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NASA NTRS2003

Mapping Soil pH Buffering Capacity of Selected Fields

Soil pH buffering capacity, since it varies spatially within crop production fields, may be used to define sampling zones to assess lime requirement, or for modeling changes in soil pH when acid forming fertilizers or manures are added to a field. Our objective was to develop a procedure to map this soil property. One hundred thirty six soil samples (0 to 15 cm depth) from three Georgia Coastal Plain fields were titrated with calcium hydroxide to characterize differences in pH buffering capacity of the soils. Since the relationship between soil pH and added calcium hydroxide was approximately linear for all samples up to pH 6.5, the slope values of these linear relationships for all soils were regressed on the organic C and clay contents of the 136 soil samples using multiple linear regression. The equation that fit the data best was b (slope of pH vs. lime added) = 0.00029 - 0.00003 * % clay + 0.00135 * % O/C, r(exp 2) = 0.68. This equation was applied within geographic information system (GIS) software to create maps of soil pH buffering capacity for the three fields. When the mapped values of the pH buffering capacity were compared with measured values for a total of 18 locations in the three fields, there was good general agreement. A regression of directly measured pH buffering capacities on mapped pH buffering capacities at the field locations for these samples gave an r(exp 2) of 0.88 with a slope of 1.04 for a group of soils that varied approximately tenfold in their pH buffering capacities.

Weaver, A. R.↗

NASA NTRS1987

The rotationally modulated Zeeman spectrum at nearly 10 to the 9th Gauss of the white dwarf PG 1031 + 234

Detailed analyses are performed of high-quality, phase-resolved CCD spectroscopy of the absorption-line spectrum throughout its rotation period of the new white dwarf PG 1031 + 234. The spectral variations are discussed and compared with new theoretical calculations of the behavior of hydrogen in strong magnetic fields. This analysis is then extended through a modeling procedure which produces a synthetic magnetically distorted spectrum for a star of arbitrary field strength and structure. The results confirm that PG 1031 + 234 possesses the strongest field yet detected on a white dwarf, with regions on the surface spanning the range of about 200 to nearly 1000 MG. The spectroscopic data reflect a field pattern containing a slightly offset global component of polar field strength of about 500 MG together with a localized magnetic 'spot' whose central field approaches 2000 MG.

Latter, William B.↗

DOE OSTI2016

Divergence preserving reconstruction of the nodal components of a vector field from its normal components to edges

We have developed a new divergence preserving method for the reconstruction of the Cartesian components of a vector field from the orthogonal projection of a vector field to the normals to edges in two dimensional. In this method, discrete divergences computed from the nodal components and from the normal ones are exactly the same. Our new method consists of two stages. At the first stage, we use an extended version of the local procedure described in [J. Comput. Phys., 139:406–409, 1998] to obtain a ‘reference’ nodal vector. This local procedure is exact for linear vector fields; however, the discrete divergence is not preserved. Then, we formulate a constrained optimization problem, in which this reference vector plays the role of a target, and the divergence constraints are enforced by using Lagrange multipliers. It leads to the solution of ‘elliptic’ like discrete equations for the cell-centered Lagrange multipliers. The new global divergence preserving method is exact for linear vector fields. Here in this paper, we describe all details of our new method and present numerical results, which confirm our theory.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2017

Tracking the Magnetic Flux in and Around Sunspots

We have developed a procedure for tracking sunspots observed by the Helioseismic and Magnetic Imager on the Solar Dynamics Observatory and for making curvature-corrected space/time maps of the associated line-of-sight magnetic field and continuum intensity. We apply this procedure to 36 sunspots, each observed continuously for nine days around its central meridian passage time, and find that the proper motions separate into two distinct components depending on their speeds. Fast (∼3–5 km s{sup −1}) motions, comparable to Evershed flows, are produced by weak vertical fluctuations of the horizontal canopy field and recur on a timescale of 12–20 min. Slow (∼0.3–0.5 km s{sup −1}) motions diverge from a sunspot-centered ring whose location depends on the size of the sunspot, occurring in the mid-penumbra for large sunspots and at the outer edge of the penumbra for small sunspots. The slow ingoing features are contracting spokes of a quasi-vertical field of umbral polarity. These inflows disappear when the sunspot loses its penumbra, and may be related to inward-moving penumbral grain. The slow outgoing features may have either polarity depending on whether they originate from quasi-vertical fields of umbral polarity or from the outer edge of the canopy. When a sunspot decays, the penumbra and canopy disappear, and the moat becomes filled with slow outflows of umbral polarity. We apply our procedure to decaying sunspots, to long-lived sunspots, and to numerical simulations of a long-lived sunspot by Rempel.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2015

