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At least 1,261 records · Page 70

Statistical analysis of correlations in the x-ray induced Coulomb explosion of iodopyridine

Coulomb explosion imaging is a promising experimental tool to study individual molecules. Here, in this work simulation data for the x-ray induced Coulomb explosion of 2-iodopyridine is analyzed and the involved fragmentation dynamics are described. It is found that particular final ion momenta show correlations that reflect a collision of two atoms during the explosion. Variations of the proton kinetic energies can be associated with variations in the charge build-up time. Covariances of the forces during the explosion can be utilized to simplify the description of the dynamics in reduced dimensionality using only four collective coordinates.

74 ATOMIC AND MOLECULAR PHYSICS↗

Liquefied Bleed for Stability and Efficiency of High Speed Inlets

A mission analysis code was developed to perform a trade study on the effectiveness of liquefying bleed for the inlet of the first stage of a TSTO vehicle. By liquefying bleed, the vehicle weight (TOGW) could be reduced by 7 to 23%. Numerous simplifying assumptions were made and lessons were learned. Increased accuracy in future analyses can be achieved by: Including a higher fidelity model to capture the effect of rescaling (variable vehicle TOGW). Refining specific thrust and impulse models ( T m a and Isp) to preserve fuel-to-air ratio. Implementing LH2 for T m a and Isp. Correlating baseline design to other mission analyses and correcting vehicle design elements. Implementing angle-of-attack effects on inlet characteristics. Refining aerodynamic performance (to improve L/D ratio at higher Mach numbers). Examining the benefit with partial cooling or densification of the bleed air stream. Incorporating higher fidelity weight estimates for the liquefied bleed system (heat exchange and liquid storage versus bleed duct weights) could be added when more fully developed. Adding trim drag or 6-degree-of-freedom trajectory analysis for higher fidelity. Investigating vehicle optimization for each of the bleed configurations.

Saunders, J. David↗

Digital tracking loops for a programmable digital modem

In this paper, an analysis and hardware emulation of the tracking loops for a very flexible programmable digital modem (PDM) will be presented. The modem is capable of being programmed for 2, 4, 8, 16-PSK, 16-QAM, MSK, and Offset-QPSK modulation schemes over a range of data rates from 2.34 to 300 Mbps with programmable spectral occupancy from 1.2 to 1.8 times the symbol rate; these operational parameters are executable in burst or continuous mode. All of the critical processing in both the modulator and demodulator is done at baseband with very high-speed digital hardware and memory. Quadrature analog front-ends are used for translation between baseband and the IF center frequency. The modulator is based on a table lookup approach, where precomputed samples are stored in memory and clocked out according to the incoming data pattern. The sample values are predistorted to counteract the effects of the other filtering functions in the link as well as any transmission impairments. The demodulator architecture was adapted from a joint estimator-detector (JED) mathematical analysis. Its structure is applicable to most signalling formats that can be represented in a two-dimensional space. The JED realization uses interdependent, mutually aiding tracking loops with post-detection data feedback. To expedite and provide for more reliable synchronization, initial estimates for these loops are computed in a parallel acquisition processor. The cornerstone of the demodulator realization is the pre-averager received data filter which allows operation over a broad range of data rates without any hardware changes and greatly simplifies the implementation complexity. The emulation results confirmed tracking loop operation over the entire range of operational parameters listed above, as well as the capability of achieving and maintaining synchronization at BER's in excess of 10(exp -1). The emulation results also showed very close agreement with the tracking loop analysis, and validated the resolution apportionment of the various hardware elements in the tracking loops.

Poklemba, John J.↗

Glass formation during combinatorial sputtering in binary alloys

Glass formation is a complex phenomenon influenced by thermodynamic and kinetic aspects, which are often controlled by extrinsic contributions. While bulk metallic glasses are typically multicomponent alloys, binary alloys offer a simplified approach to studying glass formation. In this study, we fabricated 57 binary alloy systems through combinatorial sputtering, where each alloy system is represented in 66 different alloys. We developed an automated analysis to determine structure and composition using X-ray diffraction and energy-dispersive X-ray spectroscopy for over 3700 alloys. We found that ∼17 % of the alloys form glasses under the estimated cooling rate during sputtering of ∼10 8 K/s. Data analysis revealed that commonly used factors like atomic size ratio and heat of mixing are ineffective in predicting glass formation. However, the crystal structure mismatch of the alloys’ elements emerged as the strongest indicator of glass formation under sputtering conditions of binary alloys. Here, the differences in glass formation under slow cooling rates used for bulk glass formation and the here observed glass formation under rapid cooling rates are discussed.

