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At least 1,711 records · Page 95
All sourcesNASA NTRSDOE OSTI
NASA NTRS1998

New Approach to Diagnosing Properties of Protoplanetary Disks

In this paper we suggest that subjecting the observationally derived properties of protoplanetary disks to the evolutionary interpretation yields new insights into the working of those disks, and offers valuable constraints on their models. We propose that the global properties of individual disks, such as their accretion rates and disk masses, sorted by the mass of the central star, can be indexed by the age of the star to simulate the evolution of a single disk. Using data from published surveys of T Tauri stars, we show that accretion rate data, and disk mass data for the lowest mass stars, form well-defined evolutionary tracks. The higher mass stars show a definitive negative correlation between accretion rates and star ages. We use the time-dependent alpha-disk model of the viscous protoplanetary disk to link the theory to observations. The data are consistent with the standard theoretical paradigm, but not with the layered accretion model. The best fits to the data are obtained for the standard models that start with disks that are about one-third of the mass of the central star and have their angular momenta, j, and alpha-coefficients linked by the relationship j varies as Solar mass(exp 3/2)alpha(exp 1/3). The proportionality constant in this relationship, when derived from the accretion rate data, differs from the constant derived from the disk mass data. We argue that the accretion rate data are more reliable. Taking into account typical values of the specific angular momentum of disk-forming matter, we obtain alpha is greater than or equal to 10(exp -2). A complete time-dependent standard disk model, built on the parameters determined from the best-fit procedure, is presented. Such a model constitutes a good point of departure for various theoretical studies aimed at the issue of formation of planetary systems and the character of protoplanetary disks.

Stepinski, Tomasz F.↗
NASA NTRS1982

Non-isothermal effects on SO2 absorption by water droplets. I - Model development. II - Results and discussion

An analytic model of SO2 absorption in a falling water droplet is developed and a simulation of SO2 washout is performed. Nonisothermic effects on drop growth, droplet physical parameters, reaction rates, and multicomponent diffusion are treated in the model. The gas-liquid interface is assumed to be at equilibrium, and interfacial resistance is negligible. Raindrops are simulated as falling from a 2 km height through an atmospheric region containing SO2. The droplets decrease in size from evaporation and cooling, and their slightly basic pH aids SO2 absorption. The simulation indicates higher SO2 absorption at higher altitudes, and desorption may occur at ground level. Isothermal effects are concluded to be significant, and quantification of effects will depend on further modelling.

Reda, M.↗
DOE OSTI2026

A Generalized Grain-Scale Model for the Non-Plasma and Plasma-Assisted Hydrogen Direct Reduction of Iron Ore

Direct Reduction of Iron ore using hydrogen (H-DRI) is a promising pathway towards efficient steelmaking and accurate predictive models are a necessity for scale-up and optimization of this technology. However, accurate models of this process remain limited because existing models oversimplify grain-scale phenomena, such as nonlinearity inside grain, self-sufficient porosity, surface reactions, and the role of plasma species. These phenomena are important for flash steelmaking and plasma-assisted H-DRI processes. To address this need, we present a phenomenological model for simulating H-DRI at the scale of a single micron-sized grain of the iron ore. We call this the Transient Reactive Grain Model (TRGM). TRGM incorporates key physical process: gas species transport, a chemical kinetics of material conversion, nanopore structural evolution and, adsorption-desorption surface kinetics at the reactive nanopore surface. The important contribution of this work is that the model provides a dependence on different reductant species, specifically hydrogen atoms versus molecules, so that role of hydrogen plasma reduction can be clarified compared to the use of pure hydrogen gas reduction. TRGM predictions agree well with experimental data for both molecular H2 reduction of Fe2O3 and plasma hydrogen reduction of Fe3O4. Results reveal species concentration gradients with a diffuse reaction zone, and enhanced hydrogen diffusion at the grain outer surface due to evolving porosity. These findings challenge common assumptions in existing models, including sharp reaction fronts, quasi-steady diffusion and kinetics, and the neglect of surface chemistry. As a generalized grain-scale model for H-DRI processes, TRGM has practical applications in flash steelmaking and in-flight reduction using both molecular and plasma hydrogen.

