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At least 505 records · Page 28

CTE Measurements of Carbon Fibers in ESEM

The strong appeal of carbon fiber reinforced ceramic matrix and carbon-carbon composites arises from their promising high temperature performance within laboratory-simulated nozzle, leading edge and combustor environments. The main drawback in these systems are two fold; namely oxidation affinity and CTE mismatch. To date the emphasis has been on axial CTE mismatch with the push on estimating (component) laminate level data. However, in heterogeneous and anisotropic systems, all failure mechanisms are at micro or nano scales. This paper will report plans and progress on single carbon fibers efforts in order to develop its temperature dependent, anisotropic thermophysical and thermomechanical properties using combination of x-ray spectroscopy and environmental scanning electron microscopy to capture circumferential expansion from 20-900 C in within the SEM chamber. Surface roughness measurements were also determined. Crystallinity was also determined by the quality of the electron diffraction (ED) patterns.

Effinger, Michael↗

A First Principles Approach to Spectral Phonon Transport in Heterostructures

Understanding thermal transport across interfaces which give rise to a thermal resistance (also known as Kapitza resistance) is a critical issue affecting the development of nanotechnologies. Much modern and emergent nanotechnology consist of adjacent materials, and phonon mediated heat transfer governs thermal behavior across internal interfaces in these devices. The physics of thermal transport in solids are governed both by phenomena occurring at the atomic scale and interactions with the material's microstructure. The forecasting of fundamental quantities such as temperature, heat flux and thermal conductivity typically employs the semi-classical Boltzmann transport equation to predict the macroscopic behavior of materials in terms of the microscopic dynamics of its heat carriers. Kapitza resistance was first discovered in liquid helium experiments and has led to a fundamental research thrust in micro and nano-scale heat transport, the behavior of thermal carriers across internal interfaces. Thermal interfacial resistance (TIR) is a widely studied phenomenon, first engaged by Swartz and Pohl through their development of the acoustic and diffuse mismatch methods, then continued through myriad efforts with varying methods and approaches in an attempt to resolve carrier behavior at thermal interfaces. Many of the fundamental approaches to TIR have been at the nanoscale, and research is conducted with molecular dynamics (MD) and density functional theory (DFT) methods. The limitations of these methods is system size; atomistic methods tend to be limited to system sizes of 100,000 atoms or less. Larger length-scale methods have also been pursued, based on the principles of acoustic or diffuse mismatch, but not all include simulation of TIR using a full phonon band spectrum, or temperature dependent methods. Our approach to enabling phonon transport in layered materials draws upon our previous work of demonstrating spectrally coupled phonon transport in homogeneous and heterogeneous materials. We use a semi-analytical approach in which the Bose-Einstein (B-E) statistics set the strength of the phonon radiance in a frequency group, but the B-E statistics are informed with information from the transport system. The B-E statistics in a single frequency group feels the influence of all the groups through the spatial temperature. We also include a new field term which is an indicator of the amount of non-equilibrium behavior of the phonon spectrum---this is added to the phonon source term in all groups to ensure closure and conservation of energy, as the phonon groups in the transport system and the analytical systems are coupled. This work builds upon our previous approach by adding a phonon coupling term at an internal interface, using the principles of the DMM through transmission and reflection coefficients. In this work, the coefficients are determined through computing a common temperature at the interface, influenced by the phonon band structure of both materials, in effect, providing mixing between the two material systems and using the common temperature to set the strength of the phonon radiance at the boundaries on either side of the interface. Our approach uses material properties computed along various crystallographic orientations, and while some isotropy is built into the interface condition, the material properties weight the phonon distributions in the proper crystalline direction. Greater resolution of phonon behavior in proximity to an interface, and more accurate predictions of TIR are obtained. While it is true the assumption of diffuse mismatch can yield inconsistent results compared to experiment especially at low temperatures, this work focuses on room temperature and beyond effects, for future applications in nuclear fuel, or thermoelectric devices; a modified mismatch approach may be feasible if applied properly. Additionally, our methods focus on bridging mesoscale to engineering scale

