High-Resolution In-Situ Synchrotron X-Ray Studies of Inorganic Perovskite CsPbBr[subscript 3]: New S
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Liu, Sizhan↗
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Results for “phase space methods”
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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Synthesis, Structural Characterization and Chemical Bonding of Sr 7 Li 6 Sn 12 and its Quaternary Derivatives with Eu and Alkaline Earth Metal (Mg, Ca, Ba) Substitutions. A Tale of Seven Li‐Containing Stannides and Two Complex Crystal Structures
In this paper, we discuss the synthesis and the structural characterization of the new ternary compound Sr 7 Li 6 Sn 12 and its six quaternary derivatives, where alkaline earth metals (Ca, Mg, Ba) and the rare earth metal Eu are substituted, yielding crystalline phases of monoclinic or orthorhombic symmetry. The title compounds were synthesized via high‐temperature solid‐state reactions of the corresponding elements. The crystal structures were determined by single‐crystal X‐ray diffraction methods. The (Sr,Ca) 7 Li 6 Sn 12 and Eu 7 (Mg,Li) 6 Sn 12 phases represent a new structure type (space group P 2/ m , No. 10) while Sr 7 Li 6 Sn 12 and the rest of the title phases crystallize in the orthorhombic base‐centered space group Cmmm (No. 65) which is similar to the Eu 7 Li 8– x Sn 10+ x ( x ≈ 2.0) phase with the Ce 7 Li 8 Ge 10 structure type (Pearson code oC 50). Careful examination of the resulting structures shows intricate disordering between Li and Sn atoms, which is governed by the total number of valence electrons. The discussion of experimental results is also supported by DFT electronic structure calculations.
Osman, Hussien H.↗
A search for microscopic black holes, string balls, and sphalerons in proton-proton collisions at $\sqrt{s}=13$ TeV
A search for microscopic black holes, string balls, and electroweak sphalerons using proton-proton collisions at $\sqrt{s}=13$ TeV recorded with the CMS detector at the CERN LHC during the 2016–2018 data taking, and corresponding to an integrated luminosity of 138 fb −1 , is presented. Two search strategies based on control samples in data are used. Model-independent limits on the cross section of physics phenomena with multiple energetic jets, leptons, and photons are set using a method that relies on the shape invariance of the scalar sum of the transverse momenta of all objects in the event. Model-dependent limits on black hole and sphaleron production are set using a newly introduced method that has been developed for the identification of collider events with distinct kinematic features by separating them into classes based on phase space proximity. In the context of models with large extra dimensions, semiclassical black holes and string balls with masses below 8.4–11.4 TeV and 9.0–10.7 TeV, respectively, are excluded at 95% confidence level, significantly extending the reach beyond previous searches. Results of a dedicated search for electroweak sphalerons are used to derive an upper limit of 0.0034 at 95% confidence level on the fraction of quark-quark interactions, with a center-of-mass energy above the nominal sphaleron transition energy threshold of 9 TeV, that result in a sphaleron transition.
Beyond Standard Model↗
Cosmological perturbation theory for large scale structure in phase space
We develop a framework for Large Scale Structure (LSS) perturbation theory, that solves the Vlasov-Poisson system of equations for the distribution function in full phase space. This approach relaxes the usual apriori assumption of negligible velocity dispersion underlying the Standard Perturbation Theory (SPT). We apply the new method to rederive the usual SPT kernels up to third order in the perturbative expansion. We also show that a counterterm, identical to the one introduced by standard Effective Field Theory (EFT) methods, naturally arises within our framework. We finish by making a precise connection to EFT techniques, which reveals the necessity of the EFTofLSS to self-consistently model the long-wavelength fluid, and illustrates the importance of having theoretical control over short distance fluctuations.
Cosmological perturbation theory in GR and beyond↗
External tank laminar and rarefied aeroheating
A practical method has been developed for calculation of laminar and rarefied aerodynamic heating to the external tank of the Space Shuttle during the ascent phase of flight. A modification of laminar boundary theory is used as the basis for the heating relation. This relation is used in conjunction with a correlation for surface pressures to obtain undisturbed aerodynamic heating. Interference effects on the external tank due to the orbiter are correlated using the rarefaction parameter which was developed as part of the heating relation. The effects of rarefaction on the undisturbed and interference heating are illustrated with test data.
