization: Synthesis, Modifications, and Post-treatment

KAUST Repository

Cui, Yue

2016-12-21

The thin film composite (TFC) membrane synthesized via interfacial polymerization is the workhorse of the prevalent membrane technologies such as nanofiltration (NF), reverse osmosis (RO), forward osmosis (FO), and pressure retarded osmosis (PRO) membranes. The polyamide selective layer usually possesses a high selectivity and permeability, making it the heart of this membrane technology. To further improve and understand its formation, with entirely excluding the effect of substrate, an ultrathin membrane which consists of only the polyamide selective layer has been fabricated via free-standing interfacial polymerization between M-phenylenediamine (MPD) and trimesoyl chloride (TMC) in this study. The influences of monomer concentration on polyamide layer formation is first examined. Different from previous studies which indicated that the variation of MPD concentration might affect the polyamide layer formation even when in excess, the MPD concentration when in excess does not affect membrane properties significantly, while increasing the TMC concentration gradually densifies the polyamide layer and enhances its transport resistance. Adding lithium bromide (LiBr) and sodium dodecyl sulfate (SDS) in MPD solutions is found to facilitate the reaction between the two phases and result in a significant improvement in water permeability. However, a high amount of additives leads to an augmentation in transport resistance. The N,N-dimethylformamide (DMF) treatment on the polyamide membrane shows pronounced improvements on water flux under FO tests and water permeability under RO tests without compromising reverse salt flux and salt rejection because the dense polyamide core stays intact. This study may offer a different perspective on membrane formation and intrinsic properties of the polyamide selective layer and provide useful insights for the development of next-generation TFC membranes.

Direct numerical simulation of interfacial instabilities: A consistent, conservative, all-speed, sharp-interface method

Science.gov (United States)

Chang, Chih-Hao; Deng, Xiaolong; Theofanous, Theo G.

2013-06-01

shock waves demonstrate for the first time ab initio numerical prediction of the key interfacial features and phenomena found in recent experimental and theoretical studies of this class of problems [T.G. Theofanous, Aerobreakup of Newtonian and viscoelastic liquids, Ann. Rev. Fluid Mech. 43 (2011) 661-690.].

Interfacial waves generated by electrowetting-driven contact line motion

Science.gov (United States)

Ha, Jonghyun; Park, Jaebum; Kim, Yunhee; Shin, Bongsu; Bae, Jungmok; Kim, Ho-Young

2016-10-01

The contact angle of a liquid-fluid interface can be effectively modulated by the electrowetting-on-dielectric (EWOD) technology. Rapid movement of the contact line can be achieved by swift changes of voltage at the electrodes, which can give rise to interfacial waves under the strong influence of surface tension. Here we experimentally demonstrate EWOD-driven interfacial waves of overlapping liquids and compare their wavelength and decay length with the theoretical results obtained by a perturbation analysis. Our theory also allows us to predict the temporal evolution of the interfacial profiles in either rectangular or cylindrical containers, as driven by slipping contact lines. This work builds a theoretical framework to understand and predict the dynamics of capillary waves of a liquid-liquid interface driven by EWOD, which has practical implications on optofluidic devices used to guide light.

Hopping transport in solids

CERN Document Server

Pollak, M

1991-01-01

The hopping process, which differs substantially from conventional transport processes in crystals, is the central process in the transport phenomena discussed in this book. Throughout the book the term ``hopping'' is defined as the inelastic tunneling transfer of an electron between two localized electronic states centered at different locations. Such processes do not occur in conventional electronic transport in solids, since localized states are not compatible with the translational symmetry of crystals.The rapid growth of interest in hopping transport has followed in the footsteps of the

Interfacial tension in systems involving TBP in dodecane, nitric acid, uranyl nitrate and water

International Nuclear Information System (INIS)

Kolarik, Z.; Pipkin, N.

