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NASA NTRS1992

Electron spectroscopy analysis

The Surface Science Laboratories at the University of Alabama in Huntsville (UAH) are equipped with x-ray photoelectron spectroscopy (XPS or ESCA) and Auger electron spectroscopy (AES) facilities. These techniques provide information from the uppermost atomic layers of a sample, and are thus truly surface sensitive. XPS provides both elemental and chemical state information without restriction on the type of material that can be analyzed. The sample is placed into an ultra high vacuum (UHV) chamber and irradiated with x-rays which cause the ejection of photoelectrons from the sample surface. Since x-rays do not normally cause charging problems or beam damage, XPS is applicable to a wide range of samples including metals, polymers, catalysts, and fibers. AES uses a beam of high energy electrons as a surface probe. Following electronic rearrangements within excited atoms by this probe, Auger electrons characteristic of each element present are emitted from the sample. The main advantage of electron induced AES is that the electron beam can be focused down to a small diameter and localized analysis can be carried out. On the rastering of this beam synchronously with a video display using established scanning electron microscopy techniques, physical images and chemical distribution maps of the surface can be produced. Thus very small features, such as electronic circuit elements or corrosion pits in metals, can be investigated. Facilities are available on both XPS and AES instruments for depth-profiling of materials, using a beam of argon ions to sputter away consecutive layers of material to reveal sub-surface (and even semi-bulk) analyses.

Gregory, John C.↗

NASA NTRS2013

Thermal Analysis of Unusual Local-scale Features on the Surface of Vesta

At 525 km in mean diameter, Vesta is the second-most massive object in the main asteroid belt of our Solar System. At all scales, pyroxene absorptions are the most prominent spectral features on Vesta and overall, Vesta mineralogy indicates a complex magmatic evolution that led to a differentiated crust and mantle [1]. The thermal behavior of areas of unusual albedo seen on the surface at the local scale can be related to physical properties that can provide information about the origin of those materials. Dawn's Visible and Infrared Mapping Spectrometer (VIR) [2] hyperspectral images are routinely used, by means of temperature-retrieval algorithms, to compute surface temperatures along with spectral emissivities. Here we present temperature maps of several local-scale features of Vesta that were observed by Dawn under different illumination conditions and different local solar times.

Tosi, F.↗

DOE OSTI2019

Water properties under nano-scale confinement

Abstract Water is the universal solvent and plays a critical role in all known geological and biological processes. Confining water in nano-scale domains, as encountered in sedimentary rocks, in biological, and in engineered systems, leads to the deviations in water’s physicochemical properties relative to those measured for the non-confined phase. In our comprehensive analysis, we demonstrate that nano-scale confinement leads to the decrease in the melting/freezing point temperature, density, and surface tension of confined water. With increasing degree of spatial confinement the population of networked water, as evidenced by alterations in the O-H stretching modes, increases. These analyses were performed on two groups of mesoporous silica materials, which allows to separate pore size effects from surface chemistry effects. The observed systematic effects of nano-scale confinement on the physical properties of water are driven by alterations to water’s hydrogen-bonding network—influenced by water interactions with the silica surface — and has implications for how we understand the chemical and physical properties of liquids confined in porous materials.

Science & Technology - Other Topics↗

DOE OSTI2020

Theory of edge localized mode suppression by static resonant magnetic perturbations in the DIII-D tokamak

According to a recent paper [Hu et al ., Phys. Plasmas 26, 120702 (2019)], mode penetration at the top of the pedestal is a necessary and sufficient condition for the suppression of edge localized modes (ELMs) by a resonant magnetic perturbation (RMPs) in an H-mode tokamak discharge. This paper employs asymptotic matching theory to model a particular DIII-D discharge in which ELMs were suppressed by an externally generated, static, n ¼ 2, RMP whose amplitude was modulated at a frequency of 1 Hz. It is demonstrated that the response of the plasma to the applied RMP, in the immediate vicinities of the rational (i.e., resonant) surfaces, is governed by nonlinear, rather than by linear, physics. This is the case because the magnetic island widths associated with driven reconnection exceed the linear layer widths, even in cases where driven reconnection is strongly suppressed by plasma rotation. The natural frequency at a given rational surface (i.e., the helical frequency at which the locally resonant component of the RMP would need to propagate in order to maximize driven reconnection) is found to be offset from the local E B frame in the ion diamagnetic direction. The size of the offset is mostly determined by neoclassical poloidal rotation. Finally, the predictions of a fully nonlinear plasma response model are found to be broadly consistent with the DIII-D experimental data.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2022

