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At least 433 records · Page 24

Use of a Small Unmanned Aircraft System for Autonomous Fire Spotting at the Great Dismal Swamp

This paper describes the results of a set of experiments and analyses conducted to evaluate the capability of small unmanned aircraft systems (sUAS) to spot nascent fires in the Great Dismal Swamp (GDS) National Wildlife Refuge. This work is the result of a partnership between the National Aeronautics and Space Administration and the US Fish and Wildlife service specifically to investigate sUAS usage for fire-spotting. The objectives of the current effort were to: 1) Determine suitability and utility of low-cost Small Unmanned Aircraft Systems (sUAS) to detect nascent fires at GDS; 2) Identify and assess the necessary National Airspace System (NAS) integration issues; and 3) Provide information to GDS and the community on system requirements and concepts-of-operation (CONOPS) for conducting fire detection/support mission in the National Airspace and (4) Identify potential applications of intelligent autonomy that would enable or benefit this high-value mission. In addition, data on the ability of various low-cost sensors to detect smoke plumes and fire hot spots was generated during the experiments as well as identifying a path towards a future practical mission utility by using sUAS in beyond visual-line-of-sight operation in the National Airspace System (NAS).

Logan, Michael J.↗

Temperature-based reactive flow model for triaminotrinitrobenzene (TATB) plastic bonded explosives

A new reactive flow model is presented for triaminotrinitrobenzene (TATB)-based plastic bonded explosives, applicable to shock initiation and steady detonation problems of differing initial temperature. Temperature disequilibrium is assumed between unreacted explosive, material in the vicinity of compressed defects (called hot spots), and reaction products. The model incorporates temperature-dependent decomposition reaction rates. Particularly, Arrhenius model parameters were derived from quantum-based molecular dynamics simulations of TATB decomposition. Further, a model of detonation carbon aggregation is incorporated, describing the slow release of energy inherent to detonation in TATB-based materials. Model parameters were calibrated against gas gun shock initiation experiments and steady detonation rate stick tests. The predictive ability of the model in the shock initiation regime is tested against recent thin pulse experiments. The model is found to perform equally well in predicting the size-effect curve of ambient, cold, and hot rate sticks. The present work demonstrates the viability of incorporating results from subscale simulations into a continuum-scale reactive flow model.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Numerical Study of Combustor-Turbine Interactions Considering a Two-Stage High-Pressure Turbine

In this study, preliminary results are presented from the Open National Combustion Code (OpenNCC) applied to the two-stage high-pressure turbine (HTP) from the energy efficient engine (E3) program. Although the combustor is designed for efficient fuel–air mixing and a relatively uniform exit temperature profile, temporal and spatial variation in combustor exit conditions inevitably lead to hot-streaks in the HPT. These hot streaks can cause local hot spots on the HPT blade surfaces that reduce blade life. To improve understanding of these effects and the overall design of combustor and HPT, we are developing a fully-coupled combustor-turbine computational fluid dynamics (CFD) capability. Previous work has simulated the E3 combustor at the simulated Sea-Level Take-off (SLTO) condition (P41 = 2.4 [atm]) with and without the first-stage HPT stator included. This work addresses HPT simulations using inflow conditions based on previous simulation results of the E3 combustor, as well as investigating the effects of spatial and temporal temperature non-uniformity of the combustor-exit flow on the HPT performance for a more realistic SLTO (P41 = 27.4 [atm])). First, we analyze existing results from the combustor and the HPT 1st-stage stator simulation, where the unsteady hot gas coming out of the combustor exit travels between the stationary stators and then directly exits the computational domain (i.e., no effect from the rotors). Second, we simulate the HPT including the 1st and 2nd stage stators and rotors with the time-averaged, spatially-nonuniform inflow to the HPT taken from the combustor (with HPT 1st-stage stators) solution. Differences in simulations results for the flow field in the 1st-stage stator region are presented. The results of these two simulations (combustor and HPT simulated in a sequential manner) will be compared to a fully-coupled EEE combustor/HPT simulation to understand the impacts of fully-coupled simulations on combustor and HPT performance for two different operating conditions.