08 HYDROGEN↗
DOE OSTI2020

Constraining axion inflation with gravitational waves from preheating

We study gravitational wave production from gauge preheating in a variety of inflationary models, detailing its dependence on both the energy scale and the shape of the potential. In this work, we show that preheating into Abelian gauge fields generically leads to a large gravitational wave background that contributes significantly to the effective number of relativistic degrees of freedom in the early universe, $N_{\text{eff}}$. We demonstrate that the efficiency of gravitational wave production is correlated with the tensor-to-scalar ratio, $\textit{r}$. In particular, we show that efficient gauge preheating in models whose tensor-to-scalar ratio would be detected by next-generation cosmic microwave background experiments ($\textit{r}$ ≳ 10 –3 ) will be either detected through its contribution to $N_{\text{eff}}$ or ruled out. Furthermore, we show that bounds on $N_{\text{eff}}$ provide the most sensitive probe of the possible axial coupling of the inflaton to gauge fields regardless of the potential.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRSDate not supplied

An Inverse Chance-constrained Approach to the Calibration of Robust Models

This paper proposes a strategy to calibrate computational models according to uncertain input-output data. To this end, uncertainty in the data is first quantified by creating adversarial data sets. Samples drawn from such sets are then mapped from the input-output space to the parameter space using an inverse mapping. This mapping minimizes the collective output spread of an ensemble of point predictions while satisfying a set of individual data-matching requirements. The distribution of the resulting parameter points, which often exhibits strong parameter dependencies, is then modeled using sliced-normals. The chance-constrained formulation used to learn this distribution enables the analyst to trade-off a greater likelihood for most of the data against a lower likelihood for some of the data thereby relaxing the conservatism of the calibrated model. This formulation not only neglects the worst-performing quantiles of each adversarial distribution but also eliminates the potentially serious effects that outliers might have on the resulting model. This calibration approach not only has a considerably lower computational cost than the standard forward approach but it also allows for the identification of suitable distribution classes, which in turn yield better calibrated models.

Calibration↗
DOE OSTI2022

Evaluation of the GaAs displacement damage metric using updated nuclear data

The emerging use of the physics-based athermal recombination-corrected displacement per atom (arc-dpa) model for the displacement damage efficiency has motivated a re-evaluation of the historical empirically-derived GaAs damage response function with the purpose of highlighting needs for future analytical and experimental work. The 1-MeV neutron damage equivalence methodology used in the ASTM E-722 standard for GaAs has been re-evaluated using updated nuclear data. This yielded a higher fidelity representation of the GaAs displacement kerma and, through the use of the refined PKA recoil energy-dependent damage efficiency model, an updated 1-MeV(GaAs) displacement damage function. This re-evaluation included use of the Norgett-Robinson-Torrens (NRT) model for an updated threshold treatment, rather than the sharp-threshold Kinchin-Pease model used in the current ASTM standard. The underlying nuclear data evaluations have been updated to use the ENDF/VIII.0 {sup 75}As and TENDL-2019 {sup 71}Ga/{sup 69}Ga evaluations. The displacement kerma and 1-MeV-equivalent damage responses were calculated using a modified NJOY-2016 code which allowed for refinements in some of the damage models. This paper shows that an updated displacement damage function, based upon the latest nuclear data, is consistent with the experimental data used to develop the current ASTM E-722 GaAs standard. Using a double ratio approach to compare the available experimental data with the calculated response, the average legacy double ratio was found to be 0.97 ± 0.05 and the average updated double ratio was found to be 0.94 ± 0.05. (authors)

36 MATERIALS SCIENCE↗
DOE OSTI2020

Comparing GGA, GGA+ U , and meta-GGA functionals for redox-dependent binding at open metal sites in metal–organic frameworks

