358 research outputs found

    The fragility of thermoelectric power factor in cross-plane superlattices in the presence of nonidealities : a quantum transport simulation approach

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    Energy filtering has been put forth as a promising method for achieving large thermoelectric power factors in thermoelectric materials through Seebeck coefficient improvement. Materials with embedded potential barriers, such as cross-plane superlattices, provide energy filtering, in addition to low thermal conductivity, and could potentially achieve high figure of merit. Although there exist many theoretical works demonstrating Seebeck coefficient and power factor gains in idealized structures, experimental support has been scant. In most cases, the electrical conductivity is drastically reduced due to the presence of barriers. In this work, using quantum-mechanical simulations based on the nonequilibrium Green’s function method, we show that, although power factor improvements can theoretically be observed in optimized superlattices (as pointed out in previous studies), different types of deviations from the ideal potential profiles of the barriers degrade the performance, some nonidealities being so significant as to negate all power factor gains. Specifically, the effect of tunneling due to thin barriers could be especially detrimental to the Seebeck coefficient and power factor. Our results could partially explain why significant power factor improvements in superlattices and other energy-filtering nanostructures mainly fail to be realized, despite theoretical predictions

    Ischemic Heart Disease Incidence in Relation to Fine versus Total Particulate Matter Exposure in a U.S. Aluminum Industry Cohort.

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    Ischemic heart disease (IHD) has been linked to exposures to airborne particles with an aerodynamic diameter <2.5 ÎĽm (PM2.5) in the ambient environment and in occupational settings. Routine industrial exposure monitoring, however, has traditionally focused on total particulate matter (TPM). To assess potential benefits of PM2.5 monitoring, we compared the exposure-response relationships between both PM2.5 and TPM and incidence of IHD in a cohort of active aluminum industry workers. To account for the presence of time varying confounding by health status we applied marginal structural Cox models in a cohort followed with medical claims data for IHD incidence from 1998 to 2012. Analyses were stratified by work process into smelters (n = 6,579) and fabrication (n = 7,432). Binary exposure was defined by the 10th-percentile cut-off from the respective TPM and PM2.5 exposure distributions for each work process. Hazard Ratios (HR) comparing always exposed above the exposure cut-off to always exposed below the cut-off were higher for PM2.5, with HRs of 1.70 (95% confidence interval (CI): 1.11-2.60) and 1.48 (95% CI: 1.02-2.13) in smelters and fabrication, respectively. For TPM, the HRs were 1.25 (95% CI: 0.89-1.77) and 1.25 (95% CI: 0.88-1.77) for smelters and fabrication respectively. Although TPM and PM2.5 were highly correlated in this work environment, results indicate that, consistent with biologic plausibility, PM2.5 is a stronger predictor of IHD risk than TPM. Cardiovascular risk management in the aluminum industry, and other similar work environments, could be better guided by exposure surveillance programs monitoring PM2.5

    Incident Ischemic Heart Disease After Long-Term Occupational Exposure to Fine Particulate Matter: Accounting for 2 Forms of Survivor Bias.

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    Little is known about the heart disease risks associated with occupational, rather than traffic-related, exposure to particulate matter with aerodynamic diameter of 2.5 µm or less (PM2.5). We examined long-term exposure to PM2.5 in cohorts of aluminum smelters and fabrication workers in the United States who were followed for incident ischemic heart disease from 1998 to 2012, and we addressed 2 forms of survivor bias. Left truncation bias was addressed by restricting analyses to the subcohort hired after the start of follow up. Healthy worker survivor bias, which is characterized by time-varying confounding that is affected by prior exposure, was documented only in the smelters and required the use of marginal structural Cox models. When comparing always-exposed participants above the 10th percentile of annual exposure with those below, the hazard ratios were 1.67 (95% confidence interval (CI): 1.11, 2.52) and 3.95 (95% CI: 0.87, 18.00) in the full and restricted subcohorts of smelter workers, respectively. In the fabrication stratum, hazard ratios based on conditional Cox models were 0.98 (95% CI: 0.94, 1.02) and 1.17 (95% CI: 1.00, 1.37) per 1 mg/m(3)-year in the full and restricted subcohorts, respectively. Long-term exposure to occupational PM2.5 was associated with a higher risk of ischemic heart disease among aluminum manufacturing workers, particularly in smelters, after adjustment for survivor bias