LES↗

Numerical Study of Combustor-Turbine Interactions Considering a Two-Stage High-Pressure Turbine

In this study, preliminary results are presented from the Open National Combustion Code (OpenNCC) applied to the two-stage high-pressure turbine (HTP) from the energy efficient engine (E3) program. Although the combustor is designed for efficient fuel–air mixing and a relatively uniform exit temperature profile, temporal and spatial variation in combustor exit conditions inevitably lead to hot-streaks in the HPT. These hot streaks can cause local hot spots on the HPT blade surfaces that reduce blade life. To improve understanding of these effects and the overall design of combustor and HPT, we are developing a fully-coupled combustor-turbine computational fluid dynamics (CFD) capability. Previous work has simulated the E^3 combustor at the simulated Sea-Level Take-off (SLTO) condition (P(41) = 2.4 [atm]) with and without the first-stage HPT stator included. This work addresses HPT simulations using inflow conditions based on previous simulation results of the E^3 combustor, as well as investigating the effects of spatial and temporal temperature non-uniformity of the combustor-exit flow on the HPT performance for a more realistic SLTO (P(41) = 27.4 [atm])). First, we analyze existing results from the combustor and the HPT 1st-stage stator simulation, where the unsteady hot gas coming out of the combustor exit travels between the stationary stators and then directly exits the computational domain (i.e., no effect from the rotors). Second, we simulate the HPT including the 1st and 2nd stage stators and rotors with the time-averaged, spatially-nonuniform inflow to the HPT taken from the combustor (with HPT 1st-stage stators) solution. Differences in simulations results for the flow field in the 1st-stage stator region are presented. The results of these two simulations (combustor and HPT simulated in a sequential manner) will be compared to a fully-coupled EEE combustor/HPT simulation to understand the impacts of fully-coupled simulations on combustor and HPT performance for two different operating conditions.

LES↗

Corals from Space

The goal of this research is to monitor the health and vigor of coral reef ecosystems, and their sensitivity to natural and anthropogenic climate changes. To achieve these lofty goals, this research is investigating the feasibility of using spaceborne high-resolution spectrometers (on the US Landsat, French Systeme Probatoire pour l'Observation de la Terre [SPOT] and/or the Indian Resources Satellite [IRS 1C & 1D] spacecraft) to first map the aerial extent of coral reef systems, and second separate the amount of particular corals. If this is successful, we could potentially provide a quantum leap in our understanding of coral reef systems, as well as provide much needed baseline data to measure future changes in global coral reef ecosystems. In collaboration with Tomas Tomascik, Yann Morel, and other colleagues, a series of experiments were planned to coordinate in situ coral observations, high-resolution spaceborne imagery (from Landsat, SPOT, and, possibly, IRS IC spacecraft), and NASA Space Shuttle photographs and digital images. Our eventual goal is to develop "coral health algorithms" that can be used to assess time series of imagery collected from satellite sensors (Landsat since 1972, SPOT since 1986) in concert with in situ observations. The bad news from last year was that from 1997 to mid- 1998, the extreme cloudiness over southeast Asia due to prolonged smoke from El Nino-related fires and the economic chaos in this region frustrated both our space and reef-based data collection activities. When this volatile situation stabilizes, we will restart these activities. The good news was that in collaboration with Al Strong at the National Oceanic and Atmospheric Administration (NOAA) we had an exciting year operationally using the NOAA's Advanced Very High Resolution Radiometer sensor derived sea surface temperature products to warn of coral "bleaching" at many locations throughout the tropics. Data from NOAA's satellites showed that during the El Nino of 1997 and the first half of 1998, more ocean area in the tropics experienced exceptionally high sea surface temperatures, or "hot spots," than have been observed in any fall year since the El Nino of 1982. From January to July, the coral bleaching events were concentrated in the Southern Hemisphere (during its warm season). Since July 1998, the reports of extensive coral bleaching have again spread into regions of the Northern Hemisphere following abnormally high sea surface temperatures, especially around the Philippines and throughout the Caribbean Basin, Bahamas, Bermuda and Florida Keys. These El Nino induced events clearly demonstrated that corals are the "canaries of the marine ecosystem," highly sensitive to short-term natural climate events (El Nino), and should be monitored as measures of longer-term environmental and climate change. Additional information is contained in the original.

