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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 55 records · Page 3

Probing phonon focusing, thermomechanical behavior, and moiré patterns in van der Waals architectures using surface acoustic waves

Surface acoustic waves (SAWs) propagate along solid-air, solid-liquid, and solid-solid interfaces. Their characteristics depend on the elastic properties of the solid. Combining transmission electron microscopy (TEM) experiments with molecular dynamics (MD) simulations, we probe atomic environments around intrinsic defects that generate SAWs in vertically stacked two-dimensional (2D) bilayers of MoS 2 . Our joint experimental-simulation study provides insights into SAW-induced structural and dynamical changes and thermomechanical responses of MoS 2 bilayers. Using MD simulations, we compute mechanical properties from the SAW velocity and thermal conductivity from thermal diffusion of SAWs. The results for Young’s modulus and thermal conductivity of an MoS 2 monolayer are in good agreement with experiments. The presence of defects, such as nanopores which generate SAWs, reduces the thermal conductivity of 2D-MoS 2 by an order of magnitude. We also observe dramatic changes in moiré patterns, phonon focusing, and cuspidal structures on 2D-MoS 2 layers.

36 MATERIALS SCIENCE↗

Assessment of exposure to air pollution in children: Determining whether wearing a personal monitor affects physical activity

Highlights: • Personal air pollution exposure should not interfere with usual patterns of behavior. • Overall, personal pollution samplers did not influence usual patterns of behavior in children. • Small decreases in activity while wearing the monitors were noted among the youngest participants. Personal air pollution monitoring in research studies should not interfere with usual patterns of behavior and bias results. In an urban pediatric cohort study we tested whether wearing an air monitor impacted activity time based on continuous watch-based accelerometry. The majority (71%) reported that activity while wearing the monitor mimicked normal activity. Correspondingly, variation in activity while wearing versus not wearing the monitor did not differ greatly from baseline variation in activity (P = 0.84).

54 ENVIRONMENTAL SCIENCES↗

Vortex jump behavior in coupled nanomagnetic heterostructures

The spin configuration and magnetic behavior in patterned nanostructures can be controlled by manipulating the interplay between the competing energy terms. This in turn requires fundamental knowledge of the magnetic interactions at the local nanometer scale. Here in this article, we report on the spin structure and magnetization behavior of patterned discs containing exchange coupled ferromagnetic layers with additional exchange bias to an antiferromagnetic layer. The magnetization reversal was explored by direct local visualization of the domain behavior using in-situ Lorentz transmission electron microscopy, from which quantitative magnetic induction maps were reconstructed. The roles of the main competing energy terms were elucidated and the reversal mechanism was identified as a coupled phenomenon of incoherent rotation in the exchange-biased layer and localized vortex nucleation and discontinuous propagation in the free layer, including an anomalous jump in the trajectory. The observations were supported by micromagnetic simulations and modeled phase shift simulations. In conclusion, the work presented here provides fundamental insights into opportunities for macroscopic control of the energy landscape of magnetic heterostructures for functional applications.

36 MATERIALS SCIENCE↗

Hardware-in-the-loop Laboratory Performance Verification of Flexible Building Equipment in a Typical Commercial Building

This project aims to develop high-resolution equipment performance and occupant data that quantifies demand flexibility in typical commercial buildings. The dataset documented in this report includes comprehensive time-series measurements from hardware-in-the-loop (HIL) experiments conducted across multiple testbeds designed to simulate realistic operational environments for HVAC systems. Specifically, it captures minute-by-minute high-resolution data on the performance of various typical HVAC systems, including a variable-air-volume (VAV) air handling unit (AHU) system with chillers and an ice tank in the Intelligent Building Agents Laboratory (IBAL) at the National Institute of Standards and Technology (NIST), a two-stage air-source heat pump (ASHP) at the NIST, and a water-source heat pump (WSHP) at Texas A&M University (TAMU). The data were generated under a range of controlled conditions reflecting different grid scenarios and climatic influences, as well as various control strategies, building types, occupancy patterns, and occupant behaviors. This dataset provides DE-EE0009153 Final Report 5 detailed insights into the demand flexibility of these systems, including their response to grid signals, occupant behaviors, energy consumption patterns, and operational efficiency under different conditions.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Geometric pre-patterning based tuning of the period doubling onset strain during thin film wrinkling

Wrinkling of supported thin films is an easy-to-implement and low-cost fabrication technique for generation of stretch-tunable periodic micro and nano-scale structures. However, the tunability of such structures is often limited by the emergence of an undesirable period doubled mode at high strains. Predictively tuning the onset strain for period doubling via existing techniques requires one to have extensive knowledge about the nonlinear pattern formation behavior. Herein, a geometric pre-patterning based technique is introduced to delay the onset of period doubling that can be implemented to predictively tune the onset strain even with limited system knowledge. The technique comprises pre-patterning the film/base bilayer with a sinusoidal pattern that has the same period as the natural wrinkle period of the system. The effectiveness of this technique has been verified via physical and computational experiments on the polydimethylsiloxane/glass bilayer system. It is observed that the period doubling onset strain can be increased from the typical value of 20% for flat films to greater than 30% with a modest pre-pattern aspect ratio (2∙amplitude/period) of 0.15. In addition, finite element simulations reveal that (i) the onset strain can be increased up to a limit by increasing the amplitude of the pre-patterns and (ii) the delaying effect can be captured entirely by the pre-pattern geometry. As a result, one can implement this technique even with limited system knowledge, such as material properties or film thickness, by simply replicating pre-existing wrinkled patterns to generate prepatterned bilayers. Thus, geometric pre-patterning is a practical scheme to suppress period doubling that can increase the operating range of stretch-tunable wrinkle-based devices by at least 50%.