SNICAR-ADv4: a physically based radiative transfer model to represent the spectral albedo of glacier ice

Abstract. Accurate modeling of cryospheric surface albedo is essential for our understanding of climate change as snow and ice surfaces regulate the global radiative budget and sea-level through their albedo and mass balance. Although significant progress has been made using physical principles to represent the dynamic albedo of snow, models of glacier ice albedo tend to be heavily parameterized and not explicitly connected with physical properties that govern albedo, such as the number and size of air bubbles, specific surface area (SSA), presence of abiotic and biotic light absorbing constituents (LACs), and characteristics of any overlying snow. Here, we introduce SNICAR-ADv4, an extension of the multi-layer two-stream delta-Eddington radiative transfer model with the adding–doubling solver that has been previously applied to represent snow and sea-ice spectral albedo. SNICAR-ADv4 treats spectrally resolved Fresnel reflectance and transmittance between overlying snow and higher-density glacier ice, scattering by air bubbles of varying sizes, and numerous types of LACs. SNICAR-ADv4 simulates a wide range of clean snow and ice broadband albedo (BBA), ranging from 0.88 for (30 µm) fine-grain snow to 0.03 for bare and bubble-free ice under direct light. Our results indicate that representing ice with a density of 650 kg m−3 as snow with no refractive Fresnel layer, as done previously, generally overestimates the BBA by an average of 0.058. However, because most naturally occurring ice surfaces are roughened “white ice”, we recommend modeling a thin snow layer over bare ice simulations. We find optimal agreement with measurements by representing cryospheric media with densities less than 650 kg m−3 as snow and larger-density media as bubbly ice with a Fresnel layer. SNICAR-ADv4 also simulates the non-linear albedo impacts from LACs with changing ice SSA, with peak impact per unit mass of LACs near SSAs of 0.1–0.01 m2 kg−1. For bare, bubble-free ice, LACs actually increase the albedo. SNICAR-ADv4 represents smooth transitions between snow, firn, and ice surfaces and accurately reproduces measured spectral albedos of a variety of glacier surfaces. This work paves the way for adapting SNICAR-ADv4 to be used in land ice model components of Earth system models.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS2020

Skin Sea‐Surface Temperature from VIIRS on Suomi‐NPP—NASA Continuity Retrievals

Retrievals of skin Sea‐Surface Temperature (SSTskin) from the measurements of the Visible Infrared Imaging Radiometer Suite on the Suomi‐National Polar‐orbiting Partnership satellite are presented and discussed. The algorithms used to derive the SSTskin from the radiometric measurements are given in detail. A number of approaches to assess the accuracy and stability of the Visible Infrared Imaging Radiometer Suite (VIIRS) SSTskin retrievals are reported, and factors including latitude and season, and physical processes in the atmosphere and at the surface are discussed. We conclude that the Suomi National Polar‐orbiting Partnership (S‐NPP) VIIRS is capable of matching and improving upon the accuracies of SSTskin from the MODISs on Terra and Aqua, and that the VIIRS SSTskin fields have the potential to contribute to the extension of the satellitederived Climate Data Records of SST into the future.