    On the effectiveness of the thermoelectric energy filtering mechanism in low-dimensional superlattices and nano-composites

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    Electron energy filtering has been suggested as a promising way to improve the power factor and enhance the ZT figure of merit of thermoelectric materials. In this work, we explore the effect that reduced dimensionality has on the success of the energy-filtering mechanism for power factor enhancement. We use the quantum mechanical non-equilibrium Green's function method for electron transport including electron-phonon scattering to explore 1D and 2D superlattice/nanocomposite systems. We find that, given identical material parameters, 1D channels utilize energy filtering more effectively than 2D as they: (i) allow one to achieve the maximal power factor for smaller well sizes/smaller grains which are needed to maximize the phonon scattering, (ii) take better advantage of a lower thermal conductivity in the barrier/boundary materials compared to the well/grain materials in both: enhancing the Seebeck coefficient; and in producing a system which is robust against detrimental random deviations from the optimal barrier design. In certain cases, we find that the relative advantage can be as high as a factor of 3. We determine that energy-filtering is most effective when the average energy of carrier flow varies the most between the wells and the barriers along the channel, an event which occurs when the energy of the carrier flow in the host material is low, and when the energy relaxation mean-free-path of carriers is short. Although the ultimate reason for these aspects, which cause a 1D system to see greater relative improvement than a 2D, is the 1D system's van Hove singularity in the density-of-states, the insights obtained are general and inform energy-filtering design beyond dimensional considerations

    A Bayesian Joint Model for Compositional Mediation Effect Selection in Microbiome Data

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    Analyzing multivariate count data generated by high-throughput sequencing technology in microbiome research studies is challenging due to the high-dimensional and compositional structure of the data and overdispersion. In practice, researchers are often interested in investigating how the microbiome may mediate the relation between an assigned treatment and an observed phenotypic response. Existing approaches designed for compositional mediation analysis are unable to simultaneously determine the presence of direct effects, marginal indirect effects, overall indirect effects, as well potential confounders, while simultaneously quantifying their uncertainty. We propose a formulation of a Bayesian joint model for compositional data that allows for the identification, estimation, and uncertainty quantification of various causal estimands in high-dimensional mediation analysis. We conduct simulation studies and compare our method's mediation effects selection performance with existing methods. Finally, we apply our method to a benchmark data set investigating the sub-therapeutic antibiotic treatment effect on body weight in early-life mice

    Dependence of DC characteristics of CNT MOSFETs on bandstructure models

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    http://www.gianlucafiori.org/articles/CNTieeenano.pd

    Numerical study of the thermoelectric power factor in ultra-thin Si nanowires

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    Low dimensional structures have demonstrated improved thermoelectric (TE) performance because of a drastic reduction in their thermal conductivity, {\kappa}l. This has been observed for a variety of materials, even for traditionally poor thermoelectrics such as silicon. Other than the reduction in {\kappa}l, further improvements in the TE figure of merit ZT could potentially originate from the thermoelectric power factor. In this work, we couple the ballistic (Landauer) and diffusive linearized Boltzmann electron transport theory to the atomistic sp3d5s*-spin-orbit-coupled tight-binding (TB) electronic structure model. We calculate the room temperature electrical conductivity, Seebeck coefficient, and power factor of narrow 1D Si nanowires (NWs). We describe the numerical formulation of coupling TB to those transport formalisms, the approximations involved, and explain the differences in the conclusions obtained from each model. We investigate the effects of cross section size, transport orientation and confinement orientation, and the influence of the different scattering mechanisms. We show that such methodology can provide robust results for structures including thousands of atoms in the simulation domain and extending to length scales beyond 10nm, and point towards insightful design directions using the length scale and geometry as a design degree of freedom. We find that the effect of low dimensionality on the thermoelectric power factor of Si NWs can be observed at diameters below ~7nm, and that quantum confinement and different transport orientations offer the possibility for power factor optimization.Comment: 42 pages, 14 figures; Journal of Computational Electronics, 201
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