Diffusion and Gas Flow Dynamics in Partially Saturated Smectites.

Clays and clay rocks are considered good natural and engineered barriers for deep geological disposal of nuclear waste worldwide. Metal corrosion and organic waste degradation in underground repositories generate significant amounts of gas that should be able to migrate through the multibarrier system to avoid potential pressure buildup, which could be compromising the integrity of the barriers and host rocks. The gas is expected to accumulate in larger pores and eventually form an interconnected network. Under such conditions, the migration of gas molecules takes place both in pore water films and gas-filled macropores. Therefore, mass fluxes depend on the distribution of gas molecules between the water-rich and gas-rich phases and their mobility in both compartments. Classical molecular dynamics (MD) simulations were employed to investigate the mobilities of He, H2, CO2, Ar, and CH4 in a Na-montmorillonite mesopore as a function of the degree of saturation, as well as evaluate the hydrodynamic behavior of the pore fluid in partially saturated clays. The diffusivity of the gas molecules was determined by observing the asymptotic behavior of the mean square displacement in the gas-rich phase and at the gas-water interface. The partition coefficient and Gibbs free energy were analyzed to investigate the transfer of gas molecules between the gas-rich and water-rich phases by observing the molecular trajectories as they cross the vapor-liquid interface. The results revealed that the diffusion coefficient in the gas phase increased with increasing gas-filled pore width and converged asymptotically toward the diffusion coefficient in the bulk state. It could be shown that the diffusion coefficient of gas molecules dissolved in the water films remained constant as long as the interacting water surface was in the bulk-liquid-like phase. This behavior changes in very thin water films. It was observed that the partitioning coefficient of gas molecules at the solid-liquid interface is nearly the same as that in the bulk-liquid-like phase. Partitioning is observed to be strongly dependent on the temperature and gas molecular weights. In the second part of the study, nonequilibrium molecular dynamics (NEMD) simulations were performed to investigate the mobility of gases in pressure-driven decoupled gas-phase dynamics (DGPD) and coupled gas and water phase dynamics (CGWPD) in a partially saturated Na-montmorillonite slit mesopore. The dynamic viscosity of the gas phase was calculated from NEMD simulations and indicated that the viscosity of the gas phase was almost the same in both methods (DGPD and CGWPD). The average slip length for gas molecules at the gas-water interface was also calculated, revealing that the slip-free boundary condition assumed in continuum models is generally invalid for microfluidics and that a slip boundary condition exists at the microscale for specific surface interactions. Finally, a Bosanquet-type equation was developed to predict the diffusion coefficient and dynamic viscosity of gas as a function of the average pore width, gas mean-free path, geometric factor, and thickness of the adsorbed water film

1996 Laboratory directed research and development annual report

This report summarizes progress from the Laboratory Directed Research and Development (LDRD) program during fiscal year 1996. In addition to a programmatic and financial overview, the report includes progress reports from 259 individual R&D projects in seventeen categories. The general areas of research include: engineered processes and materials; computational and information sciences; microelectronics and photonics; engineering sciences; pulsed power; advanced manufacturing technologies; biomedical engineering; energy and environmental science and technology; advanced information technologies; counterproliferation; advanced transportation; national security technology; electronics technologies; idea exploration and exploitation; production; and science at the interfaces - engineering with atoms

Feasibility and tradeoff study of an aeromaneuvering orbit-to-orbit shuttle (AMOOS)

This study establishes that configurations satisfying the aeromaneuvering orbit-to-orbit shuttle (AMOOS) requirements can be designed with performance capabilities in excess of the purely propulsive space tug. In view of this improved potential of the AMOOS vehicle over the propulsive space tug concept it is recommended that the AMOOS studies be advanced to a stage comparable to those performed for the space tug. This advancement is needed in particular in areas that are either peculiar to AMOOS or not addressed in sufficient detail in these studies to date. These areas include the thermodynamics problems, navigation and guidance, operations and economics analyses, subsystems and interfaces. The aeromaneuvering orbit-to-orbit shuttle (AMOOS) is evaluated as a candidate reusable third stage to the two-stage earth-to-orbit shuttle (EOS). AMOOS has the potential for increased payload capability over the purely propulsive space tug by trading a savings in consumables for an increase in structural and thermal protection system (TPS) mass