sea‐surface temperature↗

NASA NTRS2017

User Needs and Advances in Space Wireless Sensing and Communications

Decades of space exploration and technology trends for future missions show the need for new approaches in space/planetary sensor networks, observatories, internetworking, and communications/data delivery to Earth. The User Needs to be discussed in this talk includes interviews with several scientists and reviews of mission concepts for the next generation of sensors, observatories, and planetary surface missions. These observatories, sensors are envisioned to operate in extreme environments, with advanced autonomy, whereby sometimes communication to Earth is intermittent and delayed. These sensor nodes require software defined networking capabilities in order to learn and adapt to the environment, collect science data, internetwork, and communicate. Also, some user cases require the level of intelligence to manage network functions (either as a host), mobility, security, and interface data to the physical radio/optical layer. For instance, on a planetary surface, autonomous sensor nodes would create their own ad-hoc network, with some nodes handling communication capabilities between the wireless sensor networks and orbiting relay satellites. A section of this talk will cover the advances in space communication and internetworking to support future space missions. NASA's Space Communications and Navigation (SCaN) program continues to evolve with the development of optical communication, a new vision of the integrated network architecture with more capabilities, and the adoption of CCSDS space internetworking protocols. Advances in wireless communications hardware and electronics have enabled software defined networking (DVB-S2, VCM, ACM, DTN, Ad hoc, etc.) protocols for improved wireless communication and network management. Developing technologies to fulfil these user needs for wireless communications and adoption of standardized communication/internetworking protocols will be a huge benefit to future planetary missions, space observatories, and manned missions to other planets.

Kegege, Obadiah↗

DOE OSTI2022

Effects of plasma on physical properties of water: nanocrystalline-to-amorphous phase transition and improving produce washing

Recently is was discovered in various applications that many physical and chemical properties of water change their temperature dependence between about 35 and 60 degrees Celsius. In particular, heat conductance, light absorption, and surface tension all change their temperature dependence. These drastic changes were associated with water gradually changing its mesoscopic structure: while at the higher temperatures water is a uniform media (amorphous state), at the temperatures below transition it consists of many nano-to-micro-scale clusters (crystalline state). This transition is similar to the second order phase transition. In the present paper we show that treating water with non-thermal plasma (adding plasma-created active compounds) can lower the temperature of the transition and thus cause a significant change in such physical quantities as surface tension, viscosity, freezing rate, and wettability and washability. We present analytical estimates of the transition temperature shift based on the Debye-Hückel theory. We discuss the produce-washing experiments that illustrate the predicted effects.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2023

Iron-based superconductors: Teenage, complex, challenging

Here, fifteen years after the surprising discovery of superconductivity in iron-based materials, researchers are beginning to impart some of their newfound wisdom on a slew of emerging superconductors that display similar traits.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2025

Correlation-driven topological band inversion in VSe 2

Recent spectroscopic studies have uncovered topological surface states and band inversion in 1⁢T−VSe 2 , positioning this material at the intersection of correlated electron physics and nontrivial band topology. While previous interpretations attribute these features to surface strain, the microscopic origin of the topological band structure remains unresolved. Here, we present an alternative explanation based on electronic correlations, showing that a negative effective Hubbard interaction (𝑈 eff < 0) applied to the Se 4p orbitals can reproduce the experimentally observed band inversion at both the Γ and 𝑀 points. Using density functional theory (DFT) calculations with orbital-selective interactions, we demonstrate that this approach naturally gives rise to topological surface states without invoking structural distortions. In conclusion, our results highlight the crucial role of ligand orbital correlations in shaping band topology and provide a novel framework for understanding and engineering topological phases in chalcogenide-based quantum materials.

36 MATERIALS SCIENCE↗

DOE OSTI2016

Hierarchical Multi-Scale Approach To Validation and Uncertainty Quantification of Hyper-Spectral Image Modeling

Validating predictive models and quantifying uncertainties inherent in the modeling process is a critical component of the HARD Solids Venture program [1]. Our current research focuses on validating physics-based models predicting the optical properties of solid materials for arbitrary surface morphologies and characterizing the uncertainties in these models. We employ a systematic and hierarchical approach by designing physical experiments and comparing the experimental results with the outputs of computational predictive models. We illustrate this approach through an example comparing a micro-scale forward model to an idealized solid-material system and then propagating the results through a system model to the sensor level. Our efforts should enhance detection reliability of the hyper-spectral imaging technique and the confidence in model utilization and model outputs by users and stakeholders.