36 MATERIALS SCIENCE↗

Forced Forward Smoldering Experiments Aboard The Space Shuttle

Smoldering is a basic combustion problem that presents a fire risk because it is initiated at low temperatures and because the reaction can propagate slowly in the material interior and go undetected for long periods of time. It yields a higher conversion of fuel to toxic compounds than does flaming, and may undergo a transition to flaming. To date there have been a few minor incidents of overheated and charred cables and electrical components reported on Space Shuttle flights. With the establishment of the International Space Station, and the planning of a potential manned mission to Mars, there has been an increased interest in the study of smoldering in microgravity. The Microgravity Smoldering Combustion (MSC) experiment is part of a study of the smolder characteristics of porous combustible materials in a spacecraft environment. The aim of the experiment is to provide a better fundamental understanding of the controlling mechanisms of smoldering combustion under normal- and microgravity conditions. This in turn will aid in the prevention and control of smolder originated fires, both on earth and in spacecrafts. The microgravity smoldering experiments have to be conducted in a space-based facility because smoldering is a very slow process and consequently its study in a microgravity environment requires extended periods of time. The microgravity experiments reported here were conducted aboard the Space Shuttle. The most recent tests were conducted during the STS-105 and STS-108 missions. The results of the forward smolder experiments from these flights are reported here. In forward smolder, the reaction front propagates in the same direction as the oxidizer flow. The heat released by the heterogeneous oxidation reaction is transferred ahead of the reaction heating the unreacted fuel. The resulting increase of the virgin fuel temperature leads to the onset of the smolder reaction, and propagates through the fuel. The MSC data are compared with normal gravity data to determine the effect of gravity on smolder.

Fernandez-Pello, A. C.↗

Uptake of Small Organic Compounds by Sulfuric Acid Aerosols: Dissolution and Reaction

To assess the role of oxygenated volatile organic compounds in the upper troposphere and lower stratosphere, the interactions of a series of small organic compounds with low-temperature aqueous sulfuric acid will be evaluated. The total amount of organic material which may be taken up from the gas phase by dissolution, surface layer formation, and reaction during the particle lifetime will be quantified. Our current results for acetaldehyde uptake on 40 - 80 wt% sulfuric acid solutions will be compared to those of methanol, formaldehyde, and acetone to investigate the relationships between chemical functionality and heterogeneous activity. Where possible, equilibrium uptake will be ascribed to component pathways (hydration, protonation, etc.) to facilitate evaluation of other species not yet studied in low temperature aqueous sulfuric acid.

Iraci, L. T.↗

Heterogeneous Reactions of HNO3(g) + NaCl(s) Yields HCL(g) + NaNO3(s) and N2O5(g) + NaCl(s) Yields ClNo2(g) + NaNO3(s)

The heterogeneous reactions of HNO3(g) + NaCl(s) Yields HCL(g) + NaNO3(s) and N2O5(g) + NaCl(s) Yields ClNo2(g) + NaNO3(s)were investigated over a temperature range of 223-296 K in a flow-tube reactor coupled to a quadrupole mass spectrometer. The implications for volcanic enhancement of the HCl and HNO3 column density in the lower stratosphere are discussed.

heterogeneous↗

The importance of mesoscale circulations generated by subgrid-scale landscape heterogeneities in general circulation models

A mesoscale atmospheric model was used to evaluate the impact of subgrid-scale landscape discontinuities on the vertical profiles of resolved temperature, moisture, and moist static energy in the planetary boundary layer (PBL) of general circulation models (GCMs). These profiles were produced with a 3D version of the model (using a horizontal grid resolution of 7.5 km and 13 vertical layers in the PBL) by averaging horizontally the various atmospheric variables over a 180 x 180 sq km domain-about the size of the horizontal domain represented by a single grid element in a GCM. They were compared to corresponding vertical profiles produced with a 1D version of the model, which simulates the PBL, as in a GCM, over a single horizontal grid element. Differences obtained between the horizontally averaged atmospheric variables produced with the 3D simulations and the 1D simulations emphasize the impact of subgrid-scale landscape discontinuities on GCM-resolved variables. Various types of landscape discontinuities, characterized by horizontal contrasts of surface wetness and size of land patches, were simulated under various background-wind conditions. Differences of temperature, specific humidity, and moist static energy as large as 4 K, 6 g/kg, and 10 kJ/kg were obtained in some cases. These differences were not affected significantly by moderate winds but were sensitive to the spatial distribution of surface wetness. These results emphasize the need to parameterize mesoscale processes induced by landscape discontinuities in GCMss.

