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DOE OSTI2023

Phase patterning of metallic glasses through superfast quenching of ion irradiation-induced thermal spikes

Amorphous metallic glasses (MGs) convert to crystalline solids upon annealing at a high temperature. Such a phase change, however, does not occur with the local melting caused by damage cascades introduced by ion irradiation, although the resulting thermal spikes can reach temperatures > 1000 K. This is because the quenching rate of the local melting zone is several orders of magnitude higher than the critical cooling rate for MG formation. Thus the amorphous structure is sustained. This mechanism increases the highest temperature at which irradiated MG sustains amorphous phase. More interestingly, if an irradiated MG is pre-annealed to form a polycrystalline structure, ion irradiation can locally convert this crystalline phase to an amorphous phase if the grains are nanometers in size and comparable to the damage cascade volume size. Combining pre-annealing and site selective ion irradiation, patterned crystalline-amorphous heterogeneous structures have been fabricated. This finding opens new doors for various applications.

36 MATERIALS SCIENCE↗

NASA NTRS1982

Performing spectroscopic and specific heat studies of improper ferroelectrics

The results of infrared measurements on Ni-Br, Cu-Cl, and Fe-I boracite improper ferroelectrics and far infrared measurements of Ni-Br boracite are presented. The boracites have the general formula X3B7O3Y, where X = divalent metal and Y = halogen. They undergo a first order phase transition from a high temperature paraelectric phase with cubic symmetry to a ferroelectric phase with orthorhombic symmetry. The boracites are "improper ferroelectrics" since the spontaneous polarization is not the primary order parameter in the cubic-orthorhombic phase transition. Current understanding of these materials is that the primary order parameter is associated with a doubly degenerate zone-boundary phonon in the cubic phase. The degenerate critical modes become homogeneous and split into the A sub 1 and A sub 2 modes in the orthorhombic phase, doubling the volume of the primitive cell. An harmonic coupling between the softing A sub 1 and a low frequency A sub 1 optic mode induces a spontaneous polarization as a secondary effect in the ferroelectric phase. This secondary non-critical nature of the ferroelectric mode earns these materials the "improper" title and is responsible for their unique properties and high figure of merit in detector use.

Coleman, L. B.↗

NASA NTRS1986

The behavior of planetary wave 2 in preconditioned zonal flows

The response of linear planetary wave 2 to changes in the isentropic zonally symmetric distribution of potential vorticity (PV) is investigated numerically. Wave 2 is sensitive to the width and position of a region where the meridional derivative of PV is weak, denoted the 'surf zone', in the middle stratosphere. A narrow surf zone leads to an amplification of wave 2, and confines some of its Eliassen-Palm wave activity in high latitudes. For wider surf zones the wave activity is concentrated near the associated critical surface, and the amplitude of the wave decreases. Large changes in the wave amplitude and in the distribution of its activity are associated with the subtle changes in the zonal winds produced by modest modifications in the distribution of PV. Basic states that include regions of reversed meridional gradients of PV lead to wave overreflection and strong poleward focusing of wave activity. The amplitude of wave 2 is enhanced in the presence of negative gradients, with large responses occurring for eastward traveling waves.

Robinson, Walter A.↗

NASA NTRS2003

A phase response curve to single bright light pulses in human subjects

The circadian pacemaker is differentially sensitive to the resetting effects of retinal light exposure, depending upon the circadian phase at which the light exposure occurs. Previously reported human phase response curves (PRCs) to single bright light exposures have employed small sample sizes, and were often based on relatively imprecise estimates of circadian phase and phase resetting. In the present study, 21 healthy, entrained subjects underwent pre- and post-stimulus constant routines (CRs) in dim light (approximately 2-7 lx) with maintained wakefulness in a semi-recumbent posture. The 6.7 h bright light exposure stimulus consisted of alternating 6 min fixed gaze (approximately 10 000 lx) and free gaze (approximately 5000-9000 lx) exposures. Light exposures were scheduled across the circadian cycle in different subjects so as to derive a PRC. Plasma melatonin was used to determine the phase of the onset, offset, and midpoint of the melatonin profiles during the CRs. Phase shifts were calculated as the difference in phase between the pre- and post-stimulus CRs. The resultant PRC of the midpoint of the melatonin rhythm revealed a characteristic type 1 PRC with a significant peak-to-trough amplitude of 5.02 h. Phase delays occurred when the light stimulus was centred prior to the critical phase at the core body temperature minimum, phase advances occurred when the light stimulus was centred after the critical phase, and no phase shift occurred at the critical phase. During the subjective day, no prolonged 'dead zone' of photic insensitivity was apparent. Phase shifts derived using the melatonin onsets showed larger magnitudes than those derived from the melatonin offsets. These data provide a comprehensive characterization of the human PRC under highly controlled laboratory conditions.