Tuning the Electronic Structure of Anatase Through Fluorination

A highly fluorinated anatase lattice has been recently reported, providing a new class of materials whose general chemical formula is T i1-x $\square$ x X 4x O 2-4x (X - = F - or OH - ). To characterise the complex structural features of the material and the different F environments, we here apply a computational screening procedure. After deriving a polarisable force—field from DFT simulations, we screen in a step-wise fashion a large number of possible configurations differing in the positioning of the titanium vacancies ($\square$) and of the fluorine atoms. At each step only 10% of the configurations are retained. At the end of the screening procedure, a configuration is selected and simulated using DFT-based molecular dynamics. This allows us to analyse the atomic structure of the material, which is strongly disordered, leading to a strong decrease (by 0.8 eV) of the band gap compared to conventional anatase.

Science & Technology - Other Topics↗

NASA NTRS1986

Constraints on geomagnetic secular variation modeling from electromagnetism and fluid dynamics of the Earth's core

A spherical harmonic representation of the geomagnetic field and its secular variation for epoch 1980, designated GSFC(9/84), is derived and evaluated. At three epochs (1977.5, 1980.0, 1982.5) this model incorporates conservation of magnetic flux through five selected patches of area on the core/mantle boundary bounded by the zero contours of vertical magnetic field. These fifteen nonlinear constraints are included like data in an iterative least squares parameter estimation procedure that starts with the recently derived unconstrained field model GSFC (12/83). Convergence is approached within three iterations. The constrained model is evaluated by comparing its predictive capability outside the time span of its data, in terms of residuals at magnetic observatories, with that for the unconstrained model.

Benton, E. R.↗

DOE OSTI2015

The linear and nonlinear response of infinite periodic systems to static and/or dynamic electric fields. Implementation in CRYSTAL code

An implementation of the vector potential approach (VPA) for treating the response of infinite periodic systems to static and dynamic electric fields has been initiated within the CRYSTAL code. The VPA method is based on the solution of a time-dependent Hartree-Fock or Kohn-Sham equation for the crystal orbitals wherein the usual scalar potential, that describes interaction with the field, is replaced by the vector potential. This equation may be solved either by perturbation theory or by finite field methods. With some modification all the computational procedures of molecular ab initio quantum chemistry can be adapted for periodic systems. Accessible properties include the linear and nonlinear responses of both the nuclei and the electrons. The programming of static field pure electronic (hyper)polarizabilities has been successfully tested. Dynamic electronic (hyper)polarizabilities, as well as infrared and Raman intensities, are in progress while the addition of finite fields for calculation of vibrational (hyper)polarizabilities, through nuclear relaxation procedures, will begin shortly.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

NASA NTRS1976

The passage of a distorted velocity field through a cascade of airfoils

An analysis has been developed to predict the unsteady force and moment generated by the passage of a timewise periodic total pressure distortion through an arbitrary cascade of airfoils. The mathematical formulation of this analysis is based on the assumption that the magnitudes of the timewise fluctuations of the variables which describe the flow field are small compared to their time average values. This assumption permits the development of a linear unsteady perturbation analysis about a steady flow field. In addition to this linearization assumption the fluid medium is assumed to be incompressible and inviscid. The mathematical development begins by decomposing the velocity field surrounding an infinite cascade of airfoils into its irrotational and rotational components. The rotational component is associated with an upstream unsteady total pressure distortion and is defined in terms of the vorticity field associated with the distortion pattern. The irrotational component is further decomposed into a steady and unsteady part. A combined analytical and numerical procedure has been developed to solve the field equations which govern the rotational and irrotational velocity fields. Results of this analysis show a strong influence of mean loading on the unsteady force generated by the passage of a one dimensional gust through a cascade of compressor blades.

