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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 55 records · Page 3
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

Binary pseudo-random patterned structures for modulation transfer function calibration and resolution characterization of a full-field transmission soft x-ray microscope

We present a modulation transfer function (MTF) calibration method based on binary pseudo-random (BPR) one-dimensional sequences and two-dimensional arrays as an effective method for spectral characterization in the spatial frequency domain of a broad variety of metrology instrumentation, including interferometric microscopes, scatterometers, phase shifting Fizeau interferometers, scanning and transmission electron microscopes, and at this time, x-ray microscopes. The inherent power spectral density of BPR gratings and arrays, which has a deterministic white-noise-like character, allows a direct determination of the MTF with a uniform sensitivity over the entire spatial frequency range and field of view of an instrument. We demonstrate the MTF calibration and resolution characterization over the full field of a transmission soft x-ray microscope using a BPR multilayer (ML) test sample with 2.8 nm fundamental layer thickness. We show that beyond providing a direct measurement of the microscope’s MTF, tests with the BPRML sample can be used to fine tune the instrument’s focal distance. Our results confirm the universality of the method that makes it applicable to a large variety of metrology instrumentation with spatial wavelength bandwidths from a few nanometers to hundreds of millimeters.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2018

A practical field guide to thermoelectrics: Fundamentals, synthesis, and characterization

The study of thermoelectric materials spans condensed matter physics, materials science and engineering, and solid-state chemistry. The diversity of the participants and the inherent complexity of the topic mean that it is difficult, if not impossible, for a researcher to be fluent in all aspects of the field. This review, which grew out of a one-week summer school for graduate students, aims to provide an introduction and practical guidance for selected conceptual, synthetic, and characterization approaches and to craft a common umbrella of language, theory, and experimental practice for those engaged in the field of thermoelectric materials. This review does not attempt to cover all major aspects of thermoelectric materials research or review state-of-the-art thermoelectric materials. Rather, the topics discussed herein reflect the expertise and experience of the authors. We begin by discussing a universal approach to modeling electronic transport using Landauer theory. The core sections of the review are focused on bulk inorganic materials and include a discussion of effective strategies for powder and single crystal synthesis, the use of national synchrotron sources to characterize crystalline materials, error analysis, and modeling of transport data using an effective mass model, and characterization of phonon behavior using inelastic neutron scattering and ultrasonic speed of sound measurements. The final core section discusses the challenges faced when synthesizing carbon-based samples and the measuring or interpretation of their transport properties. We conclude this review with a brief discussion of some of the grand challenges and opportunities that remain to be addressed in the study of thermoelectrics.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2014

SU-E-T-596: Axillary Nodes Radiotherapy Boost Field Dosimetric Impact Study: Oblique Field and Field Optimization in 3D Conventional Breast Cancer Radiation Treatment

Purpose: To evaluate dosimetric impact of two axillary nodes (AX) boost techniques: (1) posterior-oblique optimized field boost (POB), (2) traditional posterior-anterior boost (PAB) with field optimization (O-PAB), for a postmastectomy breast patient with positive axillary lymph nodes. Methods: Five patients, 3 left and 2 right chest walls, were included in this study. All patients were simulated in 5mm CT slice thickness. Supraclavicular (SC) and level I/II/III AX were contoured based on the RTOG atlas guideline. Five treatment plans, (1) tangential chest wall, (2) oblique SC including AX, (3) PAB, O-PAB and POB, were created for each patient. Three plan sums (PS) were generated by sum one of (3) plan with plan (1) and (2). The field optimization was done through PS dose distribution, which included a field adjustment, a fractional dose, a calculation location and a gantry angle selection for POB. A dosimetric impact was evaluated by comparing a SC and AX coverage, a PS maximum dose, an irradiated area percentage volume received dose over 105% prescription dose (V105), an ipsi-laterial mean lung dose (MLD), an ipsi-laterial mean humeral head dose (MHHD), a mean heart dose (MHD) (for left case only) and their DVH amount these three technique. Results: O-PAB, POB and PAB dosimetric results showed that there was no significant different on SC and AX coverage (p>0.43) and MHD (p>0.16). The benefit of sparing lung irradiation from PAB to O-PAB to POB was significant (p<0.004). PAB showed a highest PS maximum dose (p<0.005), V105 (p<0.023) and MLD (compared with OPAB, p=0.055). MHHD showed very sensitive to the patient arm positioning and anatomy. O-PAB convinced a lower MHHD than PAB (p=0.03). Conclusion: 3D CT contouring plays main role in accuracy radiotherapy. Dosimetric advantage of POB and O-PAB was observed for a better normal tissue irradiation sparing.

60 APPLIED LIFE SCIENCES↗
NASA NTRS1985

Large-scale, near-field magnetic fields from external sources and the corresponding induced internal field

Data from Magsat analyzed as a function of the Dst index to determine the first degree/order spherical harmonic description of the near-earth external field and its corresponding induced field. The analysis was done separately for data from dawn and dusk. The Magsat data was compared with POGO data. A local time variation of the external field persists even during very quiet magnetic conditions; both a diurnal and 8-hour period are present. A crude estimate of Sq current in the 45 deg geomagnetic latitude range is obtained for 1966 to 1970. The current strength, located in the ionosphere and induced in the earth, is typical of earlier determinations from surface data, although its maximum is displaced in local time from previous results.

