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At least 811 records · Page 45

Semi-Analytical Hierarchical Bayesian Inference of Nonlinear Model Structure in Stochastic Dynamics: Applied to Compartmental Models of Infectious Diseases

A Bayesian computational framework for parsimonious inference in stochastic nonlinear dynamical systems is presented. This framework enables the concurrent estimation of system states, time-varying parameters, time-invariant parameters, and the optimal sparsity structure of the model parameters. Because differential equation-based models are often simplified mechanistic or phenomenological representations, robust inference from noisy measurement data requires explicit treatment of model error and uncertainty. Model error and time-varying parameters can be represented as random processes, enabling inference while making minimal assumptions about the underlying sources of discrepancy and variability. Adopting stochastic differential equation representations affords the model significant flexibility, but can also render it susceptible to overfitting during statistical inversion, where the inferred model may track noise rather than the underlying signal. To alleviate the effects of overfitting and to enable the discovery of the optimal sparse representation of the time-invariant parameters, a Bayesian sparse learning algorithm is embedded within the framework. This sparse learning framework adopts an approximate hierarchical Bayesian setting defined by a series of semi-analytical expressions. The model structure inference framework is validated using a stochastic compartmental model for tracking and forecasting active cases of an infectious disease. Compartmental models describe population-level infectious disease dynamics through interactions among population fractions grouped by disease state. Mathematically, such models consist of a system of coupled ordinary differential equations. This example adopts an expressive compartmental model that includes multiple possible interactions between disease states, motivated by early uncertainty surrounding COVID-19 reinfection dynamics and their implications for long-term epidemic forecasting. The sparse learning exercise permits the inference of a priori unknown epidemiological dynamics from simulated public health data, discovering the nested compartmental model that optimizes the trade-off between average data-fit and model complexity. It is shown that inducing sparsity among the model parameters eliminates redundant interactions between compartments, equivalently revealing the optimal coupling structure between differential equations.

97 MATHEMATICS AND COMPUTING↗

Analysis of Satellite and Sub-Orbital Measurements

The objective of this project is to support the INTEX aircraft mission by developing experience in the integrated analysis of existing sub-orbital observations and satellite observations with numerical models. Specific tasks include providing guidance to INTEX by identifying discrepancies in satellite observations with (1) in situ measurements, (2) bottom-up emission inventories of nitrogen oxides and volatile organic compounds, and (3) model calculations of the export of pollution from North America to the global atmosphere. An important focus area is developing and improving bottom-up emission inventories by combining top-down and bottom-up information.

Gleason, James↗

Elimination LArTPC Simulation Uncertainty With Modifcations to TPC Wire Waveforms

This paper introduces a novel approach to reducing systematic uncertainties in LArTPC detector simulations, which arise from known detector effects that are challenging and computationally intensive to model. The proposed method involves modifying simulated waveforms based on observed discrepancies in ionization signals from the TPC between actual data and simulations. This approach reduces the sensitivity to detailed detector modeling and decreases the computational resources required for accurate simulations.

Mktchyan, Karen↗

A k-omega multivariate beta PDF for supersonic turbulent combustion

In a recent attempt by the authors at predicting measurements in coaxial supersonic turbulent reacting mixing layers involving H2 and air, a number of discrepancies involving the concentrations and their variances were noted. The turbulence model employed was a one-equation model based on the turbulent kinetic energy. This required the specification of a length scale. In an attempt at detecting the cause of the discrepancy, a coupled k-omega joint probability density function (PDF) is employed in conjunction with a Navier-Stokes solver. The results show that improvements resulting from a k-omega model are quite modest.