Lynn, Barry H.↗

Irradiation stability and thermomechanical properties of 3D-printed SiC

Neutron irradiation tests were carried out on 3D-printed SiC derived from binderjet additive manufacturing and chemical vapor infiltration. Irradiation was carried to 2.3 dpa over a temperature range of 400–850 °C. Anisotropy that had been observed in the thermal conductivity of 3D-printed SiC prior to irradiation vanished after irradiation as the irradiation defect thermal resistivity accumulated in the material. No degradation in strength was observed in the material before or after irradiation, at various temperatures, or in different orientations. Electron microscopy of the microstructure after neutron irradiation showed distinct defect morphologies in the heterogenous material, but no evidence for irradiation-induced cracking or degradation in the microstructure was observed.

36 MATERIALS SCIENCE↗

Tendencies of Soil Microbial NO Emissions During HI‐SCALE as Predicted by a Nitrification/Denitrification Scheme

Many atmospheric chemical processes, including the formation of secondary organic aerosol (SOA), are strongly modulated by the reactions of NO and NO 2 (NO x ). Though NO x is controlled by anthropogenic emissions near urban areas, in rural areas soil microbes can be a significant contribution to NO emission globally. The relative rates of emissions of different nitrogen-containing species (e.g., NO, N 2 O, HONO, and N 2 ) are strong functions of soil properties such as temperature, moisture content, pH, and soil carbon and nitrogen pools. However, typical large-scale biogeochemical models either express these emissions simplistically, or not at all. Here we investigate the potential impact of soil NO emissions on atmospheric chemistry and SOA formation over regional and monthly time scales, specifically the 2016 spring and summer Intensive Observational Periods (IOPs) of the Holistic Interactions of Shallow Clouds, Aerosols and Land Ecosystems (HI-SCALE) field campaign. We implement the soil NO nitrification/denitrification parameterization of Rasool et al. (2019) into the Weather Research and Forecasting model coupled with Chemistry (WRF-Chem), supplemented by a 1-km soil moisture analysis. We then simulate both IOPs over the U.S. Great Plains, evaluating against ground stations and flight data. We show that soil NO emissions can account for a large fraction of total NO x and locally increase O 3 concentrations by up to 25%, while alleviating negative biases of gases and aerosols toward observations. Soil moisture and temperature changes between IOP1 and IOP2 lead to overall differences in emissions, but with large regional variability due to heterogeneous surface characteristics.

Atmoshpheric Chemistry↗

Correlation between the temperature evolution of the interfacial region and the growing dynamic cooperativity length scale

Here, we study experimentally the temperature evolution of the thickness of the interfacial layer, L int (T), between bulk matrices and the surface of nanoparticles in nanocomposites through broadband dielectric spectroscopy. Analyses revealed a power-law dependence between the logarithm of structural relaxation time in the interfacial layer, τ int (T), and the L int (T): ln τ i n t ( T ) / τ 0 ∝ L i n t β ( T ) / T , with τ 0 ~ 10 –12 s, and β index ~0.67 at high temperatures and ~1.7 at temperatures close to the glass transition temperature. In addition, our analysis revealed that the L int (T) is comparable to the length scale of dynamic heterogeneity estimated from previous nonlinear dielectric measurements and the four-point NMR [ξ NMR (T)], with L int (T) ~ ξ NMR (T). These observations may suggest a direct correlation between the L int (T) and the size of the cooperatively rearranging regions and have strong implications for understanding the dynamic heterogeneity and cooperativity in supercool liquids and their role in interfacial dynamics.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Nonmonotonic effect of chemical heterogeneity on interfacial crack growth at high-angle grain boundaries in Fe-Ni-Cr alloys

Here, an intermittent pattern is observed in the modeling of interfacial cyclic-loading crack growth at high-angle grain boundaries in ternary Fe-Ni-Cr alloys. Different from conventional wisdom of stress-intensity factor, the abrupt crack advances are found driven by extreme value statistics—namely, the aggregation of atoms with most compressive residual stresses. In addition, inherently non-affine atomic stress fluctuations are discovered, and the fluctuations peak at intermediate level of chemical heterogeneity, causing the fastest crack growth. Implications of such nonmonotonic mechanism in regard to the origin of intermediate-temperature embrittlement phenomena are also discussed.