Adamczyk, J. J.↗

NASA NTRS2010

Cosmic Infrared Background Fluctuations in Deep Spitzer Infrared Array Camera Images: Data Processing and Analysis

This paper provides a detailed description of the data reduction and analysis procedures that have been employed in our previous studies of spatial fluctuation of the cosmic infrared background (CIB) using deep Spitzer Infrared Array Camera observations. The self-calibration we apply removes a strong instrumental signal from the fluctuations that would otherwise corrupt the results. The procedures and results for masking bright sources and modeling faint sources down to levels set by the instrumental noise are presented. Various tests are performed to demonstrate that the resulting power spectra of these fields are not dominated by instrumental or procedural effects. These tests indicate that the large-scale ([greater, similar]30') fluctuations that remain in the deepest fields are not directly related to the galaxies that are bright enough to be individually detected. We provide the parameterization of these power spectra in terms of separate instrument noise, shot noise, and power-law components. We discuss the relationship between fluctuations measured at different wavelengths and depths, and the relations between constraints on the mean intensity of the CIB and its fluctuation spectrum. Consistent with growing evidence that the [approx]1-5 [mu]m mean intensity of the CIB may not be as far above the integrated emission of resolved galaxies as has been reported in some analyses of DIRBE and IRTS observations, our measurements of spatial fluctuations of the CIB intensity indicate the mean emission from the objects producing the fluctuations is quite low ([greater, similar]1 nW m-2 sr-1 at 3-5 [mu]m), and thus consistent with current [gamma]-ray absorption constraints. The source of the fluctuations may be high-z Population III objects, or a more local component of very low luminosity objects with clustering properties that differ from the resolved galaxies. Finally, we discuss the prospects of the upcoming space-based surveys to directly measure the epochs inhabited by the populations producing these source-subtracted CIB fluctuations, and to isolate the individual fluxes of these populations.

Arendt, Richard↗

DOE OSTI2018

Performance and Health Test Procedure for Grid Energy Storage Systems

A test procedure to evaluate the performance and health of field installations of grid-connected battery energy storage systems (BESS) is described. Performance and health metrics captured in the procedures are: round-trip efficiency, standby losses, response time/accuracy, and useable energy/state of charge at different discharge/charge rates over the system's lifetime. The procedures are divided into reference performance tests, which require the system to be put in a test mode and are to be conducted in intervals, and real-time monitoring tests, which collect data during normal operation without interruption. The procedures can be applied on a wide array of BESS with little modification and can thus support BESS operators in the management of BESS field installations with minimal interruption and expenditure. Simulated results based on a detailed system simulation of a prototype system are provided as guideline.

25 ENERGY STORAGE↗

DOE OSTI2017

Performance and Health Test Procedure for Grid Energy Storage Systems: Preprint

A test procedure to evaluate the performance and health of field installations of grid-connected battery energy storage systems (BESS) is described. Performance and health metrics captured in the procedures are: Round-trip efficiency, Standby losses, Response time/accuracy, and Useable Energy/ State of Charge at different discharge/charge rates over the system's lifetime. The procedures are divided into Reference Performance Tests, which require the system to be put in a test mode and are to be conducted in intervals, and Real-time Monitoring tests, which collect data during normal operation without interruption. The procedures can be applied on a wide array of BESS with little modifications and can thus support BESS operators in the management of BESS field installations with minimal interruption and expenditures.can be applied on a wide array of BESS with little modifications and can thus support BESS operators in the management of BESS field installations with minimal interruption and expenditures.

25 ENERGY STORAGE↗

NASA NTRS2014

The Effect of General Statistical Fiber Misalignment on Predicted Damage Initiation in Composites

A micromechanical method is employed for the prediction of unidirectional composites in which the fiber orientation can possess various statistical misalignment distributions. The method relies on the probability-weighted averaging of the appropriate concentration tensor, which is established by the micromechanical procedure. This approach provides access to the local field quantities throughout the constituents, from which initiation of damage in the composite can be predicted. In contrast, a typical macromechanical procedure can determine the effective composite elastic properties in the presence of statistical fiber misalignment, but cannot provide the local fields. Fully random fiber distribution is presented as a special case using the proposed micromechanical method. Results are given that illustrate the effects of various amounts of fiber misalignment in terms of the standard deviations of in-plane and out-of-plane misalignment angles, where normal distributions have been employed. Damage initiation envelopes, local fields, effective moduli, and strengths are predicted for polymer and ceramic matrix composites with given normal distributions of misalignment angles, as well as fully random fiber orientation.