Alexopoulos, G. A.↗

Nitrate loading projection is sensitive to freeze-thaw cycle representation

Climate change can have substantial impacts on nitrogen runoff, which is a major cause of eutrophication, harmful algal blooms, and hypoxia in freshwaters and coastal regions. We examined responses of nitrate loading to climate change in the Upper Mississippi River Basin (UMRB) with an enhanced Soil and Water Assessment Tool with physically based Freeze-Thaw cycle representation (SWAT-FT), as compared with the original SWAT model that employs an empirical equation. Driven by future climate projections from five General Circulation Models (GCMs) from 1960 to 2099 under the Representative Concentrations Pathways (RCP) 8.5 scenario, we analyzed changes in riverine nitrate loadings, as well as terrestrial surface and subsurface contributions of the UMRB in the 21st century relative to the baseline period of 1960–1999. By the end of the 21st century, the original SWAT model predicted about a 50% increase in riverine nitrate loadings which is nearly twice as much as that estimated by SWAT-FT (ca. 25%). Such a large difference in projected nitrate changes can potentially mislead mitigation strategies that aim to reduce nitrogen runoff from the UMRB. Further analysis shows that the difference between the original SWAT model and SWAT-FT led to substantial discrepancies in the spatial distribution of surface and subsurface nitrate loadings in the UMRB. In general, SWAT-FT predicted more nitrate leaching for northwestern parts of the UMRB which are more sensitive to freeze-thaw cycle, mainly because SWAT-FT simulated less frequent frozen soils. This study highlights the importance of using physically based freeze-thaw cycle representation in water quality modeling. Design of future nitrogen runoff reduction strategies should include careful assessment of effects that land management has on the freeze-thaw cycles to provide reliable projection of water quality under climate change.

Wang, Qianfeng↗

Lunar Scout Two spacecraft gravity experiment

Measurement of the gravity field of the Moon has a high science priority because of its implications for the internal structure and thermal history of the Moon, and it has a high priority for future exploration activities because of the influence of lunar gravity on spacecraft navigation and orbit maintenance. The current state of knowledge in the lunar gravity field (and the uncertainty in the knowledge) is based primarily on data accumulated from the Lunar Orbiter and Apollo programs. Data are sparse and emphasize the equatorial band (+/- 30 deg) on the near side of the Moon. There are no tracking data on the far side and only the Lunar Orbiter 5 provides a small amount of high inclination data. A host of gravity models developed from different combinations of tracking data have large discrepancies in their predictions of spacecraft motion and orbit lifetimes. There are also large disagreements in the Mercator projections of the gravity acceleration from each model, especially on the far side, where the contours tend to have no obvious relationship with the local topography. The science and engineering requirements for global gravity field mapping will be satisfied with continuous radio metric tracking of Lunar Scout 1 in a low polar orbit using the Deep Space Network and Lunar Scout 2 in a high elliptical orbit. The gravity field of the Moon will be mapped during the Scout Program using a two spacecraft concept. In the two spacecraft concept, one spacecraft is placed in a high altitude eccentric orbit while the second spacecraft is in a low altitude polar orbit. The gravity experiment requires a radio frequency that will permit two-way Doppler tracking between the spacecraft and the Deep Space Network (DSN). Both spacecraft carry NASA standard transponder systems for data transmission to Earth as well as for tracking and orbit determination. Data sufficient to produce a gravity field map could be acquired within one month with this system.

Cheng, Andrew F.↗

RANS Simulation of Variable Density Turbulent Round Jets with Coflow using xRAGE Hydrodynamic Code and BHR Turbulence Models

This work for the fiscal year 2023 (FY23) is a continuation of previous efforts to evaluate the BHR turbulence models for their ability to accurately simulate variable density turbulent round jets with coflow. As before, RANS simulations are carried out using the xRAGE hydrodynamic code. The following are some of the previous findings. Israel showed that i) the symmetry boundary conditions for the BHR models in axisymmetric simulations were in error, ii) three grids of different resolutions did not lead to converging solutions, and iii) BHR 3.1 simulation exhibited instabilities and did not reach a steady state. Saenz and Rauenzahn derived and implemented into xRAGE the correct BHR boundary conditions at the symmetry axis. Cline conducted sensitivity studies with various parameters including the BHR models (versions 2, 3.1 and 4), gravity, material pressure, specific heat, initial turbulent kinetic energy and initial turbulent length scale, and found that the largest factor impacting on simulation results was the BHR model version, followed by the initial turbulent length scale. In addition, freeze boundary conditions at the exit and the side wall of the computational domain were used to remove anomalous flow behavior. Cline adjusted the inlet jet velocity, initial turbulent kinetic energy and initial turbulent length scale to obtain the best reasonable match with the experimental data of Charonko and Prestridge. It was found that the BHR 2 and 3.1 models performed in a similar manner, but the BHR 2 model produced much lower levels of density-specific-volume covariance and turbulent kinetic energy. The main focus for the FY23 is to study the effects of computational parameters related to the boundary conditions, mesh, domain size and timestep size. The reasoning behind this is that, unless simulation results can be shown to be reasonably independent from the aforementioned computational parameters, it would be difficult to attribute any discrepancies between simulation and experimental results to turbulence models. This important aspect has largely been overlooked in the previous years, and therefore will be studied comprehensively here. Additionally, effects of varying the initial turbulent length scale will be examined because it was previously identified as a major factor affecting the flow fields.