Metal–organic frameworks (MOFs) with open metal sites have been widely investigated for the selective adsorption of small molecules via redox mechanisms where charge transfer can take place between the binding site and the adsorbate of interest. Quantum-chemical screening methods based on density functional theory have emerged as a promising route to accelerate the discovery of MOFs with enhanced binding affinities toward various adsorbates. However, the success of this approach is linked to the accuracy of the underlying density functional approximations (DFAs). In this work, we compare commonly used generalized gradient approximation (GGA), GGA+U, and meta-GGA exchange-correlation functionals in modeling redox-dependent binding at open metal sites in MOFs using O 2 and N 2 as representative small molecules. We find that the self-interaction error inherent to the widely used Perdew, Burke, and Ernzerhof (PBE) GGA predicts metal sites that are artificially redox-active, as evidenced by their strong binding affinities, short metal–adsorbate bond distances, and large degree of charge transfer. The incorporation of metal-specific, empirical Hubbard U corrections based on the transition metal oxide literature systematically reduces the redox activity of the open metal sites, often improving agreement with experiment. Additionally, the binding behavior shifts from strong chemisorption to weaker physisorption as a function of U. The M06-L meta-GGA typically predicts binding energies between those of PBE-D3(BJ) and PBE-D3(BJ)+U when using empirically derived U values from the transition metal oxide literature. Despite the strong sensitivity of the binding affinities toward a given DFA, the GGA, GGA+U, and meta-GGA approaches often yield the same qualitative trends and structure–property relationships.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS2014

Magnetic Reconnection in Different Environments: Similarities and Differences

Depending on the specific situation, magnetic reconnection may involve symmetric or asymmetric inflow regions. Asymmetric reconnection applies, for example, to reconnection at the Earth's magnetopause, whereas reconnection in the nightside magnetotail tends to involve more symmetric geometries. A combination of review and new results pertaining to magnetic reconnection is being presented. The focus is on three aspects: A basic, MHD-based, analysis of the role magnetic reconnection plays in the transport of energy, followed by an analysis of a kinetic model of time dependent reconnection in a symmetric current sheet, similar to what is typically being encountered in the magnetotail of the Earth. The third element is a review of recent results pertaining to the orientation of the reconnection line in asymmetric geometries, which are typical for the magnetopause of the Earth, as well as likely to occur at other planets.

Reconnection↗
NASA NTRS1983

Spatial dependences in the distant solar wind: Pioneers 10 and 11

Pioneer 10, 11 observations of the solar wind and magnetic field between 1 and 20 AU are reviewed. Spatial dependences, which are emphasized, must be inferred in the presence of large temporal variations including solar cycle effects. The separation of spatial and temporal dependences is achieved principally through the use of multipoint observations including baseline measurements at 1 AU. Measurements of the solar wind parameters (radial speed, flux, proton temperature) and of the magnetic field magnitude and components are compared with two theories, the Parker theory which assumes radial, azimuthally symmetric flow and the Goldstein-Jokipii theory which includes effects associated with stream-stream interactions. The observed radial gradients in the proton density and velocity and the magnetic field are consistent with the Parker model. A qualitative dependence of field magnitude on heliomagnetic latitude, i.e., referred to the observed location of the heliospheric current sheet, was derived. The field strength was found to decrease with distance from the current sheet.

Smith, E. J.↗
NASA NTRS2013

Modeling Errors in Daily Precipitation Measurements: Additive or Multiplicative?

The definition and quantification of uncertainty depend on the error model used. For uncertainties in precipitation measurements, two types of error models have been widely adopted: the additive error model and the multiplicative error model. This leads to incompatible specifications of uncertainties and impedes intercomparison and application.In this letter, we assess the suitability of both models for satellite-based daily precipitation measurements in an effort to clarify the uncertainty representation. Three criteria were employed to evaluate the applicability of either model: (1) better separation of the systematic and random errors; (2) applicability to the large range of variability in daily precipitation; and (3) better predictive skills. It is found that the multiplicative error model is a much better choice under all three criteria. It extracted the systematic errors more cleanly, was more consistent with the large variability of precipitation measurements, and produced superior predictions of the error characteristics. The additive error model had several weaknesses, such as non constant variance resulting from systematic errors leaking into random errors, and the lack of prediction capability. Therefore, the multiplicative error model is a better choice.