Binary alloys↗

Partial-wave projection of relativistic three-body amplitudes

We derive the integral equations for partial-wave projected three-body scattering amplitudes, starting from the integral equations for three-body amplitudes developed for lattice QCD analyses. The results, which hold for generic three-body systems of spinless particles, build upon the recently derived partial-wave projected one-particle exchange, a primary component of the relativistic framework proven to satisfy 𝑆 matrix unitarity. We derive simplified expressions for factorizable short-distance interactions, 𝒦 3 , in two equivalent formalisms—one symmetric under particle interchange and one asymmetric. For the asymmetric case, we offer parametrizations useful for amplitude analysis. Finally, we examine toy models for 3⁢𝜋 systems at unphysically heavy pion masses with total isospins 0, 1, and 2.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Interaction models and configurational entropies of binary MoTa and the MoNbTaW high entropy alloy

We introduce a simplified method to model the interatomic interactions of high entropy alloys based on a lookup table of cluster energies. Furthermore, these interactions are employed in replica exchange Monte Carlo simulations with histogram analysis to obtain thermodynamic properties across a broad temperature range. Kikuchi's cluster variation method entropy formalism is applied to directly calculate entropy from statistics on short- and long-range chemical order, and we discuss the convergence of the entropy as clusters of differing size are included. A high temperature series expansion aids in our understanding of the convergence. Computer codes implementing these methods, and supporting data, are freely available on the internet.

36 MATERIALS SCIENCE↗

A Review of the Mechanical Properties of Materials Used in Nb 3 Sn Magnets for Particle Accelerators

Superconducting magnets experience significant thermo-mechanical loads throughout their life cycle. These are introduced by the electro-magnetic forces during powering, but also by the prestress applied in many magnet designs. Further to this, the large thermal excursion that components of different materials experience can generate significant internal forces. The loads are also experienced by the superconducting coils, whose critical current can decrease as a consequence of the applied strain. It is then crucial to predict the overall mechanical behavior and conservatively design a magnet, avoiding failure of the mechanical components and of the superconducting coils. Finite Element Analysis (FEA) is generally used to perform these tasks, but its results rely heavily on the material properties and models used. This is in particular true for the coil composite, which is simplified to allow reasonable model sizes in full magnet models. Here we present the state-of-art knowledge of the mechanical properties of the materials mostly used in superconducting magnet construction. We review elastic and plastic properties at room and cryogenic temperature, thermal contraction, and summarize the state-of-art failure criteria for these materials. Finally, the paper summarizes the present understanding of the mechanical behavior and limits of Nb3Sn coils. For the first time, an orthotropic failure criteria is proposed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Design by analysis rules for ASME Section III, Division 5, Class B components

The current rules for elevated temperature ASME Section III, Division 5, Class B components, other than piping, were basically adapted from the Design-by-Rule approach for Section VIII, Division 1 vessels. A goal of the proposed new rules is to explicitly account for the design life and cyclic service while recognizing the less-rigorous requirements commensurate with lesser safety consideration. Further goals are to maximize the use of modern computational technology, for example finite element analysis in conjunction with reference stress concepts, and to avoid the need for stress classification. This paper summarizes the work done to address these issues. A summary of the design-by-analysis for primary loads, strain limit evaluation, and creep-fatigue damage assessment is presented. The proposed design-by-analysis creep-fatigue damage calculation approach uses a new elastic follow-up-based Isochronous Stress Strain Curve stress relaxation procedure. A set of sample problems are selected to validate the proposed design-by-analysis rules for creep-fatigue damage assessment. The proposed Class B rules are evaluated against the Class A elastic design rules and the experimental data obtained from a family of a simplified model test-based key-feature test results. The proposed Class B creep-fatigue damage assessment methodology yields conservative design cycles estimates compared to the experimental results.