42 ENGINEERING↗

Resolving Discrepancies Between Theory and Experiment for the NCN + H Reaction

Flame modeling studies have highlighted the role of branching in the kinetics for the prompt NO switch reaction, NCN + H. In this reaction, there is strong competition between the CH + N2 (R1) and HCN + N (R2) product channels. Increased branching towards reaction R2 promotes the subsequent formation of Fenimore or Prompt NO. Recent direct shock tube studies on this complex reaction conclude that branching to reaction R2 is much more favorable than the predicted branching from theoretical studies. The experimentally predicted prompt NO switch temperature (TS), i.e., the temperature at which k2/(k1+k2) = 0.5, is at 1670 K, in contrast to theory that predicts Ts > 3200 K. The present theory/modeling work was initiated to highlight potential causes for this significant discrepancy between experiment and theory. Our analysis of the simulations reported in the experimental studies indicate that including a fall-off representation for C2H5 radical dissociation (with C2H5 produced from C2H5I dissociation and acting as an H-atom source) has a noticeable influence on the simulations for NCN decay and HCN formation in the shock tube studies. With the inclusion of a theory-based pressure fall-off representation for C2H5 dissociation, we show that this radical persists for much longer timescales even at the high-temperatures in the shock tube studies. This persistence then facilitates the rapid conversion of reactive H-atoms to CH3 radicals at the shock tube conditions via the H + C2H5 → CH3 + CH3 reaction. An updated theoretical analysis for this classic addition-elimination reaction is also provided in this work. The rapid formation of CH3 radicals necessitates the inclusion of additional reactions to adequately simulate the NCN and HCN data. Our simulations conclude that, with the inclusion of these additional reactions, the NCN and HCN profiles can be reasonably well simulated by the most recent theoretical predictions.

Ethyl Radicals↗

Experimental study of ethanol oxidation behind reflected shock waves: Ignition delay time and H 2 O laser-absorption measurements

The oxidation of ethanol was investigated in shock tubes by measuring ignition delay times and water time history profiles. A laser absorption technique was used in the latter case. Ignition delay times were investigated for three equivalence ratios, 0.5, 1.0, and 2.0, and for pressures ranging from 1.3 to 53 atm. The fuel concentration and the type of diluent used were also varied. The ignition delay times were in very good agreement with results from the literature for the very few overlapping conditions, and most of the experimental conditions have never been studied before. A high level of accuracy was observed for the predictions of the ignition delay times from detailed kinetics mechanisms. Inhomogeneous ignition events were observed in some specific conditions, validating the notions of thermal diffusivity and flame thickness developed in the literature for the reasons behind such inhomogeneous ignition. The water time-history profiles showed the formation of water in two stages. These profiles were also modeled using well-known detailed kinetic mechanisms from the literature. Severe discrepancies were often observed for laser-absorption measurements, and this was the case with most of the models. A numerical analysis (sensitivity and rate-of-production) was conducted using the two best-performing literature mechanisms (namely, AramcoMech3.0 and CRECK).

42 ENGINEERING↗

A phase-field model for void and gas bubble superlattice formation in irradiated solids

A phase-field model to simulate the formation of both void and gas bubble superlattices is derived from a grand potential functional, assuming 1D diffusion of self-interstitial atoms. The model is capable of accounting for superlattice formation by either a nucleation and growth or spinodal decomposition mechanism; in this work, we focus on the nucleation and growth mechanism, using a discrete nucleation approach in the phase-field model. In simulations of void formation, short aligned rows of voids were initially formed, followed by growth in the size of the aligned rows, and finally leading to superlattice formation, consistent with experimental observations. Void superlattice spacing as a function of model parameters was quantified. Increased nucleation rates led to smaller superlattice spacing, while increased vacancy diffusivity led to larger superlattice spacing. In simulations of gas bubble superlattice formation, superlattice spacing decreased with increasing gas atom flux, consistent with experimental observations. Here, simulations with increasing ratio of gas atom flux to vacancy-interstitial pair production led to increased superlattice spacing, which is inconsistent with experimental observations at high gas atom flux rates; this discrepancy is attributed to the fact that the model does not account for bound gas atom-vacancy pairs that may dominate at high gas flux rates.