Modeling↗
NASA NTRS1993

Numerical Model for Isothermal and Non-Isothermal Crystallization of Liquids and Glasses

A new numerical model of isothermal and non-isothermal first order phase transformations, such as the crystallization of liquids and glasses, is presented. This model computes directly the volume fraction transformed, taking into account time-dependent nucleation rates and cluster-size-dependent growth velocities. The model is applied to the crystallization of lithium disilicate glass, using the appropriate kinetic and thermodynamic parameters. The model is used (1) to determine the validity of common methods for computing the volume fraction transformed as a function of time in isothermal experiments when a time-dependent nucleation rate is expected, (2) to simulate non-isothermal differential scanning calorimetry (DSC) studies of glass devitrification as a function of scan rate, and (3) to compute the effect of preannealing on the DSC peak parameters. A novel behavior of the nucleation rate with scan rate is predicted, arising because the relaxation of the cluster distribution cannot be described by a single relaxation time. Comparisons of the calculations with experimental data on this glass demonstrate the validity of the model.

Kelton, K. F.↗
DOE OSTI2025

LSM and CPT

We study a number of 1+1d lattice models with anti-unitary symmetries that simultaneously reflect space and reverse time. Some of these symmetries are anomalous, leading to Lieb-Schultz-Mattis-type constraints, thus excluding a trivially gapped phase. Examples include a mod 8 anomaly in the Majorana chain and various mod 2 anomalies in the spin chain. In some cases, there is an exact, non-anomalous lattice symmetry that flows in the continuum to CPT. In some other cases, the CPT symmetry of the continuum theory is emergent or absent. Depending on the model, the anomaly of the lattice model is matched in the continuum in different ways. In particular, it can be mapped to an emergent anomaly of an emanant symmetry.

Anomalies in Field and String Theories↗
NASA NTRS1992

Cosmic-ray-modified supernova remnant shocks

The evolution of cosmic-ray-modified SNRs during the early Sedov phase is investigated using the time-dependent, two-fluid model for diffusive shock acceleration. Consideration is given to the sensitivity of net acceleration efficiency to model assumptions regarding density structure of the external medium as well as time dependence in the diffusion coefficient and the cosmic-ray adiabatic index. Of the model assumptions explored, the greatest sensitivity was found to time variations in the specific heat ratio to cosmic rays. It was found that if tau is greater than or approximately equal to few times 100, dynamically significant cosmic-ray pressures are produced early in the Sedov inefficient cosmic-ray accelerators. For the SNR models under consideration, the total energy channeled into the cosmic rays can be of order 10 percent of the initial blast energy for both the uniform density and inverse-square density interstellar medium models.

Jones, T. W.↗
NASA NTRS1992

Lidar observation of marine mixed layer

Marine mixed layer is known to play an important role in the transportation of pollution exiting ship funnels. The application of a diffusion model is critically dependent upon a reliable estimate of a lid. However, the processes that form lids are not well understood, though considerable progress toward marine boundary layer has been achieved. This report describes observations of the marine mixed layer from the course Ise-wan to Nii-jima with the intention of gaining a better understanding of their structure by a shipboard lidar. These observations were made in the summer of 1991. One interesting feature of the observations was that the multiple layers of aerosols, which is rarely numerically modeled, was encountered. No attempt is yet made to present a systematic analysis of all the data collected. Instead we focus on observations that seem to be directly relevant to the structure of the mixed layer.