1982-08-01

The interfacial tension was measured at 25 0 C in the systems TBP - n-dodecane/nitric acid - water and TBP - n-dodecane/nitric acid - uranyl nitrate - water. Empirical equations describing the interfacial tension as a function of the concentration of TBP in the starting organic phase and of uranium-(VI) and nitric acid in the equilibrium aqueous phase were suggested. In the absence of uranium (VI), the interfacial tension can also be correlated with the concentration of water in the equilibrium organic phase. Free TBP, hydrated or nonhydrated, and hydrated TBP solvates of nitric acid are interfacially active. Anhydrous TBP solvates of nitric acid and the TBP solvate of uranyl nitrate, which neither is hydrated, do not exhibit any visible interfacial activity. (orig.) [de

Subthreshold slope as a measure of interfacial trap density in pentacene films

International Nuclear Information System (INIS)

Kwon, Yongwoo; Park, Byoungnam

2016-01-01

Electrical properties in organic field effect transistors (FETs) are dominated by charge transport in the accumulation layer, few molecular layers close to the gate dielectric. Through comparison of the subthreshold slope between monolayer (ML) and thick pentacene FETs, formation of the second layer islands on top of the complete first layer is found to be crucial in determining the charge transport in ML pentacene FETs. It is demonstrated that a pentacene ML field effect transistor (FET) is an excellent probe that can detect electronic states of organic semiconductors interfacing with the gate dielectric at nanometer scale. Far higher sub-threshold slope in ML FETs, as a measure of interfacial charge trap density, than that in thick pentacene FETs is translated that the path of the induced carriers in ML FETs is limited into the molecular layer interfacing with the gate dielectric with a high density of charge traps, while carriers in thicker films have alternative pathways through more electrically conductive layer above the first layer with much less trap density. - Highlights: • Sub-threshold slope is demonstrated to be a measure of interface traps. • For application to sensors, effective charge transport layer should be chosen. • Monolayer transistors can be used as a platform for probing localized states.

Subthreshold slope as a measure of interfacial trap density in pentacene films

Energy Technology Data Exchange (ETDEWEB)

Kwon, Yongwoo; Park, Byoungnam, E-mail: metalpbn@hongik.ac.kr

2016-01-29

Electrical properties in organic field effect transistors (FETs) are dominated by charge transport in the accumulation layer, few molecular layers close to the gate dielectric. Through comparison of the subthreshold slope between monolayer (ML) and thick pentacene FETs, formation of the second layer islands on top of the complete first layer is found to be crucial in determining the charge transport in ML pentacene FETs. It is demonstrated that a pentacene ML field effect transistor (FET) is an excellent probe that can detect electronic states of organic semiconductors interfacing with the gate dielectric at nanometer scale. Far higher sub-threshold slope in ML FETs, as a measure of interfacial charge trap density, than that in thick pentacene FETs is translated that the path of the induced carriers in ML FETs is limited into the molecular layer interfacing with the gate dielectric with a high density of charge traps, while carriers in thicker films have alternative pathways through more electrically conductive layer above the first layer with much less trap density. - Highlights: • Sub-threshold slope is demonstrated to be a measure of interface traps. • For application to sensors, effective charge transport layer should be chosen. • Monolayer transistors can be used as a platform for probing localized states.

Toward a CFD-grade database addressing LWR containment phenomena

Energy Technology Data Exchange (ETDEWEB)

Paladino, Domenico, E-mail: domenico.paladino@psi.ch [Laboratory for Thermal-Hydraulics, Nuclear Energy and Safety Department, Paul Scherrer Institut, CH-5232 Villigen PSI (Switzerland); Andreani, Michele; Zboray, Robert; Dreier, Joerg [Laboratory for Thermal-Hydraulics, Nuclear Energy and Safety Department, Paul Scherrer Institut, CH-5232 Villigen PSI (Switzerland)

2012-12-15

Highlights: Black-Right-Pointing-Pointer The SETH-2 PANDA tests have supplied data with CFD-grade on plumes and jets at large-scale. Black-Right-Pointing-Pointer The PANDA tests have contributed to the understanding of phenomena with high safety relevance for LWRs. Black-Right-Pointing-Pointer The analytical activities related increased confidence in the use of various computational tools for safety analysis. - Abstract: The large-scale, multi-compartment PANDA facility (located at PSI in Switzerland) is one of the state-of-the-art facilities which is continuously upgraded to progressively match the requirements of CFD-grade experiments. Within the OECD/SETH projects, the PANDA facility has been used for the creation of an experimental database on basic containment phenomena e.g. gas mixing, transport, stratification, condensation. In the PANDA tests, these phenomena are driven by large scale plumes or jets. In the paper is presented a selection of the SETH PANDA experimental results. Examples of analytical activities performed at PSI using the GOTHIC, CFX-4 and CFX-5 codes will be used to illustrate how the spatial and temporal resolutions of the measurement grid in PANDA tests are adequate for CFD code (and advanced containment codes) assessment and validation purposes.