Micromechanical↗

DOE OSTI2021

Gauge-symmetrization method for energy-momentum tensors in high-order electromagnetic field theories

For electromagnetic field theories, canonical energy-momentum conservation laws can be derived from the underpinning spacetime translation symmetry according to the Noether procedure. However, the canonical energy-momentum tensors (EMTs) are neither symmetric nor gauge-symmetric (gauge invariant). The Belinfante-Rosenfeld (BR) method is a well-known procedure to symmetrize the EMTs, which also renders them gauge symmetric for first-order field theories. High-order electromagnetic field theories appear in the study of gyrokinetic systems for magnetized plasmas and the Podolsky system for the radiation reaction of classical charged particles. For these high-order field theories, gauge-symmetric EMTs are not necessarily symmetric and vice versa. In the present study, we develop a new gauge-symmetrization method for EMTs in high-order electromagnetic field theories. The Noether procedure is carried out using the Faraday tensor $F_{μν}$, instead of the 4-potential $A_{μ}$, to derive a canonical EMT $T^{μν}_{N}$. We show that the gauge-dependent part of $T^{μν}_{N}$ can be removed using the displacement-potential tensor $F^{σμν}$ ≡ $D^{σμ}A^{ν}/4π$, where $D^{σμ}$ is the antisymmetric electric displacement tensor. This method gauge-symmetrizes the EMT without necessarily making it symmetric, which is adequate for applications not involving general relativity. For first-order electromagnetic field theories, such as the standard Maxwell system, $F^{σμν}$ reduces to the familiar BR superpotential $S^{σμν}$, and the method developed can be used as a simpler procedure to calculate $S^{σμν}$ without employing the angular momentum tensor in 4D spacetime. When the electromagnetic system is coupled to classical charged particles, the gauge-symmetrization method for EMTs is shown to be effective as well.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

NASA NTRS1987

Procedures for Computing Transonic Flows for Control of Adaptive Wind Tunnels

Numerical methods are developed for control of three dimensional adaptive test sections. The physical properties of the design problem occurring in the external field computation are analyzed, and a design procedure suited for solution of the problem is worked out. To do this, the desired wall shape is determined by stepwise modification of an initial contour. The necessary changes in geometry are determined with the aid of a panel procedure, or, with incident flow near the sonic range, with a transonic small perturbation (TSP) procedure. The designed wall shape, together with the wall deflections set during the tunnel run, are the input to a newly derived one-step formula which immediately yields the adapted wall contour. This is particularly important since the classical iterative adaptation scheme is shown to converge poorly for 3D flows. Experimental results obtained in the adaptive test section with eight flexible walls are presented to demonstrate the potential of the procedure. Finally, a method is described to minimize wall interference in 3D flows by adapting only the top and bottom wind tunnel walls.

Rebstock, Rainer↗

DOE OSTI2019

Investigation into the Distribution of Built-in Electric Fields in LED Heterostructures with Multiple GaN/InGaN Quantum Wells by Electroreflectance Spectroscopy

Electric-field nonuniformity in the active region of a LED (light-emitting diode) heterostructure based on five identical GaN/InGaN quantum wells is investigated by the electroreflectance method. The energies of band-to-band transitions in the quantum wells and barriers are determined from the analysis of electroreflectance spectra using the Kramers–Kronig transforms. The procedure for estimating the electric-field strength in separate quantum wells of the active region by the position of spectral lines is proposed. It is found that the energies of the main transition in quantum wells of the active region with zero bias of the p–n junction differ by a magnitude on the order of 140 meV, which corresponds to a difference in the electric-field strengths of 0.78 MV/cm. It is shown that the nonuniformity of the electric field in the active region depends on the p–n junction bias.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2018

Establishing Outcrop Time Series at Various Depths in a Nonlinear Soil Column: An Iterative Approach