Yamagishi, Susumu↗
NASA NTRS1992

Phased array feed design technology for Large Aperture Microwave Radiometer (LAMR) Earth observations

An assessment of the potential and limitations of phased array antennas in space-based geophysical precision radiometry is described. Mathematical models exhibiting the dependence of system and scene temperatures and system sensitivity on phased array antenna parameters and components such as phase shifters and low noise amplifiers (LNA) are developed. Emphasis is given to minimum noise temperature designs wherein the LNA's are located at the array level, one per element or subarray. Two types of combiners are considered: array lenses (space feeds) and corporate networks. The result of a survey of suitable components and devices is described. The data obtained from that survey are used in conjunction with the mathematical models to yield an assessment of effective array antenna noise temperature for representative geostationary and low Earth orbit systems. Practical methods of calibrating a space-based, phased array radiometer are briefly addressed as well.

Schuman, H. K.↗
DOE OSTI2020

Beam-energy dependence of the production of light nuclei in Au + Au collisions

We study in the coalescence model the collision energy dependence of (anti-)deuteron and (anti- )triton production in the most central Au+Au collisions at $\sqrt{s_{NN}} $ = 7.7, 11.5, 19.6, 27, 39, 62.4 and 200 GeV. The needed phase-space distribution of nucleons at the kinetic freeze-out is generated from a new 3D hybrid dynamical model (iEBE-MUSIC) by using a smooth crossover equation of state (EoS) without a QCD critical point. Our model calculations predict that the coalescence parameters of (anti-)deuteron (B 2 (d) and B 2 ($\bar{d}$)) decrease monotonically as the collision energy increases, and the light nuclei yield ratio N t N p /$Nd^{2}_{d}$ remains approximately a constant with respect to the collision energy. These calculated observables fail to reproduce the non-monotonic behavior of the corresponding data from the STAR Collaboration. Without including any effects of the critical point in our model, our results serve as the baseline predictions for the yields of light nuclei in the search for the possible QCD critical points from the experimental beam energy scan of heavy ion collisions.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

Implications of Safety and Operational Features of Small, Advanced Reactors for the Evaluation of Important Human Actions

The design and operational characteristics of non-light water reactors are likely to change the role of human actions in safety function management and the types of human actions that are deemed important. The objectives of this report are to: • Identify the implications of small, advanced reactor design characteristics on human performance and the changing role of human actions in the management of safety functions. • Identify the methods that may be used to identify important human actions. • Identify how HFE safety reviewers can help ensure that the methods adequately model human actions to identify those that are important to safety. We identified the implications of small, advanced reactor characteristics on the role of personnel in safety function management. Then we addressed how designers can identify which human actions are important to safety using both probabilistic risk assessment (PRA) and deterministic analyses. PRA identifies important human actions using risk-importance criteria. Deterministically identified important human actions include those identified by analyses of situations such as transients and accidents and defense in depth. In all cases, the acceptability of the analyses is dependent on the modeling, quantification, and criterion selection to determine which human actions are important. How well the designers address these processes determines the acceptability of their methodology.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2022

Measurement of double-parton scattering in inclusive production of four jets with low transverse momentum in proton-proton collisions at $\sqrt{s}$ = 13 TeV

A measurement of inclusive four-jet production in proton-proton collisions at a center-of-mass energy of 13 TeV is presented. The transverse momenta of jets within |η| < 4.7 are required to exceed 35, 30, 25, and 20 GeV for the first-, second-, third-, and fourth-leading jet, respectively. Differential cross sections are measured as functions of the jet transverse momentum, jet pseudorapidity, and several other observables that describe the angular correlations between the jets. The measured distributions show sensitivity to different aspects of the underlying event, parton shower modeling, and matrix element calculations. In particular, the interplay between angular correlations caused by parton shower and double-parton scattering contributions is shown to be important. The double-parton scattering contribution is extracted by means of a template fit to the data, using distributions for single-parton scattering obtained from Monte Carlo event generators and a double-parton scattering distribution constructed from inclusive single-jet events in data. The effective double-parton scattering cross section is calculated and discussed in view of previous measurements and of its dependence on the models used to describe the single- parton scattering background.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