Interfacial fracture of dentin adhesively bonded to quartz-fiber reinforced composite

International Nuclear Information System (INIS)

Melo, Renata M.; Rahbar, Nima; Soboyejo, Wole

2011-01-01

The paper presents the results of an experimental study of interfacial failure in a multilayered structure consisting of a dentin/resin cement/quartz-fiber reinforced composite (FRC). Slices of dentin close to the pulp chamber were sandwiched by two half-circle discs made of a quartz-fiber reinforced composite, bonded with bonding agent (All-bond 2, BISCO, Schaumburg) and resin cement (Duo-link, BISCO, Schaumburg) to make Brazil-nut sandwich specimens for interfacial toughness testing. Interfacial fracture toughness (strain energy release rate, G) was measured as a function of mode mixity by changing loading angles from 0 deg. to 15 deg. The interfacial fracture surfaces were then examined using Scanning Electron Microscopy (SEM) and Energy Dispersive X-ray Spectroscopy (EDX) to determine the failure modes when loading angles changed. A computational model was also developed to calculate the driving forces, stress intensity factors and mode mixities. Interfacial toughness increased from ∼ 1.5 to 3.2 J/m 2 when the loading angle increases from ∼ 0 to 15 deg. The hybridized dentin/cement interface appeared to be tougher than the resin cement/quartz-fiber reinforced epoxy. The Brazil-nut sandwich specimen was a suitable method to investigate the mechanical integrity of dentin/cement/FRC interfaces.

Hall effects and related phenomena in disordered Rashba 2DEG

International Nuclear Information System (INIS)

Inoue, Jun-ichiro; Kato, Takashi; Bauer, Gerrit E W; Molenkamp, Laurens W

2009-01-01

We review our recent work on the spin and anomalous Hall effects and other related phenomena caused by the intrinsic spin–orbit interaction. We focus our attention on disorder effects on these transport properties by adopting a model of a two-dimensional electron gas with a Rashba-type spin–orbit interaction. A spin-polarized model is adopted to calculate the anomalous Hall effect and anisotropic magnetoresistance. It is shown that the spin Hall conductivity in the ballistic transport regime is cancelled by the so-called vertex corrections for the disorder scattering, and that the anomalous Hall conductivity and anisotropic magnetoresistance vanish unless the lifetime is spin dependent. We further present results on spin accumulation under an electric field

Biomimetic Interfacial Electron-Induced Electrochemiluminesence.

Science.gov (United States)

Pu, Guiqiang; Zhang, Dongxu; Mao, Xiang; Zhang, Zhen; Wang, Huan; Ning, Xingming; Lu, Xiaoquan

2018-04-17

We provide here, for the first time, a new interfacial electron-induced electrochemiluminescence (IEIECL) system, realizing bionic construction of bioluminescence (BL) by exploiting electrochemiluminescence (ECL) and ITIES (the interface between two immiscible electrolyte solutions). Significantly, the superiority of the IEIECL system is embodied with the solution of the two bottlenecks encountered in the conventional ECL innovation: that are (a) the applications of hydrophobic luminophores in more commonly used aqueous solution are inhibited tremendously due to the poor inherent solubility and the instability of radicals and (b) the analytes, insoluble in water, are hard to be discovered in an aqueous system because of too little content. More productive IEIECL radiation, analogous to BL, originates from the triplet excited state porphyrin in comparison to the homogeneous ECL. The mechanism of IEIECL, as well as the interaction mechanism between IEIECL and charge transfer (comprising electron transfer (ET), ion transfer (IT), and facilitated ion transfer (FIT)) at the ITIES, are explored in detail. Finally, we emphasize the actual application potential of the IEIECL system with the detection of cytochrome c (Cyt c); it is a key biomolecule in the electron transport chain in the process of biological oxidation and is also an intermediate species in apoptosis. Potentially, the IEIECL system permits ones to explore the lifetime and diffusion path of free radicals, as well as imparting a possibility for the construction of a bionic sensor.

