Mass Transport in the Presence of Internal Defect Reactions—Concept of Conservative Ensembles: IV, Tracer Diffusion and Intercorrelation with Chemical Diffusion and Ion Conductivity

The tracer diffusion coefficient is analyzed for the case in which internal ionization equilibria have to be considered, using the concept of conservative ensembles. The relationships of the tracer diffusion coefficient with other phenome-nological parameters, viz., the chemical diffusion coefficient and the diffusion coefficient derived from the ionic conductivity, as well as with the defect diffusivities are given. The importance of mobile partially ionized or neutral defects is highlighted. In this respect the formulation of the tracer diffusion as an ambipolar diffusion of the different isotopes is helpful.     

Isomerization and Hydrocracking of n-Decane over Bimetallic Pt–Pd Clusters Supported on Mesoporous MCM-41 Catalysts

n-Decane hydroconversion has been investigated on bifunctional catalysts comprising bimetallic Pt–Pd clusters supported on an AlMCM-41 (n_Si/n_Al = 23) mesoporous molecular sieve. The catalytic activity of the bimetallic Pt–Pd catalysts is higher than that of the monometallic Pt and Pd catalysts. The good balance between the two catalytic functions, namely acid sites and metal sites, also results in a higher isomer yield at a substantially lower reaction temperature. Moreover, cracking on the metal sites (hydrogenolysis) is largely suppressed over certain bimetallic catalysts.     

Aerodynamics and aerosol particle deaggregation phenomena in model oral-pharyngeal cavities

The results of numerical simulations of the aerodynamics and of solid aerosol deaggregation phenomena arising in the process of airflow through various model human oropharyngeal cavities are reported. Special attention is given to the relevance of these simulations to the inhalation of dry-powder therapeutic aerosols. Several two- and three-dimensional mouth and throat geometries (terminating just beyond the larynx) are considered. Cross-sectional area-averaged viscous stress values are numerically determined as a function of distance from the mouth opening. These values, ranging from approximately 10 to 500 dyn cm⁻², are compared with estimates of Van der Waals attractive forces per unit area of particle-particle contact so as to evaluate the ability of the flowing airstream to deaggregate aerosol particles that enter the mouth in an aggregated state (held together principally by Van der Waals attractive forces). Estimates of airstream viscous stress differ markedly depending on whether the geometry is two- or three-dimensional. Quantitative differences between flow in a 90°-bend model and an oropharyngeal geometry numerically reconstructed from a cast of a human mouth and throat are especially significant in regards to the ability of the airstream to break apart particle agglomerates. For all geometries it is observed that increasingly smaller particle agglomerates may potentially be separated as the airflow rate increases from 30 to 2001 min⁻¹. At the highest airflows, aggregated particles of diameter near to or even below 1 μm may potentially be separated by the airflow. If separation of particle agglomerates is to occur, it appears far more likely to take place in the throat than in the mouth. This is especially apparent for the more physiologically faithful oropharyngeal geometries considered.     

Displaying a boundary in graphic and symbolic “wait” displays: Duration estimates and users’ preferences

Two experiments assessed the effect of displaying a boundary on duration estimates and preference ratings for dynamic displays that were shown while users waited for the system's response. Displays were either symbolic (changing numbers) or graphic (increasing rectangles) and could contain a boundary that indicated when the interval was expected to be over. Duration estimates were similar for symbolic and graphic displays and for displays with and without a boundary. However, when the displays were encountered successively, participants assessed the graphic displays as having shorter durations than the symbolic displays. Faster rates of change in both types of displays led to increased duration estimates. Although displaying a boundary did not affect duration estimates, participants preferred displays in which a boundary was shown and preferred the graphic displays over the symbolic displays. Hence, bounded graphic displays are recommended as “wait” displays for computerized applications.     

Job-shop scheduling in a body shop

We study a generalized job-shop problem called the body shop scheduling problem (BSSP). This problem arises from the industrial application of welding in a car body production line, where possible collisions between industrial robots have to be taken into account. BSSP corresponds to a job-shop problem where the operations of a job have to follow alternating routes on the machines, certain operations of different jobs are not allowed to be processed at the same time and after processing an operation of a certain job a machine might be unavailable for a given time for operations of other jobs. As main results we will show that for three jobs and four machines the special case where only one machine is used by more than one job is already $\mathcal NP $ -hard. This also implies that the single machine scheduling problem that asks for a makespan minimal schedule of three chains of operations with delays between the operations of a chain is $\mathcal NP $ -hard. On the positive side, we present a polynomial algorithm for the two job case and a pseudo-polynomial algorithm together with an FPTAS  for an arbitrary but constant number of jobs. Hence for a constant number of jobs we fully settle the complexity status of the problem.     

Nonparametric Bayesian Image Segmentation

Image segmentation algorithms partition the set of pixels of an image into a specific number of different, spatially homogeneous groups. We propose a nonparametric Bayesian model for histogram clustering which automatically determines the number of segments when spatial smoothness constraints on the class assignments are enforced by a Markov Random Field. A Dirichlet process prior controls the level of resolution which corresponds to the number of clusters in data with a unique cluster structure. The resulting posterior is efficiently sampled by a variant of a conjugate-case sampling algorithm for Dirichlet process mixture models. Experimental results are provided for real-world gray value images, synthetic aperture radar images and magnetic resonance imaging data.     

A formal framework for scenario development in support of environmental decision-making

Scenarios are possible future states of the world that represent alternative plausible conditions under different assumptions. Often, scenarios are developed in a context relevant to stakeholders involved in their applications since the evaluation of scenario outcomes and implications can enhance decision-making activities. This paper reviews the state-of-the-art of scenario development and proposes a formal approach to scenario development in environmental decision-making. The discussion of current issues in scenario studies includes advantages and obstacles in utilizing a formal scenario development framework, and the different forms of uncertainty inherent in scenario development, as well as how they should be treated. An appendix for common scenario terminology has been attached for clarity. Major recommendations for future research in this area include proper consideration of uncertainty in scenario studies in particular in relation to stakeholder relevant information, construction of scenarios that are more diverse in nature, and sharing of information and resources among the scenario development research community.