Engel, C. D.↗
Analysis of an infinite array of rectangular microstrip patches with idealized probe feeds
A solution is presented to the problem of an infinite array of microstrip patches fed by idealized current probes. The input reflection coefficient is calculated versus scan angle in an arbitrary scan plane, and the effects of substrate parameters and grid spacing are considered. It is pointed out that even when a Galerkin method is used the impedance matrix is not symmetric due to phasing through a unit cell, as required for scanning. The mechanism by which scan blindness can occur is discussed. Measurement results are presented for the reflection coefficient magnitude variation with angle for E-plane, H-plane, and D-plane scans, for various substrate parameters. Measured results from waveguide simulators are also presented, and the scan blindness phenomenon is observed and discussed in terms of forced surface waves and a modified grating lobe diagram.
Pozar, D. M.↗
Rebuilding the space technology base
NASA's Civil Space Technology Initiative (CSTI) will not only develop novel technologies for space exploration and exploitation, but also take mature technologies into their demonstration phase in earth orbit. In the course of five years, CSTI will pay off in ground- and space-tested hardware, software, processes, methods for low-orbit transport and operation, and fundamental scientific research on the orbital environment. Attention is given to LOX/hydrogen and LOX/hydrocarbon reusable engines, liquid/solid fuel hybrid boosters, and aeroassist flight experiments for the validation of aerobraking with atmospheric friction. Also discussed are advanced scientific sensors, systems autonomy and telerobotics, control of flexible structures, precise segmented reflectors, high-rate high-capacity data handling, and advanced nuclear power systems.
Povinelli, Frederick P.↗
Jet mixing in low gravity - Results of the Tank Pressure Control Experiment
The Tank Pressure Control Experiment (TPCE) is discussed with attention given to the results for controlling storage-tank pressures by forced-convective mixing in microgravitational environments. The fluid dynamics of cryogenic fluids in space is simulated with freon-113 during axial-jet-induced mixing. The experimental flow-pattern data are found to confirm previous data as well as existing mixing correlations. Thermal nonuniformities and tank pressure can be reduced by employing low-energy mixing jets which are useful for enhancing heat/mass transfer between phases. It is found that space cryogenic systems based on the principle of active mixing can be more reliable and predictable than other methods, and continuous or periodic mixing can be accomplished with only minor energy addition to the fluid.
Bentz, M. D.↗
Aerodynamic Properties Analysis of Rapid Prototyped Models Versus Conventional Machined Models
Initial studies of the aerodynamic characteristics of proposed launch vehicles can be made more accurately if lower cost, high fidelity aerodynamic models are available for wind tunnel testing early in the design phase. This paper discusses the results of a study undertaken at NASA's Marshall Space Flight Center to determine if four rapid prototyping methods using a variety of materials are suitable for the design and manufacturing of high speed wind tunnel models in direct testing applications. It also gives an analysis of whether these materials and processes are of sufficient strength and fidelity to withstand the testing environment. In addition to test data, costs and turn-around times for the various models are given. Based on the results of this study, it can be concluded that rapid prototyping models show promise in limited direct application for preliminary aerodynamic development studies at subsonic, transonic, and supersonic speeds.
Springer, A.↗
Electromagnetic Modeling for the Conformal Lightweight Antenna System for Aeronautical Communications Technologies (CLAS-ACT) Program: Final Report
A series of electromagnetic simulations was conducted for the Conformal Lightweight Antenna System for Aeronautical Communications Technologies (CLAS-ACT) Program. The program designed, built, and flight tested a 14.25 GHz conformal patch array antenna for satellite communications on a T-34C airplane. Various studies were performed to evaluate the effects of antenna element spacing, array shape, signal taper, phased array pointing angle, null steering coefficients, antenna platform, and location on the airplane. This report documents the methods and some of the results of tests done over a 2 ½ year period.