A Comparison of Numerical Strategies for Modeling the Transport Phenomena in High-Energy Laser Surface Alloying Process

Directory of Open Access Journals (Sweden)

Dipankar Chatterjee

2017-06-01

Full Text Available A comparative assessment is done on the effectiveness of some developed and reported macroscopic and mesoscopic models deployed for addressing the three-dimensional thermo-fluidic transport during high-power laser surface alloying process. The macroscopic models include the most celebrated k–ε turbulence model and the large eddy simulation (LES model, whereas a kinetic theory-based lattice Boltzmann (LB approach is invoked under the mesoscopic paradigm. The time-dependent Navier–Stokes equations are transformed into the k–ε turbulence model by performing the Reynolds averaging technique, whereas a spatial filtering operation is used to produce the LES model. The models are suitably modified to address the turbulent melt-pool convection by using a modified eddy viscosity expression including a damping factor in the form of square root of the liquid fraction. The LB scheme utilizes three separate distribution functions to monitor the underlying hydrodynamic, thermal and compositional fields. Accordingly, the kinematic viscosity, thermal and mass diffusivities are adjusted independently. A single domain fixed-grid enthalpy-porosity approach is utilized to model the phase change phenomena in conjunction with an appropriate enthalpy updating closure scheme. The performance of these models is recorded by capturing the characteristic nature of the thermo-fluidic transport during the laser material processing. The maximum values of the pertinent parameters in the computational domain obtained from several modeling efforts are compared to assess their capabilities. The comparison shows that the prediction from the k–ε turbulence model is higher than the LES and LB models. In addition, the results from all three models are compared with the available experimental results in the form of dimensionless composition of the alloyed layer along the dimensionless depth of the pool. The comparison reveals that the LB and the LES approaches are better

Flow and Transport in Tight and Shale Formations: A Review

KAUST Repository

Salama, Amgad

2017-09-18

A review on the recent advances of the flow and transport phenomena in tight and shale formations is presented in this work. Exploration of oil and gas in resources that were once considered inaccessible opened the door to highlight interesting phenomena that require attention and understanding. The length scales associated with transport phenomena in tight and shale formations are rich. From nanoscale phenomena to field-scale applications, a unified frame that is able to encounter the varieties of phenomena associated with each scale may not be possible. Each scale has its own tools and limitations that may not, probably, be suitable at other scales. Multiscale algorithms that effectively couple simulations among various scales of porous media are therefore important. In this article, a review of the different length scales and the tools associated with each scale is introduced. Highlights on the different phenomena pertinent to each scale are summarized. Furthermore, the governing equations describing flow and transport phenomena at different scales are investigated. In addition, methods to solve these equations using numerical techniques are introduced. Cross-scale analysis and derivation of linear and nonlinear Darcy\\'s scale laws from pore-scale governing equations are described. Phenomena occurring at molecular scales and their thermodynamics are discussed. Flow slippage at the nanosize pores and its upscaling to Darcy\\'s scale are highlighted. Pore network models are discussed as a viable tool to estimate macroscopic parameters that are otherwise difficult to measure. Then, the environmental aspects associated with the different technologies used in stimulating the gas stored in tight and shale formations are briefly discussed.