Randomized Controlled Trial↗

DOE OSTI2024

Convolutional Neural Network-Based Protection-Zone Classification of Faults in Distribution Feeders with Photovoltaics.

Fault detection and isolation is critical for reliable operation of distribution systems. The ride-through requirements for the distributed energy resources (DER), mandated by the IEEE 1547-2018 standard, makes it challenging to use undervoltage (UV) conditions for fault detection. In addition, with low fault current contribution from these inverter-based DERs, the time-overcurrent relays are also less effective. Thus motivated, this paper presents a learning-based approach for fault detection and localization. A convolutional neural network (CNN)-based model is proposed which uses local voltage and current waveforms from DER locations and feeder substations, for training a zonal classifier. The classifier can be adopted into any relay-like device for discriminating between faults originating from different protection zones. The performance of the proposed approach was tested on publicly available test feeders with distributed photovoltaics (PVs).

Fault localization, convolutional neural networks,↗

DOE OSTI2025

Modeling commercial-scale CO 2 storage in the gas hydrate stability zone with PFLOTRAN v6.0

Abstract. Safe and secure carbon dioxide (CO2) storage is likely to be critical for mitigating some of the most dangerous effects of climate change. In the last decade, there has been a significant increase in activity associated with reservoir characterization and site selection for large-scale CO2 storage projects across the globe. These prospective storage sites tend to be selected for their optimal structural, petrophysical, and geochemical trapping potential. However, it has also been suggested that storing CO2 in reservoirs within the CO2 hydrate stability zone (GHSZ), characterized by high pressures and low temperatures (e.g., Arctic or marine environments), could provide a natural thermodynamic barrier to gas leakage. Evaluating the prospect of commercial-scale, long-term storage of CO2 in the GHSZ requires reservoir-scale modeling capabilities designed to account for the unique physics and thermodynamics associated with these systems. We have developed the HYDRATE flow mode and the accompanying fully implicit parallel well model in the massively parallel subsurface flow and reactive transport simulator PFLOTRAN to model CO2 injection into the marine GHSZ. We have applied these capabilities to a set of CO2 injection scenarios designed to reveal the challenges and opportunities for commercial-scale CO2 storage in the GHSZ.

carbon storage↗

NASA NTRS1987

Evidence for variations in magma production along oceanic spreading centers - A critical appraisal

Recent geologic, geophysical, and geochemical studies of the oceanic lithosphere near fracture zones have resulted in the proposal that the 'magma budget,' defined as the amount of magma delivered to magma chambers or conduits beneath a spreading center for a given amount of spreading, decreases as fracture zones are approached. Seismic reflection and refraction studies indicate that the crust becomes anomalously thin near fracture zones, but reference must be made to the boundary between residual upper mantle peridotites and overlying cumulate rocks in order to assess potential variations in the magma budget. The position of this interface, however, generally is not constrained by geophysical studies. Geochemical variations in basaltic glasses collected near fracture zones are consistent with a decrease in partial melting as fracture zones are approached, but they could also be produced by variations in open-system magmatic processes with no change in the extent of partial melting. Although a decrease in the magma budget as fracture zones are approached is consistent with these data, so are alternative models that incorporate a constant magma budget.