36 MATERIALS SCIENCE↗

Pressure-induced structural transition in chalcopyrite ZnSiP 2

In this paper, the pressure-dependent phase behavior of semiconducting chalcopyrite ZnSiP 2 was studied up to 30 GPa using in situ X-ray diffraction and Raman spectroscopy in a diamond-anvil cell. A structural phase transition to the rock salt type structure was observed between 27 and 30 GPa, which is accompanied by soft phonon mode behavior and simultaneous loss of Raman signal and optical transmission through the sample. The high-pressure rock salt type phase possesses cationic disorder as evident from broad features in the X-ray diffraction patterns. The behavior of the low-frequency Raman modes during compression establishes a two-stage, order-disorder phase transition mechanism. Finally, the phase transition is partially reversible, and the parent chalcopyrite structure coexists with an amorphous phase upon slow decompression to ambient conditions.

58 GEOSCIENCES↗

Automated imaging of the annihilation of a transverse domain wall in patterned magnetic thin films

Imaging the magnetic domain wall behavior in patterned thin films under external stimuli can enable understanding the underlying energy landscape and the role of local microstructure and defects. We present an automated workflow for in situ Lorentz transmission electron microscopy to image magnetic domain walls at the nanometer length scale and at a time resolution in the sub-millisecond regime—the latter of which is limited by the speed of the available camera. Our workflow is modular and can be broadly applied to various types of in situ experiments, taking us a step closer to the future of autonomous imaging of nanomagnetic films with electron microscopy. Using our workflow, we show the transformation of a transverse domain wall with sub-millisecond time resolution under the application of an in situ transverse magnetic field, a study of whose dynamics are essential in the design of future domain wall mediated spintronic device applications.

Algebraic topology↗

Prediction of Individual Social-Demographic Role Based on Travel Behavior Variability Using Long-Term GPS Data

With the development of and advances in smartphones and global positioning system (GPS) devices, travelers’ long-term travel behaviors are not impossible to obtain. This study investigates the pattern of individual travel behavior and its correlation with social-demographic features. For different social-demographic groups (e.g., full-time employees and students), the individual travel behavior may have specific temporal-spatial-mobile constraints. The study first extracts the home-based tours, including Home-to-Home and Home-to-Non-Home, from long-term raw GPS data. The travel behavior pattern is then delineated by home-based tour features, such as departure time, destination location entropy, travel time, and driving time ratio. The travel behavior variability describes the variances of travelers’ activity behavior features for an extended period. After that, the variability pattern of an individual’s travel behavior is used for estimating the individual’s social-demographic information, such as social-demographic role, by a supervised learning approach, support vector machine. In this study, a long-term (18-month) recorded GPS data set from Puget Sound Regional Council is used. The experiment’s result is very promising. The sensitivity analysis shows that as the number of tours thresholds increases, the variability of most travel behavior features converges, while the prediction performance may not change for the fixed test data.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

OpenPATH - Leveraging Technology to Measure Travel Behavior

Shifting transportation to more sustainable modes is a key piece of the decarbonization puzzle. However, mobility behavior and travel patterns are difficult to influence because they are difficult to measure. OpenPATH provides a tool to capture longitudinal behaviors through a smartphone application. Agencies interested in gathering data about a population's travel behavior can set up a deployment of the app customized to the needs of their community. Partners can choose between simple mode and purpose labels or surveys for each trip to balance the level of user engagement with the associated burden. The labels, trip surveys, and an initial demographic survey can all be tailored to the specific context of the deployment. The OpenPATH tool is unique in its open-source nature, ability to gather detailed longitudinal travel data, and design allowing direct engagement with travelers. A valuable technological advancement, this tool enables partners to measure the way changes in the transportation landscape impact their community. The suite of tools includes both public and administrator dashboards. The public dashboard supports continuous data analysis through charts presenting trip information updated daily. The administrator dashboard displays geospatial data and supports data export. Example applications have included e-bike programs; gathering valuable metrics on increased access to opportunities and reduction in VMT, and studies aimed at understanding existing mobility behavior to see where advancements such as electric vehicles could fit into these habits. OpenPATH collects travel data in association with an initial demographic survey, enabling detailed insight into the behavior patterns or impact of a certain program on different populations.