Flow and Transport in Tight and Shale Formations: A Review

KAUST Repository

Salama, Amgad; El-Amin, Mohamed; Kumar, Kundan; Sun, Shuyu

2017-01-01

A review on the recent advances of the flow and transport phenomena in tight and shale formations is presented in this work. Exploration of oil and gas in resources that were once considered inaccessible opened the door to highlight interesting phenomena that require attention and understanding. The length scales associated with transport phenomena in tight and shale formations are rich. From nanoscale phenomena to field-scale applications, a unified frame that is able to encounter the varieties of phenomena associated with each scale may not be possible. Each scale has its own tools and limitations that may not, probably, be suitable at other scales. Multiscale algorithms that effectively couple simulations among various scales of porous media are therefore important. In this article, a review of the different length scales and the tools associated with each scale is introduced. Highlights on the different phenomena pertinent to each scale are summarized. Furthermore, the governing equations describing flow and transport phenomena at different scales are investigated. In addition, methods to solve these equations using numerical techniques are introduced. Cross-scale analysis and derivation of linear and nonlinear Darcy's scale laws from pore-scale governing equations are described. Phenomena occurring at molecular scales and their thermodynamics are discussed. Flow slippage at the nanosize pores and its upscaling to Darcy's scale are highlighted. Pore network models are discussed as a viable tool to estimate macroscopic parameters that are otherwise difficult to measure. Then, the environmental aspects associated with the different technologies used in stimulating the gas stored in tight and shale formations are briefly discussed.

Effect of antiferromagnetic interfacial coupling on spin-wave resonance frequency of multi-layer film

Energy Technology Data Exchange (ETDEWEB)

Qiu, Rong-ke, E-mail: rkqiu@163.com; Cai, Wei

2017-08-15

Highlights: • A quantum approach is developed to study the SWR of a bicomponent multi-layer films. • The comparison of the SWR in films with FM and AFM interfacial coupling has been made. • The present results show the method to enhance and adjust the SWR frequency of films. - Abstract: We investigate the spin-wave resonance (SWR) frequency in a bicomponent bilayer and triple-layer films with antiferromagnetic or ferromagnetic interfacial couplings, as function of interfacial coupling, surface anisotropy, interface anisotropy, thickness and external magnetic field, using the linear spin-wave approximation and Green’s function technique. The microwave properties for multi-layer magnetic film with antiferromagnetic interfacial coupling is different from those for multi-layer magnetic film with ferromagnetic interfacial coupling. For the bilayer film with antiferromagnetic interfacial couplings, as the lower (upper) surface anisotropy increases, only the SWR frequencies of the odd (even) number modes increase. The lower (upper) surface anisotropy does not affect the SWR frequencies of the even (odd) number modes{sub .} For the multi-layer film with antiferromagnetic interfacial coupling, the SWR frequency of modes m = 1, 3 and 4 decreases while that of mode m = 2 increases with increasing thickness of the film within a proper parameter region. The present results could be useful in enhancing our fundamental understanding and show the method to enhance and adjust the SWR frequency of bicomponent multi-layer magnetic films with antiferromagnetic or ferromagnetic interfacial coupling.

Dropout Phenomena at Universities

DEFF Research Database (Denmark)

Larsen, Michael Søgaard; Kornbeck, Kasper Pihl; Kristensen, Rune

Dropout from university studies comprises a number of complex phenomena with serious complex consequences and profound political attention. Further analysis of the field is, therefore, warranted. Such an analysis is offered here as a systematic review which gives answers based on the best possible...... such dropout phenomena occur at universities? What can be done by the universities to prevent or reduce such dropout phenomena?...

Tomography based determination of permeability, Dupuit-Forchheimer coefficient, and interfacial heat transfer coefficient in reticulate porous ceramics

International Nuclear Information System (INIS)

Petrasch, Joerg; Meier, Fabian; Friess, Hansmartin; Steinfeld, Aldo

2008-01-01

A computer tomography based methodology is applied to determine the transport properties of fluid flow across porous media. A 3D digital representation of a 10-ppi reticulate porous ceramic (RPC) sample was generated by X-ray tomographic scans. Structural properties such as the porosity, specific interfacial surface area, pore-size distribution, mean survival time, two-point correlation function s 2 , and local geometry distribution of the RPC sample are directly extracted from the tomographic data. Reference solutions of the fluid flow governing equations are obtained for Re = 0.2-200 by applying finite volume direct pore-level numerical simulation (DPLS) using unstructured, body-fitted, tetrahedral mesh discretization. The permeability and the Dupuit-Forchheimer coefficient are determined from the reference solutions by DPLS, and compared to the values predicted by selected porous media flow models, namely: conduit-flow, hydraulic radius theory, drag models, mean survival time bound, s 2 -bound, fibrous bed correlations, and local porosity theory-based models. DPLS is further employed to determine the interfacial heat transfer coefficient and to derive a corresponding Nu-correlation, which is compared to empirical correlations