Karson, J. A.↗

NASA NTRS1997

A Comparison of Sea Ice Type, Sea Ice Temperature, and Snow Thickness Distributions in the Arctic Seasonal Ice Zones with the DMSP SSM/I

Global climate studies have shown that sea ice is a critical component in the global climate system through its effect on the ocean and atmosphere, and on the earth's radiation balance. Polar energy studies have further shown that the distribution of thin ice and open water largely controls the distribution of surface heat exchange between the ocean and atmosphere within the winter Arctic ice pack. The thickness of the ice, the depth of snow on the ice, and the temperature profile of the snow/ice composite are all important parameters in calculating surface heat fluxes. In recent years, researchers have used various combinations of DMSP SSMI channels to independently estimate the thin ice type (which is related to ice thickness), the thin ice temperature, and the depth of snow on the ice. In each case validation efforts provided encouraging results, but taken individually each algorithm gives only one piece of the information necessary to compute the energy fluxes through the ice and snow. In this paper we present a comparison of the results from each of these algorithms to provide a more comprehensive picture of the seasonal ice zone using passive microwave observations.

St.Germain, Karen↗

DOE OSTI2025

Exploring the impact of hydro-mechanical coupling on compaction localization

In deep subsurface environments, where porous rocks are saturated with fluids, hydromechanical coupling plays a critical role in the formation and propagation of localized deformation zones, such as compaction bands. In this study, we numerically investigate the influence of fluid-rock interactions on the development of compaction localization in fluid-saturated rocks. For this purpose, it uses a numerical framework that adapts the heat equation to model the diffusion of pore pressure caused by deformation. This is achieved with specialized subroutines for material behavior and heat transfer formulated within the ABAQUS platform and by allowing changes in rock permeability during strain localization. The results highlight that hydromechanical coupling significantly alters the compaction behavior compared to dry conditions. Under high confining stress, excess pore pressure inhibits the progression of compaction fronts, while in time-dependent processes like rock creep, pore pressure transients accelerate deformation by creating feedback loops between mechanical forces and fluid flow. These findings underscore the importance of saturation in controlling the dynamics of compaction localization and provide insights into the interplay between pore pressure, deformation, and permeability. The implications of this study extend to applications in geological storage, resource extraction, and subsurface geomechanics, offering a deeper understanding of coupled hydromechanical processes in porous rocks.

58 GEOSCIENCES↗

DOE OSTI2024

Climatic Drivers for the Variation of Gross Primary Productivity Across Terrestrial Ecosystems in the United States

Abstract Temperature and water stress are important factors limiting the gross primary productivity (GPP) in terrestrial ecosystems, yet the extent of their influence across ecosystems remains uncertain. This study examines how surface air temperature, soil water availability (SWA) and vapor pressure deficit (VPD) influence ecosystem light use efficiency (LUE), a critical metric for assessing GPP, across different ecosystems and climatic zones at 80 flux tower sites based on in situ measurements and data assimilation products. Results indicate that LUE increases with temperature in spring, with higher correlation coefficients in colder regions (0.79–0.82) than in warmer regions (0.68–0.78). LUE reaches a plateau earlier in the season in warmer regions. LUE variations in summer are mainly driven by SWA, exhibiting a positive correlation indicative of a water‐limited regime. The relationship between the daily LUE and daytime temperature shows a clear seasonal hysteresis at many sites, with a higher LUE in spring than in fall under the same temperature, likely resulting from younger leaves being more efficient in photosynthesis. Drought stress influences LUE through SWA in all ranges of water availability; VPD variation under moderate conditions does not have a clear influence on LUE, but extremely high VPD (exceeding the threshold of 1.6 kPa, often observed during extreme drought‐heat events) causes a dramatic reduction of LUE. Our findings provide insight into how ecosystem productivities respond to climate variability and how they may change under the influence of more frequent and severe heat and drought events projected for the future.

Environmental Sciences & Ecology↗

DOE OSTI2022

Photocatalyzed electron exchange between organic chromophores and hematite nanoparticles and the role of solid-state charge transport

Understanding photocatalyzed redox interactions between Fe(III)–(oxyhydr)oxide mineral nanoparticles and adsorbed chromophoric organic matter is critical for accurately predicting bioavailable iron fluxes in the euphotic zone of natural aquatic systems, and for improving the effectiveness of nano-iron-based water purification systems. However, the electron transfer processes that underpin photoreductive dissolution at particle/organic/solution interfaces occur on ultrafast timescales and thus remain difficult to probe. In this work, we report an ultrafast transient absorption spectroscopy (TAS) study of suspensions of hematite nanoplatelets (HNPs) sensitized by adsorbed rhodamine B (RhB) dye as a function of solution media and pH. The TAS results indicate a substantially longer fluorescence lifetime of RhB adsorbed on HNPs across a wide range of pH conditions, consistent with transient photoinduced electron transfer to the oxide with recombination kinetics controlled by electron migration back to the interface via small polaron hopping. Normalization of the observed kinetics to the measured surface loading of RhB at different pH values shows that the recombination rates are insensitive to environmental variables, likely controlled instead by particle properties that determine small polaron diffusion behavior.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2022