Patzert, William C.↗

Computational Study of Modeling Fully-Coupled Combustor-Turbine Interactions by the Open National Combustion Code (OpenNCC)

In this study, preliminary results are presented from the Open National Combustion Code (OpenNCC) applied to the two-stage high-pressure turbine (HTP) from the energy efficient engine (E3) program. Although the combustor is designed for efficient fuel–air mixing and a relatively uniform exit temperature profile, temporal and spatial variation in combustor exit conditions inevitably lead to hot-streaks in the HPT. These hot streaks can cause local hot spots on the HPT blade surfaces that reduce blade life. To improve understanding of these effects and the overall design of combustor and HPT, we proposed a sequential approach: Step 1 (combustor _ 1st stage stator), Step 2 (HPT) and Step 3 (fully-coupled EEE combustor/HPT). In this presentation, we would like to discuss the recent numerical results at two different operating conditions: the simulated Sea-Level Take-off (SLTO) condition (P41 = 2.4 [atm]) and a more realistic SLTO (P41 = 27.4 [atm])).

LES↗

Design-controlled synthesis of IrO 2 sub-monolayers on Au nanoflowers: marrying plasmonic and electrocatalytic properties

We develop herein plasmonic–catalytic Au–IrO 2 nanostructures with a morphology optimized for efficient light harvesting and catalytic surface area; the nanoparticles have a nanoflower morphology, with closely spaced Au branches all partially covered by an ultrathin (1 nm) IrO 2 shell. This nanoparticle architecture optimizes optical features due to the interactions of closely spaced plasmonic branches forming electromagnetic hot spots, and the ultra-thin IrO 2 layer maximizes efficient use of this expensive catalyst. This concept was evaluated towards the enhancement of the electrocatalytic performances towards the oxygen evolution reaction (OER) as a model transformation. The OER can play a central role in meeting future energy demands but the performance of conventional electrocatalysts in this reaction is limited by the sluggish OER kinetics. We demonstrate an improvement of the OER performance for one of the most active OER catalysts, IrO 2 , by harvesting plasmonic effects from visible light illumination in multimetallic nanoparticles. We find that the OER activity for the Au–IrO 2 nanoflowers can be improved under LSPR excitation, matching best properties reported in the literature. Our simulations and electrocatalytic data demonstrate that the enhancement in OER activities can be attributed to an electronic interaction between Au and IrO 2 and to the activation of Ir–O bonds by LSPR excited hot holes, leading to a change in the reaction mechanism (rate-determinant step) under visible light illumination.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The UK Met Office GCM with a Sophisticated Radiation Scheme Applied to the Hot Jupiter HD 209458b

To study the complexity of hot Jupiter atmospheres revealed by observations of increasing quality, we have adapted the UK Met Office Global Circulation Model (GCM), the Unified Model (UM), to these exoplanets. The UM solves the full 3D Navier-Stokes equations with a height-varying gravity, avoiding the simplifications used in most GCMs currently applied to exoplanets. In this work we present the coupling of the UM dynamical core to an accurate radiation scheme based on the two-stream approximation and correlated-k method with state-of-the-art opacities from ExoMol. Our first application of this model is devoted to the extensively studied hot Jupiter HD 209458b. We derive synthetic emission spectra and phase curves, and compare them to both previous models also based on state-of-the-art radiative transfer, and to observations. We find a reasonable a agreement between observations and both our days side emission and hot spot offset, however, our night side emissions is too large. Overall our results are qualitatively similar to those found by Showman et al. (2009) with the SPARCMIT gcm, however, we note several quantitative differences: Our simulations show significant variation in the position of the hottest part of the atmosphere with pressure, as expected from simple timescale arguments, and in contrast to the vertical coherency found by Showman et al. (2009). We also see significant quantitative differences in calculated synthetic observations. Our comparisons strengthen the need for detailed intercomparisons of dynamical cores, radiation schemes and post-processing tools to understand these differences. This effort is necessary in order to make robust conclusions about these atmospheres based on GCM results.

radiation↗

Anisotropic Thermally Conductive Composites Enabled by Acoustophoresis and Stereolithography

Opportunities to improve thermal management in electronic devices are currently hindered by processing constraints that limit thermal conductivity in polymer-matrix composites. Active patterning of filler particles is a promising route to improve conductivity while retaining processability by improving particle contact density and directing heat along optimized pathways. Here, we employ acoustic patterning to align and compact filler particles into stripes during stereolithographic 3D printing. This approach produces polymer-based composite materials with highly efficient embedded heat transport pathways which reach 95 vol% particle utilization (relative to the parallel conduction upper limit). These composites exhibit anisotropic thermal conductivity up to 300% higher than unpatterned composites, with in-plane anisotropy ratios of up to 350%. Combining this high conductivity with 3D printing enables materials with engineered heat networks that optimize transport from hot spots to heatsinks while maintaining low viscosity for fast particle patterning and for infiltration around electronic components. Finally, numerical simulations of acoustic assembly of particles with varied geometry, when compared to experimentally characterized particle packing, illuminate pathways for further improving conductivity by optimizing particle geometry for alignment and stacking of particles with maximum contact surface area.