The impact of pressure-dependent interfacial tension and buoyancy forces upon pressure depletion in virgin hydrocarbon reservoirs

Energy Technology Data Exchange (ETDEWEB)

McDougall, S.R.; Mackay, E.J. [Heriot-Watt University, Edinburgh (United Kingdom). Dept. of Petroleum Engineering

1998-07-01

This paper describes a combined experimental and theoretical study of the microscopic pore-scale physics characterizing gas and liquid production from hydrocarbon reservoirs during pressure depletion. The primary focus of the study was to examine the complex interactions between interfacial tension and buoyancy forces during gas evolution within a porous medium containing oil, water and gas. A specialized 2-dimensional glass micromodel, capable of operating at pressure in excess of 35 MPa was used to visualize the physical mechanisms governing such microscopic processes. In addition, a 3-dimensional, 3-phase numerical pore-scale simulator was developed that can be used to examine gas evolution over a range of different lengthscales and for a wide range of fluid and rock properties. The model incorporates all of the important physics observed in associated laboratory micromodel experiments, including: embryonic nucleation, supersaturation effects, multiphase diffusion, bubble growth-migration-fragmentation, and three-phase spreading coefficients. The precise pore-scale mechanisms governing gas evolution were found to be far more subtle than earlier models would suggest because of the large variation of gas/oil interfacial tension with pressure. This has a profound effect upon the migration of gas structures during depletion and, in models pertaining to reservoir rock, the process of gas migration is consequently much slower than previously thought. This is the first time that such a phenomena has been modelled at the pore-scale and the implications for production forecasting are thought to be significant. (author)

Phenomena Associated With EIT Waves

Science.gov (United States)

Thompson, B. J.; Biesecker, D. A.; Gopalswamy, N.

2003-01-01

We discuss phenomena associated with "EIT Wave" transients. These phenomena include coronal mass ejections, flares, EUV/SXR dimmings, chromospheric waves, Moreton waves, solar energetic particle events, energetic electron events, and radio signatures. Although the occurrence of many phenomena correlate with the appearance of EIT waves, it is difficult to mfer which associations are causal. The presentation will include a discussion of correlation surveys of these phenomena.

Frontiers of interfacial water research :workshop report.

Energy Technology Data Exchange (ETDEWEB)

Cygan, Randall Timothy; Greathouse, Jeffery A.

2005-10-01

Water is the critical natural resource of the new century. Significant improvements in traditional water treatment processes require novel approaches based on a fundamental understanding of nanoscale and atomic interactions at interfaces between aqueous solution and materials. To better understand these critical issues and to promote an open dialog among leading international experts in water-related specialties, Sandia National Laboratories sponsored a workshop on April 24-26, 2005 in Santa Fe, New Mexico. The ''Frontiers of Interfacial Water Research Workshop'' provided attendees with a critical review of water technologies and emphasized the new advances in surface and interfacial microscopy, spectroscopy, diffraction, and computer simulation needed for the development of new materials for water treatment.

Advances in the study of far-field phenomena affecting repository performance

International Nuclear Information System (INIS)

Tsang, C.F.

1991-01-01

Studies of far-field phenomena affecting repository performance have focussed on the role of fractures and other heterogeneities in the potential transport of radioactive solutes from the repository to the biosphere. The present paper summarizes two recent advances in the subject: the channeling model for the understanding and analysis tracer transport in variable-aperture fractures and the modeling of coupled thermo-hydro-mechanical processes in geologic formation around a repository. The paper concludes with remarks on the need for duality in the approach to performance assessment. One line of the duality is fundamental studies and the other, goal-oriented assessment to satisfy regulatory requirements. 15 refs., 10 figs., 1 tab

Phenomena and parameters important to burnup credit

International Nuclear Information System (INIS)

Parks, C.V.; Dehart, M.D.; Wagner, J.C.