A hierarchy of global ocean models coupled to CESM1

We develop a hierarchy of simplified ocean models for coupled ocean, atmosphere, and sea ice climate simulations using the Community Earth System Model version 1 (CESM1). The hierarchy has four members: a slab ocean model, a mixed-layer model (MLM) with entrainment and detrainment, an Ekman MLM, and an ocean general circulation model (OGCM). Flux corrections of heat and salt are applied to the simplified models ensuring that all hierarchy members have the same climatology. We diagnose the needed flux corrections from auxiliary simulations in which we restore the temperature and salinity to the daily climatology obtained from a target CESM1 simulation. The resulting three-dimensional corrections contain the interannual variability fluxes that maintain the correct vertical gradients of temperature and salinity in the tropics. We find that the inclusion of mixed-layer entrainment and Ekman flow produces sea surface temperature and surface air temperature fields whose means and variances are progressively more similar to those produced by the target CESM1 simulation. We illustrate the application of the hierarchy to the problem of understanding the response of the climate system to the loss of Arctic sea ice. We find that the shifts in the positions of the mid-latitude westerly jet and of the Inter-tropical Convergence Zone (ITCZ) in response to sea-ice loss depend critically on upper ocean processes. Specifically, heat uptake associated with the mixed-layer entrainment influences the shift in the westerly jet and ITCZ. Moreover, the shift of ITCZ is sensitive to the form of Ekman flow parameterization.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS1975

An in-flight investigation of nonlinear roll control

An in-flight simulation was undertaken to study the piloting problems associated with a type of nonlinear control effectiveness which is characteristic of spoiler roll control systems. Typically, the initial response is small or even zero, followed by a narrow region of highly effective control, and a final one of moderate effectiveness. Results for the landing flare and touchdown, which turned out to be the critical flight phase, indicate that a substantial amount of dead zone and changing effectiveness can be tolerated, but the best level of handling is obtained with linear, aileron-like control.

Ellis, D. R.↗

NASA NTRS1986

Physical conditions near red giant and supergiant stars - An interpretation of SiO VLBI maps

Understanding the dynamical structure of circumstellar envelopes around cool giant and supergiant stars depends critically on the knowledge of what happens in the 'near zone' of the envelope, within a few stellar radii of the star. One probe with adequate angular resolution to study the near zone is VLBI observation of the SiO masers. It is shown that VLBI maps of VX Sgr establish that the particle density in the SiO masers is very high (about 10 to the 12th/cu cm), indicating that the masers form in dense cloudlets and not in a spherically expanding wind. The implications of these results for the mechanism of mass loss are discussed.

Alcock, Charles↗

NASA NTRS1991

Detonation of cryogenic gaseous hydrogen-oxygen mixtures

The accidental mixing and detonation of oxygen-hydrogen mixtures is a serious aerospace industry hazard. The detonation characteristics of cryogenic mixtures of gaseous hydrogen and oxygen have accordingly been studied at various initial pressures and equivalence ratios at 100 K, and the results compared with numerical computations of idealized, steady-state, one-dimensional Zeldovich-von Neumann-Doering detonation structure with detailed chemical reaction kinetics. The predictions thus obtained for critical tube diameter, on the basis of calculated reaction-zone thickness, are found to agree reasonably well with experimental data.