Advances in Hydraulics and Hydroinformatics Volume 2

This Special Issue reports on recent research trends in hydraulics, hydrodynamics, and hydroinformatics, and their novel applications in practical engineering. The Issue covers a wide range of topics, including open channel flows, sediment transport dynamics, two-phase flows, flow-induced vibration and water quality. The collected papers provide insight into new developments in physical, mathematical, and numerical modelling of important problems in hydraulics and hydroinformatics, and include demonstrations of the application of such models in water resources engineering

Aeronautical engineering: A continuing bibliography with indexes (supplement 284)

This bibliography lists 974 reports, articles, and other documents introduced into the NASA scientific and technical information system in Oct. 1992. The coverage includes documents on design, construction, evaluation, testing, operation, and performance of aircraft (including aircraft engines) and associated components, equipment, and systems. It also includes research and development in aerodynamics, aeronautics, and ground support equipment for aeronautical vehicles

Recent Trends in Coatings and Thin Film–Modeling and Application

Over the past four decades, there has been increased attention given to the research of fluid mechanics due to its wide application in industry and phycology. Major advances in the modeling of key topics such Newtonian and non-Newtonian fluids and thin film flows have been made and finally published in the Special Issue of coatings. This is an attempt to edit the Special Issue into a book. Although this book is not a formal textbook, it will definitely be useful for university teachers, research students, industrial researchers and in overcoming the difficulties occurring in the said topic, while dealing with the nonlinear governing equations. For such types of equations, it is often more difficult to find an analytical solution or even a numerical one. This book has successfully handled this challenging job with the latest techniques. In addition, the findings of the simulation are logically realistic and meet the standard of sufficient scientific value

The Windowless Gaseous Tritium Source of the KATRIN Experiment - Characterisation of Gas Dynamical and Plasma Properties

The Karlsruhe Tritium Neutrino Experiment aims to measure the neutrino mass with a sensitivity of 200meV (90% C.L) using the β-decay of molecular tritium. This makes a proper understanding of the characteristics of the tritium source indispensable. In this thesis the picture of gas flow related processes in the KATRIN source is completed and a model of its low density tritium plasma is developed. The predictions from the models are used to quantify the effect on the neutrino mass measurement

Aeronautical engineering: A continuing bibliography with indexes (supplement 219)

This bibliography lists 586 reports, articles, and other documents introduced into the NASA scientific and technical information system in October, 1987

Interactions of spacecraft and other moving bodies with natural plasmas

Abstract compilation on spacecraft interactions with ionosphere, magnetosphere, and interplanetary plasm

Microfluidics and Nanofluidics Handbook

The Microfluidics and Nanofluidics Handbook: Two-Volume Set comprehensively captures the cross-disciplinary breadth of the fields of micro- and nanofluidics, which encompass the biological sciences, chemistry, physics and engineering applications. To fill the knowledge gap between engineering and the basic sciences, the editors pulled together key individuals, well known in their respective areas, to author chapters that help graduate students, scientists, and practicing engineers understand the overall area of microfluidics and nanofluidics. Topics covered include Finite Volume Method for Numerical Simulation Lattice Boltzmann Method and Its Applications in Microfluidics Microparticle and Nanoparticle Manipulation Methane Solubility Enhancement in Water Confined to Nanoscale Pores Volume Two: Fabrication, Implementation, and Applications focuses on topics related to experimental and numerical methods. It also covers fabrication and applications in a variety of areas, from aerospace to biological systems. Reflecting the inherent nature of microfluidics and nanofluidics, the book includes as much interdisciplinary knowledge as possible. It provides the fundamental science background for newcomers and advanced techniques and concepts for experienced researchers and professionals