36 MATERIALS SCIENCE↗

From 2D to 4D: a containerized workflow and browser to explore dynamic chromatin architecture

Background Characterizing the physical organization of the genome is essential for understanding long-range gene regulation, chromatin compartmentalization, and epigenetic accessibility. Hi-C experiments generate two-dimensional (2D) genome-wide contact maps of chromatin interactions by capturing the spatial proximity between genomic loci, which reveal interaction frequencies but lack the spatial resolution needed to interpret the three-dimensional (3D) genome structure(s). Emerging evidence suggests that epigenetic regulation is closely linked to 3D genome architecture, and that structural changes over time (4D) drive key biological processes in development, disease, and environmental response. Thus, integrating 3D structure with functional data is critical for a more complete understanding of genome regulation. Previous work, most notably the 4DHiC chromosome modeling framework, has shown that physical multi-dimensional modeling approaches rooted in polymer physics and molecular dynamics can resolve these structures at biologically meaningful resolutions by integrating temporal Hi-C data with physical constraints to uncover dynamic chromosome reorganization. Thus, molecular dynamics simulations, constrained by Hi-C contact matrices, can resolve fine-scale structural changes and reveal functionally significant transitions in chromatin conformation. Results Herein, we present the 4D Genome Browser Workflow (4DGBWorkflow) and the 4D Genome Browser (4DGB). The algorithm is based on the 4DHiC method, and the containerized tool is an end-to-end workflow that can transform, filter, and view 4D epigenomics and chromatin datasets, allowing non-specialists to apply three-dimensional modeling principles to diverse datasets and experimental conditions. The software executes on a laptop running macOS, Linux or Windows. From input Hi-C files (.hic), the 4DGBWorkflow produces 3D reconstructions of chromosomes, integrates the reconstruction with track data (e.g., epigenetic marks, transcriptome profiles), and provides comparative visualization of the results in a single workflow. Conclusions The 4DGBWorkflow and 4D Genome Browser are open-source tools for comparative analysis and visualization of 4D chromosome datasets, including chromatin architecture and epigenomic signals. Automatic integration of Hi-C data with molecular dynamics democratizes the construction of time resolved 3D genome structures, simplifying complex simulations and data integration schemes.

3D Genome Browser↗

Some refinements of the theory of the viscous screw pump.

Recently performed analysis for herringbone thrust bearings has been incorporated into the theory of the viscous screw pump for Newtonian fluids. In addition, certain earlier corrections for sidewall and channel curvature effects have been simplified. The result is a single, refined formula for the prediction of the pressure-flow relation for these pumps.

Elrod, H. G.↗

Simplified thermal analyzer

Simplified Shuttle Payload Thermal Analyzer (SSPTA) aids in evaluating thermal design of instruments to be flown in Space Shuttle cargo bay. It is collection of programs that are currently used in thermal analysis of spacecraft, modified for quick, preliminary analysis of payloads. Although designed primarily to analyze Shuttle payloads, it can be easily used for thermal analysis in other situations.

Coyle, M. J.↗

Convective instability when the temperature gradient and rotation vector are oblique to gravity. I - Fluids without diffusion

A linear stability analysis of fluid layers under uniform rotation (generally oblique to gravity) which possess both vertical and horizontal temperature gradients is made by considering ideal fluids without diffusion within a Boussinesq approximation. This simplified configuration is used to assess the preferred convective modes as a function of latitude on a planet like Jupiter. The tilted rotation vector introduces a preference for roll-like disturbances with north-south orientations, while the horizontal temperature gradient produces a thermal wind shear which favors convective rolls oriented parallel to the flow in an east-west direction. It is found that the horizontal temperature gradient needed to produce a preference for the axisymmetric or east-west rolls increases with an increasing rotation rate and a decreasing latitude. The parameter values for Jupiter are estimated with the use of a simple radiative convective model, indicating a preference for axisymmetric rolls at nearly all latitudes if the convection zone depth is greater than about 200 km below the one atmosphere pressure level and convective roll characteristics which contribute to an equatorial acceleration.

Hathaway, D. H.↗

A simplified dynamic model of the T700 turboshaft engine

A simplified open-loop dynamic model of the T700 turboshaft engine, valid within the normal operating range of the engine, is developed. This model is obtained by linking linear state space models obtained at different engine operating points. Each linear model is developed from a detailed nonlinear engine simulation using a multivariable system identification and realization method. The simplified model may be used with a model-based real time diagnostic scheme for fault detection and diagnostics, as well as for open loop engine dynamics studies and closed loop control analysis utilizing a user generated control law.