Langel, R. A.↗
NASA NTRS1992

Transient scattering from dielectric cylinders - E-field, H-field, and combined field solutions

In this work, the problem of transient scattering by arbitrarily shaped two-dimensional dielectric cylinders is solved using the marching-on-in-time technique. The dielectric problem is approached via the equivalence principle. Three different formulations, namely, the electric field integral equation formulation, the magnetic field integral equation formulation, and the combined field integral equation formulation are considered. Numerical results are presented for two cross sections, namely, a circle and a square, and compared with inverse discrete Fourier transform (IDFT) techniques. In each case, good agreement is obtained with the IDFT solution.

Vechinski, Douglas A.↗
DOE OSTI2015

Simulation of Heterogeneous Atom Probe Tip Shape Evolution during Field Evaporation Using a Level Set Method and Different Evaporation Models

Accurate reconstruction of spatial positions of field evaporated ions from detector patterns depends on a correct understanding of the tip shape evolution and evaporation laws of component atoms. Reconstruction artifacts introduced in the heterogeneous tip can be contributed by the assumption on homogeneous evaporation behavior. A level set method based specimen shape evolution model is developed in this study to simulate the evaporation of synthetic layered-structured atom probe tip. The simulation results of the shape evolution by the present level set model agree well with the literature data using other numerical approaches, i.e. finite difference method. The asymmetric evolving shape predicted by the level set model demonstrates that the complex evaporation behavior of heterogeneous tips and interface curvature can potentially lead to the tip reconstruction distortion. Compared with other shape evaporation methods the new method provides considerably higher resolution and computational efficiency with the aid of the intrinsic subgrid scale accuracy.

atom probe tomography, field evaporation, tip shap↗
DOE OSTI2014

Probing the limits of Si:P δ -doped devices patterned by a scanning tunneling microscope in a field-emission mode

Recently, a single atom transistor was deterministically fabricated using phosphorus in Si by H-desorption lithography with a scanning tunneling microscope (STM). This milestone in precision, achieved by operating the STM in the conventional tunneling mode, typically utilizes slow (∼102 nm2/s) patterning speeds. By contrast, using the STM in a high-voltage (>10 V) field-emission mode, patterning speeds can be increased by orders of magnitude to ≳104 nm2/s. We show that the rapid patterning negligibly affects the functionality of relatively large micron-sized features, which act as contacting pads for these devices. For nanoscale structures, we show that the resulting electrical transport is consistent with the donor incorporation chemistry constraining the electrical dimensions to a scale of 10 nm even though the pattering spot size is 40 nm.

Rudolph, M.↗
DOE OSTI2015

The one-loop matter bispectrum in the Effective Field Theory of Large Scale Structures

With this study, given the importance of future large scale structure surveys for delivering new cosmological information, it is crucial to reliably predict their observables. The Effective Field Theory of Large Scale Structures (EFTofLSS) provides a manifestly convergent perturbative scheme to compute the clustering of dark matter in the weakly nonlinear regime in an expansion in k/k NL , where k is the wavenumber of interest and k NL is the wavenumber associated to the nonlinear scale. It has been recently shown that the EFTofLSS matches to 1% level the dark matter power spectrum at redshift zero up to k ≃ 0.3 h Mpc –1 and k ≃ 0.6 h Mpc –1 at one and two loops respectively, using only one counterterm that is fit to data. Similar results have been obtained for the momentum power spectrum at one loop. This is a remarkable improvement with respect to former analytical techniques. Here we study the prediction for the equal-time dark matter bispectrum at one loop. We find that at this order it is sufficient to consider the same counterterm that was measured in the power spectrum. Without any remaining free parameter, and in a cosmology for which kNL is smaller than in the previously considered cases (σ 8 =0.9), we find that the prediction from the EFTofLSS agrees very well with N-body simulations up to k ≃ 0.25 h Mpc –1 , given the accuracy of the measurements, which is of order a few percent at the highest k's of interest. While the fit is very good on average up to k ≃ 0.25 h Mpc –1 , the fit performs slightly worse on equilateral configurations, in agreement with expectations that for a given maximum k, equilateral triangles are the most nonlinear.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

Enhancement and Tunability of Near-Field Radiative Heat Transfer Mediated by Surface Plasmon Polaritons in Thin Plasmonic Films