36 MATERIALS SCIENCE↗

Cold-Starting All-Solid-State Batteries from Room Temperature by Thermally Modulated Current Collector in Sub-Minute

All-solid-state batteries (ASSBs) show great potential as high-energy and high-power energy storage devices but their attainable energy/power density at room temperature is severely reduced because of the sluggish kinetics of lithium-ion transport. Here we first reported a thermally modulated current collector (TMCC), which can rapidly cold-start ASSBs from room temperature to operating temperatures (70–90 °C) in less than one minute, and simultaneously enhance the transient peak power density by 15-fold compared to one without heating. This TMCC is prepared by integrating a uniform, ultrathin (~200 nm) nickel layer as a thermal modulator within an ultralight polymer-based current collector. By isolating the thermal modulator from the ion/electron pathway of ASSBs, it can provide fast, stable heat control yet does not interfere with regular battery operation. Moreover, this ultrathin (13.2 μm) TMCC effectively shortens the heat transfer pathway, minimizes heat losses, and mitigates the formation of local hot spots. The simulated heating energy consumption can be as low as ~3.94% of total battery energy. This TMCC design with good tunability opens new frontiers towards smart energy storage devices in the future from the current collector perspective.

25 ENERGY STORAGE↗

A Self-Healing, Flowable, Yet Solid Electrolyte Suppresses Li-Metal Morphological Instabilities

In this article, lithium metal (Li 0 ) solid-state batteries encounter implementation challenges due to dendrite formation, side reactions, and movement of the electrode–electrolyte interface in cycling. Notably, voids and cracks formed during battery fabrication/operation are hot spots for failure. Here, a self-healing, flowable yet solid electrolyte composed of mobile ceramic crystals embedded in a reconfigurable polymer network is reported. This electrolyte can auto-repair voids and cracks through a two-step self-healing process that occurs at a fast rate of 5.6 µm h -1 . A dynamical phase diagram is generated, showing the material can switch between liquid and solid forms in response to external strain rates. The flowability of the electrolyte allows it to accommodate the electrode volume change during Li 0 stripping. Simultaneously, the electrolyte maintains a solid form with high tensile strength (0.28 MPa), facilitating the regulation of mossy Li 0 deposition. The chemistries and kinetics are studied by operando synchrotron X-ray and in situ transmission electron microscopy (TEM). Solid-state NMR reveals a dual-phase ion conduction pathway and rapid Li + diffusion through the stable polymer-ceramic interphase. This designed electrolyte exhibits extended cycling life in Li 0 –Li 0 cells, reaching 12 000 h at 0.2 mA cm -2 and 5000 h at 0.5 mA cm -2 . Furthermore, owing to its high critical current density of 9 mA cm -2 , the Li 0 –LiNi 0.8 Mn 0.1 Co 0.1 O 2 (NMC811) full cell demonstrates stable cycling at 5 mA cm -2 for 1100 cycles, retaining 88% of its capacity, even under near-zero stack pressure conditions.

25 ENERGY STORAGE↗

Phase change material integrated core–shell catalyst for in situ thermal control in methanol synthesis from syngas

A model-guided core–shell catalyst design is presented for methanol synthesis, featuring a phase change material (PCM) core encapsulated by a Cu–Zn–Al 2 O 3 (CZA) catalytic shell. The PCM enables in situ thermal management by absorbing reaction heat at its melting point, mitigates the kinetic decline at high temperatures and therefore avoids low conversion, prevents hot spots, and stabilizes the reaction temperature. A two-dimensional axisymmetric, non-isothermal packed-bed reactor model (COMSOL 6.3) was developed for a 10 g system. Simulations evaluate three PCM candidates, that is, LiNO 3 , 9 wt% LiCl + 91 wt% LiNO 3 , and commercial H250, with melting points near 244–250°C. Results indicate that CO conversion can increase from 34.4% to 52.4%, and methanol production can improve by 69% compared to a conventional packed-bed reactor. Beyond methanol synthesis, the PCM-integrated core–shell concept provides a scalable approach for thermal control in exothermic reactions, improving reactor efficiency and safety.