Duyar, Ahmet↗

Simplified Computation Of Blade-Surface Coordinates

Coordinates of points on complicated three-dimensional surface of turbo-machine blade computed by method partly simplifying three-dimensional problem to two-dimensional problem. Method implemented in computer program enabling rapid hydrodynamical evaluation and optimization of blade surface prior to definition of final design of, and analysis of stresses in blade. By incorporating program into procedure for designing turbomachine, one reduces time spent on design iterations.

Chen, Wei-Chung↗

Identification of the open loop dynamics of the T700 turboshaft engine

A simplified model of the T700 turboshaft engine open loop dynamics valid within the normal operating range of the engine is developed. This model is obtained by linking the linearized point models obtained at five different operating conditions of the engine. The simplified model may be used with a model-based real time diagnostic scheme for fault detection and diagnostics, as well as for open loop engine dynamics studies and closed loop control analysis utilizing a user generated control law.

Duyar, Ahmet↗

An evaluation with the Fourier Amplitude Sensitivity Test (FAST) of which land-surface parameters are of greatest importance in atmospheric modeling

Land-surface parameterizations based on a statistical-dynamical have been suggested recently to improve the representation of the surface forcing from heterogeneous land in atmospheric models. With this approach, land-surface characteristics are prescribed by probability density functions (PDFs) rather than single 'representative' values as in 'big-leaf' parameterizations. Yet the use of many PDFs results in an increased computational burden and requires the complex problem of representing covariances between PDFs to be addressed. In this study, a sensitivity analysis of a land-surface parameterization for atmospheric modeling was performed to evaluate the surface parameters most important to the variability of surface heat fluxes. The Fourier amplitude sensitivity test (FAST) used for this analysis determines the relative contribution of individual input parameters to the variance of energy fluxes resulting from a heterogeneous surface. By simultaneously varying all parameters according to their individual probability density functions, the number of computations needed is very much reduced by this technique. This analysis demonstrates that most of the variability of surface heat fluxes may be described by the distributions of relative stomatal conductance and surface roughness. Thus, the statistical-dynamical approach may be simplified by the use of only these two probability density functions.

Collins, Dan C.↗

Solar Proton Transport within an ICRU Sphere Surrounded by a Complex Shield: Combinatorial Geometry

The 3DHZETRN code, with improved neutron and light ion (Z (is) less than 2) transport procedures, was recently developed and compared to Monte Carlo (MC) simulations using simplified spherical geometries. It was shown that 3DHZETRN agrees with the MC codes to the extent they agree with each other. In the present report, the 3DHZETRN code is extended to enable analysis in general combinatorial geometry. A more complex shielding structure with internal parts surrounding a tissue sphere is considered and compared against MC simulations. It is shown that even in the more complex geometry, 3DHZETRN agrees well with the MC codes and maintains a high degree of computational efficiency.

Wilson, John W.↗

Demonstration of Probabilistic Sensitivity Analyses Tools on the Structural Response of a Representative Inflatable Space Structure

This work provides an initial step toward demonstrating a probabilistic numerical simulation capability to support trade studies and the development of a certification plan for inflatable space habitats. This study concentrates on interpreting the results from probabilistic analysis and numerical simulation tools to identify parameter sensitivities for a novel inflatable airlock concept, specifically the Non‐Axisymmetric Inflatable Pressure Structure (NAIPS) that was designed and tested under NASA's Minimalistic Advanced Softgoods Hatch (MASH) Program. A brief overview of the finite element model is provided along with the probabilistic sensitivity analysis approach. The sensitivity studies required a model that was numerically stable and efficient enough that hundreds of simulations could be completed in the allotted time. Therefore, the existing full model was simplified by: extracting a quarter symmetry section of the dome; focusing on a single inflation pressure; and replacing the non‐linear material stress‐strain curves with linear, isotropic materials defined by elastic moduli. Responses of interest include the sensitivity of various structural component loads to material properties, cord lengths, inflation pressure and friction. Multiple sensitivity studies were completed and three are reported here. The first study focused on utilizing wide input parameter ranges to provide an opportunity to assess numerical robustness. The next two studies narrowed the parameter ranges to enable focus on understanding uncertainty at a fixed operating condition. The completion of the sensitivity studies improved understanding of the interdependence of multiple inputs on the responses. In addition, numerical stability of the simulations over wide parameter ranges, shows the feasibility of incorporating uncertainty‐based methods in the design and certification of inflatable space habitats. With the experience and trust gained, it is anticipated that these same methods will be applied to nonlinear, orthotropic models in the future.

Lyle, Karen H.↗