Mackenzie, Anne I.↗
Ensemble Forecasting/Assimilation/Emissions Estimation with WRF-Chem/DART: Accomplishments, Lessons Learned, and Future Plans
Over the past ten years, we have been conducting research on regional ensemble atmospheric composition forecasting/data assimilation/emissions estimation with WRF-Chem/DART. WRF- Chem/DART integrates the Weather Research and Forecasting model (WRF) with online chemistry (WRF-Chem) into the Data Assimilation Research Testbed (DART). DART is an ensemble data assimilation system based on the ensemble adjustment Kalman filter (EAKF) with adaptive inflation, localization (physical and state space), and an optional non-Gaussian formulation of the EAKF. DART includes assimilation of meteorological and limited chemical observations. WRF-Chem/DART extends DART to include assimilation of: MOPITT CO; IASI CO and O3; MODIS AOD; OMI O3, NO2, and SO2; TROPOMI CO, O3, NO2, and SO2, TES CO, CO2 (research mode), O3, NH3, and CH4 (research mode); CrIS CO, O3, NH3, CH4 (research mode), and PAN; SCIAMACHY NO2; GOME2a NO2; MLS O3 and HNO3; and proxy TEMPO O3, and NO2 satellite retrievals as raw retrievals or as ‘compact phase space retrievals’ (CPSRs) for profile retrievals. WRF-Chem/DART also assimilates in situ atmospheric composition measurements and uses the ‘state augmentation method’ for emissions estimation. In our presentation, we will provide an overview of WRF-Chem/DART: • applications and results; • lessons learned from: (i) independent versus joint assimilation; (ii) total/partial column versus profile retrieval assimilation; (iii) joint in situ and retrieval assimilation; (iv) assimilation at grid resolutions ranging from 100 km to 4 km; (v) dynamic emissions estimation; and • future work related to wildfire emissions estimation and intercomparison of CMAQ (online)/JEDI and CMAQ (online and offline)/DART.
WRF-Chem/DART↗
Accelerating Thermochemical Equilibrium Calculations for Nuclear Reactor Applications
Thermochemical properties play a key role in modeling and simulation of several key phenomena in nuclear reactors. There has been an increasing interest in incorporating CALPHAD-based formulations in multiphysics simulations including for Molten Salt Reactors where knowledge of phase evolution of the salt and the chemical potentials of various elements are of utmost importance in source term analyses and redox control. However, the size of such simulations is often limited by the high computational cost of full thermodynamic equilibrium calculations. This work discusses the current efforts aimed at accelerating thermochemical equilibrium calculations for multiphysics simulations performed using the open-source finite element / finite volume code Multiphysics Object Oriented Simulation Environment (MOOSE) [1]. While several methods have been proposed for accelerating phase equilibrium calculations [2], most focus on relatively small systems and often rely on a- priori knowledge of the state-space of the system. Nuclear materials, however, are often multi-component systems owing to the evolution of composition under irradiation and an approach based on a-priori mapping of phase diagram is often not enough. This work is aimed at demonstrating an on-the-fly surrogate modeling framework that uses active learning to reduce the number of full equilibrium calculations that must be performed. By combining with efficient coupling approaches, the surrogate framework helps in reducing the computational cost of thermodynamic equilibrium informed multiphysics simulations of nuclear materials. The performance is benchmarked against full coupling with the thermochemistry library Thermochimica [3]. This work uses a machine learning based approach for constructing surrogate models to predict the stable phases in a multicomponent system. The surrogates were constructed using neural networks and Gaussian process classification. In this work, we compare the relative performance of the two methods. We also demonstrate the use of caching previous calculations by interpolating the values from nearest neighbors. References [1] Lindsay, A.D., et al. "2.0 – MOOSE: Enabling massively parallel multiphysics simulation", SoftwareX, 20 (2022): 101202. [2] Roos, W.A. and Zietsman J.H. "Accelerating complex chemical equilibrium calculations – A Review", Calphad, 77 (2022): 102380. [3] Piro, M.H.A., et al. "The thermochemistry library Thermochimica", Computational Materials Science, 67 (2013): 266-272.
36 MATERIALS SCIENCE↗
Interferometer applications of VHF radars, part 3.6A
Using a spaced antenna setup of a VHF radar, the spatial distribution of amplitudes and phases of the radar echoes from the troposphere, stratosphere and mesosphere can be measured. Combining in a suitable analysis procedure the complex digital samples from the different receiving antennas is consistent with the radar interferometer method. In addition to the well-known parameters measured with the commonly applied Doppler and drifts methods, i.e., reflectivity and mean fluctuation velocity, the interferometer technique allows to measure the regular spectrum of the returns. This technique, which was first applied with the spaced antenna system of the SOUSY-VHF-Radar in W. Germany, as well as some first examples of results are described here. These comprise the measurements of the horizontal and vertical velocities of the mean flow as well as of turbulence structures, the aspect sensitivity and the tilt of layers from which the baroclinicity can be estimated. Particularly, results of interferometer measurements of the vertical and horizontal phase velocities and wavelengths of gravity waves in the stratosphere are displayed. The latter results are also discussed in terms of the generation and propagation of these waves.