core–shell catalyst↗

Palladium/Ferrierite versus Palladium/SSZ‐13 Passive NOx Adsorbers: Adsorbate‐Controlled Location of Atomically Dispersed Palladium(II) in Ferrierite Determines High Activity and Stability**

Abstract Pd‐loaded FER and SSZ‐13 zeolites as low‐temperature passive NOx adsorbers (PNA) are compared under practical conditions. Vehicle cold start exposes the material to CO under a range of concentrations, necessitating a systematic exploration of the effect of CO on the performance of isolated Pd ions in PNA. The NO release temperature of both adsorbers decreases gradually with an increase in CO concentration from a few hundred to a few thousand ppm. This beneficial effect results from local nano‐“hot spot” formation during CO oxidation. Dissimilar to Pd/SSZ‐13, increasing the CO concentration above ≈1000 ppm improves the NOx storage significantly for Pd/FER, which was attributed to the presence of Pd ions in FER sites that are shielded from NOx. CO mobilizes this Pd atom to the NOx accessible position where it becomes active for PNA. This behavior explains the very high resistance of Pd/FER to hydrothermal aging: Pd/FER materials survive hydrothermal aging at 800 °C in 10 % H 2 O vapor for 16 hours with no deterioration in NOx uptake/release behavior. Thus, by allocating Pd ions to the specific microporous pockets in FER, we have produced (hydro)thermally stable and active PNA materials.

Khivantsev, Konstantin↗

Palladium/Ferrierite versus Palladium/SSZ-13 Passive NOx Adsorbers: Adsorbate-Controlled Location of Atomically Dispersed Palladium(II) in Ferrierite Determines High Activity and Stability**

Pd-loaded FER and SSZ-13 zeolites as low-temperature passive NOx adsorbers (PNA) are compared under practical conditions. Vehicle cold start exposes the material to CO under a range of concentrations, necessitating a systematic exploration of the effect of CO on the performance of isolated Pd ions in PNA. The NO release temperature of both adsorbers decreases gradually with an increase in CO concentration from a few hundred to a few thousand ppm. This beneficial effect results from local nano-“hot spot” formation during CO oxidation. Dissimilar to Pd/SSZ-13, increasing the CO concentration above ˜1000 ppm improves the NOx storage significantly for Pd/FER, which was attributed to the presence of Pd ions in FER sites that are shielded from NOx. CO mobilizes this Pd atom to the NOx accessible position where it becomes active for PNA. This behavior explains the very high resistance of Pd/FER to hydrothermal aging: Pd/FER materials survive hydrothermal aging at 800°C in 10% H 2 O vapor for 16 hours with no deterioration in NOx uptake/release behavior. Therefore, by allocating Pd ions to the specific microporous pockets in FER, we have produced (hydro)thermally stable and active PNA materials.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The importance of explicitly representing the streambed in watershed models

Abstract The streambed is the critical interface between the aquatic and terrestrial systems and hosts important biogeochemical hot spots within river corridors. Although the streambed characteristics are significantly different from those of its surrounding soil, the streambed itself has not been explicitly represented in watershed models. Here, we explicitly incorporated a streambed layer into an integrated hydrologic model through model parameterization and discretization. We examined the hydrological effects of streambed characteristics, including hydraulic conductivity ( K ), layer thickness, and resolution, on the exchange fluxes across the streambed as well as the streamflow at the watershed outlet. The numerical experiments were performed in the American River Watershed, a headwater, mountainous watershed within the Yakima River Basin in central Washington. Despite having a negligible effect on the watershed streamflow, an explicit representation of the streambed with distinctive properties dramatically changed the magnitude and variability of the exchange flux. In general, a larger streambed K along with a thicker streambed layer induced larger exchange fluxes. The exchange flux was most sensitive to the streambed resolution. A finer streambed resolution increased exchange fluxes per unit area while reducing the overall exchange volumes across the entire streambed. The amount of baseflow decreased by 6% as the streambed resolution increased from 250 to 50 m. This finding is important because these hydrological changes may, in turn, affect the exchange of nutrients and contaminants between surface water and groundwater and the associated biogeochemical processes. Our work demonstrated the importance of representing streambeds in fully distributed, process‐based watershed models to better capture the exchange flow dynamics in river corridors.