Plaster, M.↗

NASA NTRS1993

Manson impact structure, Iowa: First geochemical results for drill core M-1

The Manson Impact Structure is a large complex impact crater centered ca. S km north of the town of Manson, Iowa. It is the largest intact impact structure recognized in the United States (35 km in diameter). Its Ar-40/Ar-39 age is indistinguishable from that of the Cretaceous-Tertiary (K-T) boundary. The Manson structure may be one element of the events at the K-T boundary. The crater is completely covered by Quaternary glacial sedimentary deposits that are normally underlain by Cretaceous clastic sediments and flat-lying carbonate sediments of Phanerozoic age, as well as Proterozoic red clastic, metamorphic, volcanic, and plutonic rock sequences. The study of a reflection seismic profile, provided by Amoco, was critical in interpreting the structure. In the 35 km diameter zone that marks the extension of the crater the normal rock sequence is disturbed due to the impact, and at the center of the structure granitic basement rocks are present that have been uplifted from about 4 km depth. Our studies consist of detailed petrological and geochemical characterization of all cores, with emphasis on a detailed description of all rock types found in the core samples and their relationship to target rocks. Geochemical data on samples from the Manson M-1 core are presented.

Koeberl, Christian↗

NASA NTRS2017

HydroCube Mission Concept: P-Band Signals of Opportunity for Remote Sensing of Snow and Root Zone Soil Moisture

We have developed the HydroCube mission concept with a constellation of small satellites to remotely sense Snow Water Equivalent (SWE) and Root Zone Soil Moisture (RZSM). The HydroCube satellites would operate at sun-synchronous 3-day repeat polar orbits with a spatial resolution of about 1-3 Km. The mission goals would be to improve the estimation of terrestrial water storage and weather forecasts. Root-zone soil moisture and snow water storage in land are critical parameters of the water cycle. The HydroCube Signals of Opportunity (SoOp) concept utilizes passive receivers to detect the reflection of strong existing P-band radio signals from geostationary Mobile Use Objective System (MUOS) communication satellites. The SWE remote sensing measurement principle using the P-band SoOp is based on the propagation delay (or phase change) of radio signals through the snowpack. The time delay of the reflected signal due to the snowpack with respect to snow-free conditions is directly proportional to the snowpack SWE. To address the ionospheric delay at P-band frequencies, the signals from both MUOS bands (360-380 MHz and 250-270 MHz) would be used. We have conducted an analysis to trade off the spatial resolution for a space-based sensor and measurement accuracy. Through modeling analysis, we find that the dual-band MUOS signals would allow estimation of soil moisture and surface roughness together. From the two MUOS frequencies at 260 MHz and 370 MHz, we can retrieve the soil moisture from the reflectivity ratio scaled by wavenumbers using the two P-band frequencies for MUOS. A modeling analysis using layered stratified model has been completed to determine the sensitivity requirements of HydroCube measurements. For mission concept demonstration, a field campaign has been conducted at the Fraser Experimental Forest in Colorado since February 2016. The data acquired has provided support to the HydroCube concept.

Derksen, Chris↗

NASA NTRS2018

UAS-Based P-Band Signals of Opportunity for Remote Sensing of Snow and Root Zone Soil Moisture

We have developed the P-band Signals of Opportunity (SoOp) sensor based on the Unmanned Aircraft System (UAS) to remotely sense Snow Water Equivalent (SWE) and Root Zone Soil Moisture (RZSM). The P-band UAS SoOp sensor for Hydrology (UASHydro) would operate on the S2 aircraft developed by Black Swift Technologies for sensing of SWE and RZSM with a spatial resolution of about 10m. Root-zone soil moisture and snow water storage in land are critical parameters of the water cycle. The long-term goal of our development would be to use small UAS to perform regional high resolution observation of two key hydrological measurements to improve the estimation of terrestrial water storage for water management, crop production and forecasts of natural hazard. The UASHydro concept utilizes passive receivers to detect the reflection of strong existing P-band radio signals at the 360-380 MHz band from geostationary Mobile Use Objective System (MUOS) communication satellites launched by the US Navy. The SWE remote sensing measurement principle using the P-band SoOp is based on the propagation delay (or phase change) of radio signals through the snowpack. The time delay of the reflected signal due to the snowpack with respect to snow-free conditions is directly proportional to the snowpack SWE, while the soil moisture can be retrieved from the reflectivity at the P-band frequencies for MUOS. We have been conducting ground-based campaigns to test the instrumentation and data processing methods at the Fraser Experimental Forest in Colorado since February 2016. The field campaign data has provided support to the measurement concept. To install the SoOp technologies on the UAS, a lightweight antenna has been built and interfaces with the S2 built by Black Swift Technologies have been completed. A set of flights have been planned starting April 2018 through the end of 2018 in Colorado.

Elston, Jack↗