Rottger, J.↗
CCSDS - SFCG Efficient Modulation Methods Study at NASA/JPL - Phase 4: Interference Susceptibility
Susceptibility to two types of interfering signals was requested by the SFCG: a pure carrier (single frequency tone)and wide-band RFI (characteristics unspecified). Selecting a broad-band interfering signal is diffuclt because it should represent the types of interference to be found in the space science service bands.
Modulation Methods Interference Susceptibility↗
Computational Fluid Dynamics Methods Used in the Development of the Space Launch System Liftoff and Transition Lineloads Databases
The objective of this paper is to document the reasoning and trade studies that supported the selection of appropriate tools for constructing aerodynamic lineload databases for the Liftoff and Transition phases of flight for launch vehicles. These decisions were made amid the maturation of an evolving workflow for generating databases on variants of the Space Launch System launch vehicle, with most being based on results from brief developmental studies performed in response to specific, unforeseen challenges that were encountered in analyzing a given configuration. This report is intended to provide a summary of the results and the decision-making processes chronologically over the design cycles of various configurations, starting with isolated free-air bodies for the Block 1 Crew, then the Block 1B Crew and Cargo configurations, and most recently the Block 1B Crew configuration in proximity to the launch tower. The results from these analyses led to the selection of the CREATE-AV Kestrel flowsolver for simulating these problems. The need to accurately capture the expected leeward-wake flow field characteristics required the use of Delayed Detached Eddy Simulation (DDES) method, for which the vorticity magnitude was employed as the solution Adaptive Mesh Refinement (AMR) function over the off-body Cartesian grid region. In addition, the Spalart-Allmaras (SA) model is used to account for the flow turbulence effects.
Ratnayake, Nalin A.↗
Hole–hole Tamm–Dancoff-approximated density functional theory: A highly efficient electronic structure method incorporating dynamic and static correlation
The study of photochemical reaction dynamics requires accurate as well as computationally efficient electronic structure methods for the ground and excited states. While time-dependent density functional theory (TDDFT) is not able to capture static correlation, complete active space self-consistent field methods neglect much of the dynamic correlation. Hence, inexpensive methods that encompass both static and dynamic electron correlation effects are of high interest. Here, we revisit hole–hole Tamm–Dancoff approximated (hh-TDA) density functional theory for this purpose. The hh-TDA method is the hole–hole counterpart to the more established particle–particle TDA (pp-TDA) method, both of which are derived from the particle–particle random phase approximation (pp-RPA). In hh-TDA, the N-electron electronic states are obtained through double annihilations starting from a doubly anionic (N+2 electron) reference state. In this way, hh-TDA treats ground and excited states on equal footing, thus allowing for conical intersections to be correctly described. Furthermore, the treatment of dynamic correlation is introduced through the use of commonly employed density functional approximations to the exchange-correlation potential. Additionally, we show that hh-TDA is a promising candidate to efficiently treat the photochemistry of organic and biochemical systems that involve several low-lying excited states—particularly those with both low-lying ππ* and nπ* states where inclusion of dynamic correlation is essential to describe the relative energetics. In contrast to the existing literature on pp-TDA and pp-RPA, we employ a functional-dependent choice for the response kernel in pp- and hh-TDA, which closely resembles the response kernels occurring in linear response and collinear spin-flip TDDFT.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
An iterative algorithm combining model reduction and control design
A design strategy which integrates model reduction by modal cost analysis and a multiobjective controller design is proposed. The necessary modeling and control algorithms are easily programmed in Matlab standard software. Hence, this method is very practical for controller design for large space structures. The design algorithm also solves the very important problem of tuning multiple loop controllers (multi-input, multi-output, or MIMO). Instead of the single gain change that is used in standard root locus and gain and phase margin theories, this method tunes multiple loop controllers from low to high gain in a systematic way in the design procedure. This design strategy is applied to NASA's Mini-Mast system.
Hsieh, C.↗
Looking at NGST Through the Eyes of DCATT
The first phase of the Developmental Characterized Active Telescope Testbed (DCATT) hardware system was integrated at Goddard Space Flight Center in early March of 1999 and has been operational for almost a year. Experiments are currently being conducted on the testbed to quantify and refine various methods and techniques in the baseline wavefront sensing and control process. This paper addresses the actual optical design of the Phase 0 hardware configuration and discusses the open loop system level performance of the system. Lessons learned for NGST during the buildup and characterization of the system are presented.
Davila, Pam↗