2001-01-01

Since the mid-1980s, a significant number of studies have been directed at understanding the phenomena and parameters important to implementation of burnup credit in out-of-reactor applications involving pressurized-water- reactor (PWR) spent fuel. The efforts directed at burnup credit involving boiling-water-reactor (BWR) spent fuel have been more limited. This paper reviews the knowledge and experience gained from work performed in the United States and other countries in the study of burnup credit. Relevant physics and analysis phenomenon are identified, and an assessment of their importance to burnup credit implementation for transport and dry cask storage is given. (author)

Magnetoresistance in Hybrid Pt/CoFe2O4 Bilayers Controlled by Competing Spin Accumulation and Interfacial Chemical Reconstruction.

Science.gov (United States)

Vasili, Hari Babu; Gamino, Matheus; Gàzquez, Jaume; Sánchez, Florencio; Valvidares, Manuel; Gargiani, Pierluigi; Pellegrin, Eric; Fontcuberta, Josep

2018-04-11

Pure spin currents have potential for use in energy-friendly spintronics. They can be generated by a flow of charge along a nonmagnetic metal with large spin-orbit coupling. This produces a spin accumulation at the surfaces, controllable by the magnetization of an adjacent ferromagnetic layer. Paramagnetic metals typically used are close to ferromagnetic instability and thus magnetic proximity effects can contribute to the observed angular-dependent magnetoresistance (ADMR). As interface phenomena govern the spin conductance across the metal/ferromagnetic-insulator heterostructures, unraveling these distinct contributions is pivotal for a full understanding of spin current conductance. Here, we report X-ray absorption and magnetic circular dichroism (XMCD) at Pt M and (Co, Fe) L absorption edges and atomically resolved energy electron loss spectroscopy (EELS) data of Pt/CoFe 2 O 4 bilayers, where CoFe 2 O 4 layers have been capped by Pt grown at different temperatures. It was found that the ADMR differs dramatically, dominated either by spin Hall magnetoresistance (SMR) associated with the spin Hall effect or by anisotropic magnetoresistance. The XMCD and EELS data indicate that the Pt layer grown at room temperature does not display any magnetic moment, whereas when grown at a higher temperature, it becomes magnetic due to interfacial Pt-(Co, Fe) alloying. These results enable differentiation of spin accumulation from interfacial chemical reconstructions and tailoring of the angular-dependent magnetoresistance.

Interfacial tensions of binary mixtures of ethanol with octane, decane, dodecane, and tetradecane

International Nuclear Information System (INIS)

Mejia, Andres; Cartes, Marcela; Segura, Hugo

2011-01-01

Highlights: → Experimental interfacial tensions in binary mixtures with aneotropic behavior. → Experimental interfacial tensions for ethanol + hydrocarbon mixtures. → Aneotropic displacement in ethanol mixtures. - Abstract: This contribution is devoted to the experimental characterization of interfacial tensions of a representative group of binary mixtures pertaining to the (ethanol + linear hydrocarbon) series (i.e. octane, decane, dodecane, and tetradecane). Experimental measurements were isothermically performed using a maximum differential bubble pressure technique, which was applied over the whole mole fraction range and over the temperature range 298.15 K < T/K < 318.15 K. Experimental results show that the interfacial tensions of (ethanol + octane or decane) negatively deviate from the linear behavior and that sharp minimum points on concentration, or aneotropes, are observed for each isotherm. The interfacial tensions of (ethanol + dodecane or tetradecane), in turn, are characterized by combined deviations from the linear behavior, and inflecting behavior observed on concentration for each isotherm. The experimental evidence also shows that these latter mixtures are close to exhibit aneotropy. For the case of (ethanol + octane or decane) mixtures, aneotropy was clearly induced by the similarity of the interfacial tension values of the constituents. The inflecting behavior of the interfacial tensions of (ethanol + dodecane or tetradecane), in turn, was observed in the vicinity of the coordinates of the critical point of these mixtures, thus pointing to the fact that the quasi-aneotropic singularity that affects these mixtures was provoked by the proximity of an immiscibility gap of the liquid phase. Finally, the experimental data of interfacial tensions were smoothed with the Scott-Myers expansion, from which it is possible to conclude that the observed aneotropic concentrations weakly depend on temperature for all the analyzed mixtures.

Iridium Interfacial Stack (IRIS)

Science.gov (United States)