Seismic soil-structure interaction (SSI) analysis of nuclear facilities is an important consideration during design and retrofit. SSI tools used in the nuclear industry are currently based on an equivalent linear approach. Procedures for developing input ground motion for equivalent linear approaches are well established. However, the procedures for establishing input ground motion for Nonlinear Soil-Structure Interaction (NLSSI) analysis of nuclear facilities is not well established. A collaborative research group at Idaho National Laboratory (INL) has recently developed analytical methods and numerical tools for using NLSSI analysis for nuclear facility seismic calculations. NLSSI analysis for a nuclear facility allows for calculation of seismic wave motion through a near field soil domain using either, (1) vertically propagating shear and compressive waves, which is the current industry practice, or (2) a three-dimensional non-vertical wave field. This paper presents an iterative procedure for establishing outcrop motion at a depth in the soil column for NLSSI analysis that uses vertically propagating shear waves. The approach presented in this paper starts with a known ground motion at the surface, deconvolves to a depth, and then convolves the obtained motion up to a different desired location of input for the NLSSI model. To demonstrate the validity of the approach a finite element soil column, that is representative of a nuclear facility site in the US, is used to produce compatible outcrop seismic time series for reduced nonlinear soil mesh depths. The developed approach for reducing the nonlinear soil column model depth is a two-step iterative method; 1) the first step is establishing an outcrop time series at the lowest depth considered that produces the top-of-soil response spectrum of an actual recorded ground motion, and 2) the second step is providing compatible outcrop time series at a shallower depth based on the information from the first step. The comparison of the 5% damped response spectrum from the resulting acceleration time series based on the iterated outcrop motions and the original acceleration time series are conducted. The study showed that the proposed iterative approach produced comparable results within 1% range of the original recorded time series results when sufficient iterations were performed.

58 GEOSCIENCES↗

NASA NTRS1995

Hybrid Upwind Splitting (HUS) by a Field-by-Field Decomposition

We introduce and develop a new approach for upwind biasing: the hybrid upwind splitting (HUS) method. This original procedure is based on a suitable hybridization of current prominent flux vector splitting (FVS) and flux difference splitting (FDS) methods. The HUS method is designed to naturally combine the respective strengths of the above methods while excluding their main deficiencies. Specifically, the HUS strategy yields a family of upwind methods that exhibit the robustness of FVS schemes in the capture of nonlinear waves and the accuracy of some FDS schemes in the resolution of linear waves. We give a detailed construction of the HUS methods following a general and systematic procedure directly performed at the basic level of the field by field (i.e. waves) decomposition involved in FDS methods. For such a given decomposition, each field is endowed either with FVS or FDS numerical fluxes, depending on the nonlinear nature of the field under consideration. Such a design principle is made possible thanks to the introduction of a convenient formalism that provides us with a unified framework for upwind methods. The HUS methods we propose bring significant improvements over current methods in terms of accuracy and robustness. They yield entropy-satisfying approximate solutions as they are strongly supported in numerical experiments. Field by field hybrid numerical fluxes also achieve fairly simple and explicit expressions and hence require a computational effort between that of the FVS and FDS. Several numerical experiments ranging from stiff 1D shock-tube to high speed viscous flows problems are displayed, intending to illustrate the benefits of the present approach. We assess in particular the relevance of our HUS schemes to viscous flow calculations.

Coquel, Frederic↗

NASA NTRS2005

Life in the Atacama - Year 2: Geologic Reconnaissance Through Long-Range Roving and Implications on the Search for Life

The "Life in the Atacama" (LITA) project included two field trials during the 2004 field season, each of which lasted about a week. The remote science team had no prior knowledge of the local geology, and relied entirely on orbital images and rover-acquired data to make interpretations. The sites for these trials were in different locations, and are designated "Site B" and "Site C" respectively. The primary objective of the experiment is to develop and test the means to locate, characterize, and identify habitats and life remotely through long-range roving, which included field testing the rover, named Zoe. Zoe has onboard autonomous navigation for long-range roving, a plow to overturn rocks and expose near-surface rock materials, and high-resolution imaging, spectral, and fluorescence sampling capabilities. Highlights from the experiment included characterizing the geology in and near the landing ellipse, assessing pre-mission, satellite-based hypotheses, and improving the approach and procedures used by the remote and field teams for upcoming experiments through combined satellite, field-based, and microscopic perspectives and long-range roving.

Dohm, J. M.↗