54 ENVIRONMENTAL SCIENCES↗

Standards development for modules in high temperature micro-environments

Photovoltaic (PV) module qualification standards, IEC 61215 and IEC 61730, were designed to apply to “general open-air climates” and IEC 61730 specifically indicated applicability of ambient air temperature of 40°C. Additionally, these standards provided allowances for so-called “open rack mounted PV modules” without a clear definition of “open-rack.” These implied restrictions and allowances meant that hotter climates or thermally restrictive installation methods may not be covered by these often customer-mandated certification standards. This is particularly salient for the significant growth regions of the Middle East and India that would be expected to operate at significantly higher temperatures. The applicability of these documents raised issues over the definition of “open rack” and the fact that the geographic location is just as important as the mounting configuration in assessing the impact of the micro-environment of a PV module. This work summarizes the scientific background for IEC Technical Specification 63126:2020 ED1, titled “Guidelines for qualifying PV modules components and materials for operation at high temperatures.” This standard was recently published by the IEC and is the first step in a systematic effort to rework these standards to address the question of temperature more directly. Instead of specifying a mounting condition, we specify different suites of tests suitable for a system (PV module, mounting style, and location) defined by the 98th percentile cell temperature. With a defined temperature regime to work from, this allowed us to use existing literature research combined with additional modeling work to determine, which tests would need to be modified. This resulted in suggested changes to material thermal indices, thermal cycling temperatures, hot spot testing, ultraviolet testing, and bypass diode testing among other tests and characteristics described in this study.

14 SOLAR ENERGY↗

X-ray Phase Contrast Imaging of the Impact of Multiple HMX Particles in a Polymeric Matrix

The initiation of high explosives (HEs) under shock loading lacks a comprehensive understanding: particularly at the particle scale. One common explanation is the hot spot theory, which suggests that energy in the material resulting from the impact event is localized in a small area causing an increase in temperature that can lead to ignition. This study focuses on the response of HMX particles (a common HE) within a polymer matrix (Sylgard-184 (R)), a simplified example of a polymer-bound explosive (PBX). These PBXs consist of multiple HMX particles in a single polymer-bound sample. A light gas gun was used to load the samples at impact velocities above 400 m/s. The impact events were visualized using X-ray phase-contrast imaging (PCI) allowing real-time observation of the impact event. The experiment used two different types of samples (multi-particle and two crystals) and found evidence of cracking and debonding in both sample types. Additionally, it was found that the multiple particle samples showed similar evidence of damage at lower velocities than that of single particle samples. This is an expected result as the multiple particles add additional interfaces for stress concentration and frictional heating.

42 ENGINEERING↗

Predicted Melt Curve and Liquid Shear Viscosity of RDX up to 30 GPa

Recent grain-scale simulations of HMX and TATB have shown that predictions for hot spot formation in high explosives are particularly sensitive to accurate determinations of the pressure-dependent melt curve and the shear viscosity of the liquid phase. These physics terms are poorly constrained beyond ambient pressure for the explosive RDX. Here we adopt an all-atom modeling approach using molecular dynamics (MD) simulations to predict the melt curve of RDX near to detonation conditions (30 GPa) and determine the shear viscosity of the liquid as a function of temperature and pressure above the melt curve. Phase-coexistence simulations were used to determine the melt curve, which is predicted to vary by almost 1100 K as the pressure increases from 0 GPa to 30 GPa. Equilibrium MD simulations and the Green-Kubo formalism were used to obtain the pressure-temperature-dependent shear viscosity. The shear viscosity of RDX is predicted to be of similar magnitude to the viscosity of TATB at low GPa-range pressures, and to be roughly an order of magnitude lower than the viscosity of HMX. The temperature dependence of the shear viscosity is Arrhenius at a given pressure, and the exponential pre-factor and activation term exhibit a strong, yet complicated, pressure dependence. An empirical pressure-temperature dependent function for RDX shear viscosity is developed that simultaneously captures a wide range of MD predictions while taking an analytic form that extrapolates smoothly beyond the fitted regime. The relative strength of the pressure and temperature dependencies of these two physics terms is found to be of similar magnitude for RDX, HMX, and TATB, which motivates incorporating these results in future RDX grain-scale modeling.

36 MATERIALS SCIENCE↗