Engel, David W.↗

NASA NTRS2021

Robotics Instrument Deployment System Surface Operations for the InSight Mars Lander

This paper describes NASA’s first successful precision robotics instrument placement and release on another astronomical body since Apollo. This operations breakthrough enabled NASA’s InSight lander to detect the first known ‘marsquake’, a faint trembling of Mars’s surface on 6th April 2019, 128 Martian days after landing on Mars on the 26th November 2018. This is the first quake detected on an astronomical body other than Earth or the Moon. This paper describes the operations of the Robotics Instrument Deployment Systems (IDS) that successfully deployed the InSight science payload to the surface of Mars. The payload includes a seismometer (SEIS), Wind and Thermal Shield (WTS) and Heat Flow and Physical Properties Package (HP3), enabling scientists to perform the first comprehensive surface-based geophysical investigation of Mars’ interior structure. In addition, the paper describes the IDS planning and command sequence generation process used for the successful deployment of SEIS, WTS and HP3 on the surface of Mars. The paper concludes with recommendations based on the experience gained from InSight IDS operations. This includes identified technology gaps in the operations of in-situ manipulators for planetary exploration.

Yen, Jeng↗

NASA NTRS2011

Subtropical Gyre Variability as Seen from Satellites

A satellite multi-sensor approach is used to analyse the biological response of open ocean regions of the subtropical gyres to changes in physical forcing. Thirteen years (1998-2010) of SeaWiFS chlorophyll a (Chl-a), combined with concurrent satellite records of sea-surface temperature (SST) and sea level height, were analysed to investigate the seasonal and interannual variability of Chl-a concentration within these immense so-called ocean deserts. The seasonal variability of Chl-a within the gyres is driven mostly by the warming/cooling of surface waters. Summer warming promotes shallower mixed layers and lower Chl-a due to a reduction of vertical mixing and consequently a decrease in nutrient supply. The opposite happens during the winter cooling period. Therefore, long-term trends in SST have the potential to cause an impact on the interannual variability of Chl-a. Our analyses show that, during the 13 whole years of SeaWiFS data record, the North Pacific, Indian Ocean, and North Atlantic gyres experienced a decrease in Chl-a of 9%, 12%, and 11%, respectively, with corresponding SST increases of 0.27 C, 0.42 C, and 0.32 C. The South Pacific and South Atlantic gyres also showed warming trends but with weak positive trends in Chl-a that are not statistically significant. We hypothesize that the warming of surface waters in these two gyres are counterbalanced by other interacting physical and biological driving mechanisms, as indicated in previous studies.

Signorini, Sergio R.↗

NASA NTRS1994

Aerothermodynamics of Pyrolizing Surfaces in Hypersonic Rarefied Flows

Direct simulation Monte Carlo (DSMC) calculations of rarefied flows about entry bodies typically employ a fixed surface temperature or a radiative-equilibrium energy balance to compute that temperature. Such boundary conditions neglect any effects of heat capacitance and heat conduction in the spacecraft heat shield and, therefore, provide an upper bound for the surface temperature. Such calculations also neglect pyrolysis from the heat shield which can be significant for a high-energy incident flow at very low densities. Accurate prediction of both heating and aerodynamic forces requires including pyrolysis and surface heat transfer in the models for gas-surface interaction employed in DSMC methods. Although these physical models have long appeared in various continuum flow calculation codes, they have only recently appeared in DSMC codes which are required to simulate rarefied flows during entry at high altitudes. In the current implementation, routines from the widely distributed Charring Material Thermal Response and Ablation (CMA) program are coupled into a DSMC code to calculate the one-dimensional heat transfer into the carbon phenolic heat shield at each point on a vehicle surface. Temperature-dependent material properties, surface re-radiation, and in-depth pyrolysis were included in the calculation, but surface ablation was neglected. Sample calculations for entry of the Galileo probe into the atmosphere of Jupiter demonstrate that including pyrolysis in the model leads to significant differences in predicted aerodynamics. Granted, the drag coefficient does not depend strongly on the surface temperature which can itself be significantly below the radiative equilibrium value during entry. However, the surface mass flux due to pyrolysis of the material is significant once the probe drops to altitudes characterized by transition flow. This leads to a noticeable increase in drag and a decrease in heating compared to a body without pyrolysis.