36 MATERIALS SCIENCE↗

Status of the Muon G − 2 Experiment

The Muon g−2 Experiment at Fermi National Accelerator Laboratory was designed to measure the anomalous magnetic moment of the muon, aµ, with a precision of 140 parts-per-billion; a four-fold improvement over the former BNL measurement. The Fermilab experiment was motivated by the about 3.5 standard deviation between the experiment and the Standard Model calculation of aµ which could be a hint of new physics. The experiment at Fermilab relies on the well-established storage ring technique using magic momentum muons but employs new detector systems and a higher rate of muons per injection cycle to achieve the significant improvement in precision. A first result from the Run-1 data taking period has achieved an uncertainty of 0.46 parts-per-million and confirmed the BNL discrepancy, further increasing the tension with the Standard Model to 4.2 σ. The experimental technique, key aspects of the measurement, and the data analysis of Run-1 will be summarized.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

A Thermal Analysis of a Hot-Wire Probe for Icing Applications

This paper presents a steady-state thermal model of a hot-wire instrument applicable to atmospheric measurement of water content in clouds. In this application, the power required to maintain the wire at a given temperature is used to deduce the water content of the cloud. The model considers electrical resistive heating, axial conduction, convection to the flow, radiation to the surroundings, as well as energy loss due to the heating, melting, and evaporation of impinging liquid and or ice. All of these parameters can be varied axially along the wire. The model further introduces a parameter called the evaporation potential which locally gauges the maximum fraction of incoming water that evaporates. The primary outputs of the model are the steady-state power required to maintain a spatially-average constant temperature as well as the variation of that temperature and other parameters along the wire. The model is used to understand the sensitivity of the hot-wire performance to various flow and boundary conditions including a detailed comparison of dry air and wet (i.e. cloud-on) conditions. The steady-state power values are compared to experimental results from a Science Engineering Associates (SEA) Multi-Element probe, a commonly used water-content measurement instrument. The model results show good agreement with experiment for both dry and cloud-on conditions with liquid water content. For ice, the experimental measurements under read the actual water content due to incomplete evaporation and splashing. Model results, which account for incomplete evaporation, are still higher than experimental results where the discrepancy is attributed to splashing mass-loss which is not accounted in the model.

Thermal Analysis↗

Atmospheric Energy Spectra in Global Kilometre-Scale Models

Eleven 40-day long integrations of five different global models with horizontal resolutions of less than 9 km are compared in terms of their global energy spectra. The method of normal-mode function decomposition is used to distinguish between balanced (Rossby wave; RW) and unbalanced (inertia-gravity wave; IGW) circulation. The simulations produce the expected canonical shape of the spectra, but their spectral slopes at mesoscales, and the zonal scale at which RW and IGW spectra intersect differ significantly. The partitioning of total wave energies into RWs an IGWs is most sensitive to the turbulence closure scheme and this partitioning is what determines the spectral crossing scale in the simulations, which differs by a factor of up to two. It implies that care must be taken when using simple spatial filtering to compare gravity wave phenomena in storm-resolving simulations, even when the model horizontal resolutions are similar. In contrast to the energy partitioning between the RWs and IGWs, changes in turbulence closure schemes do not seem to strongly affect spectral slopes, which only exhibit major differences at mesoscales. Despite their minor contribution to the global (horizontal kinetic plus potential available) energy, small scales are important for driving the global mean circulation. Our results support the conclusions of previous studies that the strength of convection is a relevant factor for explaining discrepancies in the energies at small scales. The models studied here produce the major large-scale features of tropical precipitation patterns. However, particularly at large horizontal wavenumbers, the spectra of upper tropospheric vertical velocity, which is a good indicator for the strength of deep convection, differ by factors of three or more in energy. High vertical kinetic energies at small scales are mostly found in those models that do not use any convective parameterisation.