36 MATERIALS SCIENCE↗

Optimizing DOE Opportunities to Research Land–Atmosphere Interactions in the U.S. Southeast (Workshop Report)

The southeastern United States (Southeast), with its complex and varied environments, is an area of tremendous economic, ecological, and societal importance to the country. The region is characterized by heterogeneous landscapes (i.e., geology and soil type) and a long history of human land use coupled with a warm temperature regime and high precipitation. As a result, soil erosion and deposition are pronounced, vegetation recovery is rapid, and human modification is extensive across the region. To better understand land–atmosphere interactions in this important and complex region, research communities supported by the U.S. Department of Energy’s Biological and Environmental Research (BER) program identified the Southeast as a priority region of interest. In fall 2024, the third Atmospheric Radiation Measurement Mobile Facility (AMF3), one of three mobile monitoring facilities designed to collect atmospheric and climate data from undersampled regions around the world, will begin operations in northwestern Alabama’s Bankhead National Forest (BNF). The AMF3-BNF 5-year deployment, from 2024–2029, will monitor the effects of feedbacks among aerosols, clouds, and precipitation on plant physiology and canopy-scale fluxes. It will also focus on scale aggregation to resolve the role of local forcing on larger-scale processes. To enable broader AMF3 involvement by the science community, the BER Environmental System Science (ESS) program organized the Southeast Land– Atmosphere Research Opportunities (SELARO) workshop in August 2023. The purpose was to identify gaps in scientific understanding of terrestrial processes in the Southeast (defined as states bounded by the Gulf of Mexico to the south, the Atlantic Ocean to east, the Mississippi River to the west, and extending through Tennessee and North Carolina to the north) and explore opportunities to use the AMF3-BNF deployment to coordinate and leverage research efforts across the region. Many parts of the Southeast have experienced repeated anthropogenic forcings. Farming, hunting, burning, and settlement of the region by Indigenous Peoples first shaped the distribution of plant communities, which in turn influenced European colonization patterns. Timber harvesting was common during the expansion of European settlements, and production forestry continues today. Agricultural production was extensive and then waned through the 20th century, creating a period of afforestation following agricultural abandonment. Today, many formerly agricultural landscapes are undergoing rapid urbanization and suburbanization. Overlying these patterns of anthropogenic land use are frequent disturbances from hurricanes, tornadoes, wildfires, drought, flooding, ice storms, and the occasional blizzard. An additional characteristic of the Southeast is its overall landscape complexity. Unlike the western United States, where broad expanses may share similar characteristics, Southeast topography, drainage patterns, vegetation, and development patterns vary widely across relatively small spatial scales (<1 km). This is due to the region’s underlying geology and soil development, species biodiversity patterns, and land ownership and use coupled with strong forces of erosion, weathering, and rapid plant growth in the warm, wet climate.

54 ENVIRONMENTAL SCIENCES↗

Condensation and its growth down the test-section of the Langley 0.3-m transonic cryogenic tunnel

Four total pressure probes were used to measure the growth of condensation down the test section of the Langley 0.3-m tunnel, and the condensation data were employed to verify a mathematical model which assumes condensation results from heterogeneous nucleation on preexisting seed particles. The onset of effects occurs throughout the test section at the same total temperature but the magnitude of the effects increases with increasing length down the test section. Condensation is important because it determines the minimum operating temperature of transonic cryogenic wind tunnels.

Hall, R. M.↗

Reluctant glass formers and their applications in optical lens design

Over ten years ago, it was shown that glasses with high index of refraction and some with low dispersion could be produced from a number of pure refractory oxides, including the lanthanides, by containerless processing. By containerless processing it is possible to minimize surface heterogeneous nucleation and produce larger glass samples of the materials than by other methods. The use of proposed high temperature containerless processing facilities in space permits the fabrication of benchmark samples of new unique glass compositions for optical property determination as well as for glass formation. It was shown that glasses with high refractive indices and large Abbe numbers can be formulated using this technology. These glasses lie in the classical forbidden region of the glass map. Preliminary study of the impact of having such unusual glasses available for the lens designer was made. Results indicate that significant improvements can be realized over the use of only conventional glasses. A cursory survey of a number of nationally recognized lens designers indicated a general agreement that such glasses would be highly desired and could be expected to lead to completely new designs as well as simplifying existing designs.