Haas, Brian L.↗

DOE OSTI2022

Nematic superconductivity in a one-dimensional system of massless fermions

The superconducting properties of the one-dimensional model of “relativistic” fermions with attraction generated by antiferromagnetic (Heisenberg) pair superexchange spin interaction are studied. Namely, we demonstrate that such a pairing in this system takes place in the nematic channel, with extended s-wave symmetry, where the attraction between fermions mostly takes place when the fermions occupy the nearest sites. It is demonstrated, that the zero-temperature properties of such a system are rather different from the “standard” case of superconductivity with local attraction. For instance, the order parameter has an unusual helical momentum dependence, ∼e −ika ⁠, where a is the lattice parameter and the dependence of the gap on doping has a bell shape, qualitatively similar to cuprate high-T c superconductors. Finally, the smooth transition from the overlapping pair to the local pair regime (or BCS–BEC crossover) in the nematic phase takes place at much lower values of doping as compared to the local pairing case, i.e., the “relativistic 1D” nematic superconductor is much less “friendly” to the local pairs. In conclusion, we also discuss the possible relation of the properties of this model to the superconducting properties of twisted graphene.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

NASA NTRS1989

A PBL-radiation model for application to regional numerical weather prediction

Often in the short-range limited-area numerical weather prediction (NWP) of extratropical weather systems the effects of planetary boundary layer (PBL) processes are considered secondarily important. However, it may not be the case for the regional NWP of mesoscale convective systems over the arid and semi-arid highlands of the southwestern and south-central United States in late spring and summer. Over these dry regions, the PBL can grow quite high up into the lower middle troposphere (600 mb) due to very effective solar heating and hence a vigorous air-land thermal interaction can occur. The interaction representing a major heat source for regional dynamical systems can not be ignored. A one-dimensional PBL-radiation model was developed. The model PBL consists of a constant-flux surface layer superposed with a well-mixed (Ekman) layer. The vertical eddy mixing coefficients for heat and momentum in the surface layer are determined according to the surface similarity theory, while their vertical profiles in the Ekman layer are specified with a cubic polynomial. Prognostic equations are used for predicting the height of the nonneutral PBL. The atmospheric radiation is parameterized to define the surface heat source/sink for the growth and decay of the PBL. A series of real-data numerical experiments has been carried out to obtain a physical understanding how the model performs under various atmospheric and surface conditions. This one-dimensional model will eventually be incorporated into a mesoscale prediction system. The ultimate goal of this research is to improve the NWP of mesoscale convective storms over land.

Chang, Chia-Bo↗

DOE OSTI2023

Detailed studies of the processes in low energy H irradiation of Li and Li-compound surfaces

We have used a combination of pico-to-nano temporal/spatial scale computational physics and chemistry modeling of plasma–material interfaces in the tokamak fusion plasma edges to unravel the evolving characteristics, not readily accessible by empirical means, of lithium-, oxygen-, and hydrogen-containing materials of plasma-facing components under irradiation by hydrogen and its isotopes. In the present calculation, amorphous lithium compound surfaces containing oxygen, Li 2 O, and LiOH were irradiated by 1-100 eV particles at incident angles on the surface ranging from perpendicular to almost grazing angles. Consequential surface processes, reflection, retention, and sputtering were studied at “the same footing” and compared to earlier results from amorphous Li and LiH surfaces. In conclusion, the critical role of charging dynamics of lithium, oxygen, and hydrogen atoms in the surface chemistry during hydrogen-fuel irradiation was found to drive the kinetics and dynamics of these surfaces in unexpected ways that ultimately could have profound effects on fusion plasma confinement behavior and surface erosion.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2017

Local synthesis of 3D magnetic surfaces

Local synthesis of nested 3D toroidal magnetic surfaces is carried out on the basis of the general theory of surfaces by using magnetic coordinates (generally unknown a priori). An equilibrium magnetic surface is calculated by specifying two functions on the surface (the absolute value of the magnetic field and the distance to the nearest magnetic surface) and three parameters (the rotational transform, pressure gradient, and poloidal current). The choice of the parameters is restricted by the requirement that the surface should be closed toroidally. A method of synthesis of a closed magnetic surface is proposed when two functions—the absolute value of the magnetic field and the major radius—are specified. A set of harmonics of a new type of poloidally preudosymmetric configuration (a toroidal mirror with a large mirror ratio and small rotational transform) is obtained.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