DYAMOND↗

Lyman-alpha observations of Comet West /1975n/

The rate of hydrogen production of Comet West is studied through rocket observation of solar Lyman-alpha radiation resonantly scattered by the escaping hydrogen atoms. Two sets of Lyman-alpha exposure sequences are used to obtain computer-smoothed brightness contour (isophote) maps covering a density range of 100:1. A simple radial outflow model is applied to the contour maps to determine the rate of hydrogen production (3.2 by 10 to the 30th power atoms/sec.) Discrepancies between the observed shape of the outer isophotes and predicted models may be explained by optical depth effects, or by the presence of small pieces of the comet's nucleus distributed along the orbit. Hydrogen, carbon, and oxygen production for Comet West and Comet Kohoutek are compared; differences may be accounted for by variations in the composition or evolution of the two comets.

Opal, C. B.↗

Analytical study of twin-jet shielding

Development of jet noise source model, and comparison to experiments with a point noise source are summarized. The refinement of the noise source is expected to resolve discrepancies noted between previous analytical results with a point noise source model and experimental results for twin-jet shielding. Comparison of the analytical model with experimental program which include shielding of a point noise source by a jet and twin jet shielding are also made. The comparisons should serve to define more completely the mechanisms of shielding

Gerhold, C. H.↗

Comparison of Wind-Tunnel Predictions with Flight Measurements of the Longitudinal-Stability and -Control Characteristics of a Douglas BTD-1 Airplane

Low Mach number longitudinal-stability and control characteristics as predicted by use of wind tunnel data from a powered 3/16-scale model are compared with flight test measurements of a Navy BTD-1 airplane. The accuracy of the wind tunnel data and the discrepancies involved in attempting to correlate with flight data are discussed and analyzed. The comparison showed that wind tunnel predictions were, in general, in good agreement with flight test data. The predicted values were for the most part sufficiently accurate to show the satisfactory and unsatisfactory characteristics in the preliminary design stage and to indicate possible methods of improvement. The discrepancies which did occur were attributed principally to physical dissimilarities between model and airplane and the instability to determine accurately the flight power conditions. The effect of Mach number was considered negligible since the maximum flight test value was about 0.5. In order to simulate more closely the flight conditions and hence obtain more accurate data for predictions, it appears desirable to perform large-scale tests of unorthodox control surfaces such as the sealed vaned elevators with which the airplane was equipped.

Bunnell, Mort V.↗

Comparisons of Mixed-Phase Icing Cloud Simulations with Experiments Conducted at the NASA Propulsion Systems Laboratory

This paper builds on previous work that compares numerical simulations of mixed-phase icing clouds with experimental data. The model couples the thermal interaction between ice particles and water droplets of the icing cloud with the flowing air of an icing wind tunnel for simulation of NASA Glenn Research Centers (GRC) Propulsion Systems Laboratory (PSL). Measurements were taken during the Fundamentals of Ice Crystal Icing Physics Tests at the PSL tunnel in March 2016. The tests simulated ice-crystal and mixed-phase icing that relate to ice accretions within turbofan engines. Experimentally measured air temperature, humidity, total water content, liquid and ice water content, as well as cloud particle size, are compared with model predictions. The model showed good trend agreement with experimentally measured values, but often over-predicted aero-thermodynamic changes. This discrepancy is likely attributed to radial variations that this one-dimensional model does not address. One of the key findings of this work is that greater aero-thermodynamic changes occur when humidity conditions are low. In addition a range of mixed-phase clouds can be achieved by varying only the tunnel humidity conditions, but the range of humidities to generate a mixed-phase cloud becomes smaller when clouds are composed of smaller particles. In general, the model predicted melt fraction well, in particular with clouds composed of larger particle sizes.

Thermal model↗

Our Future Nuclear Data Needs

A well-established knowledge of nuclear phenomena including fission, reaction cross sections, and structure/decay properties is critical for applications ranging from the design of new reactors to nonproliferation to the production of radioisotopes for the diagnosis and treatment of illness. However, the lack of a well-quantified, predictive theoretical capability means that most nuclear observables must be measured directly and used to calibrate empirical models, which in turn provide the data needed for these applications. In many cases, either there is a lack of data needed to guide the models or the results of the different measurements are discrepant, leading to the development of evaluation methodologies to provide recommended values and uncertainties. In this review, we describe the nuclear data evaluation process and the international community that carries it out. We then discuss new measurements and improved theory and/or modeling needed to address future challenges in applied nuclear science.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