Ethridge, Edwin C.↗

A Review of Spatial and Seasonal Changes in Condensation Clouds Observed During Aerobraking by MGS TES

Successful operation of the Mars Global Surveyor spacecraft beginning in September 1997, has permitted extensive infrared observations of condensation clouds during the martian southern summer and fall seasons (184 deg<L(sub s)<28 deg). Initially, thin (normal optical depth<0.06 at 825/cm) ice clouds and hazes were widespread, showing a latitudinal gradient. With the onset of a regional dust storm at L(sub s) = 224 deg, ice clouds essentially vanished in the southern hemisphere, to reappear gradually after the decay of the storm. The thickest clouds (optical depth approximately 0.6) were associated with major volcanic features. At L(sub s) =318 deg, the cloud at Ascraeus Mons was observed to disappear between 21:30 and 09:30, consistent with historically recorded diurnal behavior for clouds of this type. Limb observations showed extended optically thin (depth<0.04) stratiform clouds at altitudes up to 55 km. A water ice haze was present in the north polar night at altitudes up to 40 km; this probably provided heterogeneous nucleation sites for the formation of CO2 clouds at altitudes below the 1 mbar pressure level, where atmospheric temperatures dropped to the condensation point Of CO2.

Pearl, J. C.↗

A Review of Spatial and Seasonal Changes in Condensation Clouds Observed During Aerobraking by MGS TES

Successful operation of the Mars Global Surveyor spacecraft, beginning in September 1997, has permitted extensive infrared observations of condensation clouds during the martian southern summer and fall seasons (184 deg less than L(sub s) less than 28 deg). Initially, thin (normal optical depth less than 0.06 at 825/ cm) ice clouds and hazes were widespread, showing a latitudinal gradient. With the onset of a regional dust storm at L(sub s) = 224 deg, ice clouds essentially vanished in the southern hemisphere, to reappear gradually after the decay of the storm. The thickest clouds (optical depth approx. 0.6) were associated with major volcanic features. At L(exp s) = 318 deg, the cloud at Ascraeus Mons was observed to disappear between 21:30 and 09:30, consistent with historically recorded diurnal behavior for clouds of this type. Limb observations showed extended optically thin (depth less than 0.04) stratiform clouds at altitudes up to 55 km. A water ice haze was present in the north polar night at altitudes up to 40 km; this probably provided heterogeneous nucleation sites for the formation of CO2 clouds at altitudes below the 1 mbar pressure level, where atmospheric temperatures dropped to the condensation point of CO2.

Pearl, J. C.↗

Microphysical Modelling of Polar Stratospheric Clouds During the 1999-2000 Winter

The evolution of the 1999-2000 Arctic winter has been examined using a microphysical/photochemical model run along diabatic trajectories. A large number of trajectories have been generated, filling the vortex throughout the region of polar stratospheric cloud (PSC) formation, and extending from November until the vortex breakup, in order to provide representative sampling of the evolution of PSCs and their effect on stratospheric chemistry. The 1999-2000 winter was particularly cold, allowing extensive PSC formation. Many trajectories have ten-day periods continuously below the Type I PSC threshold; significant periods of Type II PSCs are also indicated. The model has been used to test the extent and severity of denitrification and dehydration predicted using a range of different microphysical schemes. Scenarios in which freezing only occurs below the ice frost point (causing explicit coupling of denitrification and dehydration) have been tested, as well as scenarios with partial freezing at warmer temperatures (in which denitrification can occur independently of dehydration). The sensitivity to parameters such as aerosol freezing rates and heterogeneous freezing have been explored. Several scenarios cause sufficient denitrification to affect chlorine partitioning, and in turn, model-predicted ozone depletion, demonstrating that an improved understanding of the microphysics responsible for denitrification is necessary for understanding ozone loss rates.

Drdla, Katja↗

Laboratory Studies of Homogeneous and Heterogeneous Chemical Processes of Importance in the Upper Atmosphere

The objective of this study is to conduct measurements of chemical kinetics parameters for reactions of importance in the stratosphere and upper troposphere, and to study the interaction of trace gases such as HCl with ice surfaces in order to elucidate the mechanism of heterogeneous chlorine activation processes, using both a theoretical and an experimental approach. The measurements will be carried out under temperature and pressure conditions covering those applicable to the stratosphere and upper troposphere. The techniques to be employed include turbulent flow - chemical ionization mass spectrometry, and optical ellipsometry. The next section summarizes our research activities during the second year of the project, and the section that follows consists of the statement of work for the third year.

Molina, Mario J.↗