The properties of thermal radiation exchange between hot and cold objects can be strongly modified if they interact in the near field where electromagnetic coupling occurs across gaps narrower than the dominant wavelength of thermal radiation. Using a rigorous fluctuational electrodynamics approach, we predict that ultra-thin films of plasmonic materials can be used to dramatically enhance near-field heat transfer. The total spectrally integrated film-to-film heat transfer is over an order of magnitude larger than between the same materials in bulk form and also exceeds the levels achievable with polar dielectrics such as SiC. We attribute this enhancement to the significant spectral broadening of radiative heat transfer due to coupling between surface plasmon polaritons (SPPs) on both sides of each thin film. We show that the radiative heat flux spectrum can be further shaped by the choice of the substrate onto which the thin film is deposited. In particular, substrates supporting surface phonon polaritons (SPhP) strongly modify the heat flux spectrum owing to the interactions between SPPs on thin films and SPhPs of the substrate. The use of thin film phase change materials on polar dielectric substrates allows for dynamic switching of the heat flux spectrum between SPP-mediated and SPhP-mediated peaks

42 ENGINEERING↗
DOE OSTI2015

Phase-field simulations of GaN growth by selective area epitaxy from complex mask geometries

Three-dimensional phase-field simulations of GaN growth by selective area epitaxy were performed. The model includes a crystallographic-orientation-dependent deposition rate and arbitrarily complex mask geometries. The orientation-dependent deposition rate can be determined from experimental measurements of the relative growth rates of low-index crystallographic facets. Growth on various complex mask geometries was simulated on both c-plane and a-plane template layers. Agreement was observed between simulations and experiment, including complex phenomena occurring at the intersections between facets. The sources of the discrepancies between simulated and experimental morphologies were also investigated. The model provides a route to optimize masks and processing conditions during materials synthesis for solar cells, light-emitting diodes, and other electronic and opto-electronic applications.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Rigorous force field optimization principles based on statistical distance minimization

We use the concept of statistical distance to define a measure of distinguishability between a pair of statistical mechanical systems, i.e., a model and its target, and show that its minimization leads to general convergence of the model’s static measurable properties to those of the target. We exploit this feature to define a rigorous basis for the development of accurate and robust effective molecular force fields that are inherently compatible with coarse-grained experimental data. The new model optimization principles and their efficient implementation are illustrated through selected examples, whose outcome demonstrates the higher robustness and predictive accuracy of the approach compared to other currently used methods, such as force matching and relative entropy minimization. We also discuss relations between the newly developed principles and established thermodynamic concepts, which include the Gibbs-Bogoliubov inequality and the thermodynamic length.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

Mapping magnetic fields of Fe{sub 3}O{sub 4} nanosphere assemblies by electron holography

Crystalline Fe{sub 3}O{sub 4} nanospheres with averaged diameters of 150 nm have been synthesized by a facile solvothermal method and characterized using transmission electron microscopy and electron holography. The nanospheres can self-assemble into either chain-like or ring-like shapes with sizes of a few micrometers, where large magnetic moments are found for individual particles at the remanent state and lead to strong fringing field in vicinity of the assemblies. Magnetic dipolar moments can be aligned both within and out of the sample plane, with a typical length scale on the order of 500 nm.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

CO 2 storage in depleted oil and gas fields in the Gulf of Mexico

Depleted oil and gas reservoirs are one of the prime-candidate formations for geologic CO 2 storage. Although both the geological structure and the physical properties of most of them have been extensively studied and characterized, there is limited data on the assessment of the CO 2 storage capacity, especially in the offshore fields. The purpose of this study is to develop a high-level quantitative assessment of the CO 2 volume that can be stored in depleted oil and gas fields in the Federal offshore regions of the Gulf of Mexico (GOM), both on a field-by-field and on a reservoir-by-reservoir basis. In this study, we simulated CO 2 storage in 461 of the depleted oil and gas reservoirs (73 fields) among 3514 reservoirs (675 fields) in the GOM (2013 BOEM Reserves database). Based on the simulation results, we improved the Department of Energy (DOE) CO 2 Storage Resource Estimate Equation to make more refined and accurate estimates of storable CO 2 volumes. Newly revised efficiency factor (ERoil/gas) correlates better with hydrocarbon recovery factor (HCRF), which is found to be a strong indicator of the CO 2 storage capacity of the reservoir. The higher HCRF results in higher ERoil/gas. The further investigations resulted in an improved, material balance-based correlation—which is called the Production-CO 2 Storage Correlation—between cumulative production (free gas, oil and water) at reservoir conditions and CO 2 storage volume at standard conditions. This relationship, which is unique for all three types of reservoirs (gas, oil and combination), allows for making direct estimates of CO 2 storage volume using only existing production data. Application of these correlations to all of the depleted fields (3514 reservoirs) yields CO 2 storage capacities of 4748 MMtons, and the CO 2 storage capacity in all 1295 depleted and active fields (13,289 reservoirs) in the GOM calculated to be 21.57 Billion tons. If a 5000 psia surface injection pressure constraint was applied, these volumes would be reduced to 4075 MMtons for all depleted fields only and to 15.80 Billion tons for all depleted and active fields in the GOM. Therefore, the production-CO 2 storage correlations can be used to make more accurate CO 2 storage volume estimates in all onshore and offshore depleted oil and gas fields.

03 NATURAL GAS↗