ADVANCED PROPULSION SYSTEMS↗

A multi-level load shape clustering and disaggregation approach to characterize patterns of energy consumption behavior

This study presents representative electrical load shapes, disaggregated to the end-use level, for over 5000 customer clusters across California’s residential, commercial, industrial and agricultural sectors. We developed a novel, multi-level load shape clustering approach for residential and commercial sectors leveraging interval meter data for over 350,000 California utility customers collected as a part of the Phase 4 California Demand Response (DR) Potential Study. The clustering approach allowed us to identify typical consumption patterns and categorize customers based on their daily load shape displayed throughout the year. For example, we were able to identify customers with particular energy technologies such as electric vehicles and rooftop solar, as well as building occupancy types such as restaurants, grocery stores and even unoccupied buildings, based solely on whole-building interval data. We then combined the load shape-based clusters with other customer information including building type, climate, geographical area, total consumption and low-income status, to create a set of customer clusters based on both demographics and usage patterns. Total cluster electricity demand was then disaggregated into a wide variety of end-uses using weather normalization and other publicly available end-use load shape datasets. The resulting disaggregated cluster load shapes will be released in anonymized form as part of the Phase 4 DR Potential Study. They will have wide-ranging applications in energy research and policy analysis, including estimation of energy efficiency (EE) and DR potential on the end-use level, time-dependent valuation of EE savings, building stock modeling, and developing customer targeting strategies for EE and DR programs.

Murthy, Samanvitha↗

Heterogeneous nature of relaxation dynamics of room-temperature ionic liquids (EMIm) 2 [Co(NCS) 4 ] and (BMIm) 2 [Co(NCS) 4 ]

Dynamic crossover above T g has been recognized as a characteristic feature of molecular dynamics of liquids approaching glass transition. Experimentally, it is manifested as a change in Vogel Fulcher Tammann dependence or a breakdown of the Stokes Einstein and related relations. In this paper, we report the exception from this rather general pattern of behavior. By means of dielectric, ultrasonic, rheological, and calorimetric methods, dynamics of two good ionic conductors (BMIm) 2 [Co(NCS) 4 ] and (EMIm) 2 [Co(NCS) 4 ] of less common stoichiometry (2:1) was studied in a very broad temperature range. However, none of the mentioned dynamic changes was observed in the entire studied temperature range. On the contrary, the single VFT and the same fractional Walden coefficient were found for conductivity and viscosity changes over 12 decades. Furthermore, ultrasonic studies revealed that the data at temperatures which cover the normal liquid region cannot be fitted by a single exponential decay, and the Cole Cole function should be used instead.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Automating Network Node Behavior Characterization by Mining Communication Patterns

Enterprise networks of scale are complex, dynamic computing environments that respond to evolv- ing business objectives and requirements. Characteriz- ing system behaviors in these environments is essential for network management and cyber security operations. Characterization of system’s communication is typical and is supported using network flow information (NetFlow). Related work has characterized behavior using theoretical graph metrics; results are often difficult to interpret by enterprise staff. We propose a different approach, where flow information is mapped to sets of tags that contextualize the data in terms of network principals and enterprise concepts. Frequent patterns are then extracted and are expressed as behaviors. Behaviors can be com- pared, identifying systems expressing similar behaviors. We evaluate the approach using flow information collected by a third party.

cyber system modeling↗

A data analytical approach for assessing the efficacy of Operational Technology active defenses against insider threats

In recent years, the need for Operational Technology (OT) defenses has been recognized, serving as an additional line of defense when Information Technology (IT) defenses are bypassed. This is no longer considered an uncommon possibility when dealing with advanced persistent threat (APT) actors expected to be state-sponsored and receiving insider assistance. In these extreme adversarial situations, OT defenses aim to provide another layer of defense for the system, introduced directly at the physical process level, as described by the sensors data, the system model, and control actions. Just like IT defenses, two schools of thought, i.e., passive and active defenses, have emerged to address this challenge. In active defenses, representing the focus of this paper, known signatures, synthesized based on the system's unique characteristics, are inserted into the system. In contradistinction, passive methods rely solely on observing system behavior in search of patterns of normal behavior with deviations thereof representing abnormal behavior. In their most sophisticated implementations, both passive and active defenses rely on the use of data analytics to identify the patterns and synthesize the observed and/or inserted signatures. Past research has shown that passive defenses may be bypassed by APT actors relying on data analytics and their intimate knowledge of the system to evade detection by respecting the patterns identified by the defenders. Here this manuscript explores the use of active defenses under the assumption that the attacker has privileged access to the system, including access to the system's model and sensors data. Specifically, this manuscript assesses the ability of active defenses to remain invisible to the attackers, and discusses the associated challenges that must be addressed to ensure their resiliency against APT actors.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗

Effect of patterned inclusions on the fracture behavior of ceramic composites

Developments in additive manufacturing have enabled the reinforcement of ceramic composites across the scales. Understanding the fracture behavior of such composites is critical for structural design and engineering. However, systematic investigations on the relationship between the patterning characteristics and the effective fracture properties have been scarce. In this work, we propose a mixed-mode phase field model to investigate the effects of elastic modulus and pattern characteristics of circular inclusions on the fracture behavior of a ceramic composite beam. The modeling results have shown that the stiff and compliant inclusions can either repel or attract the crack. The extent of repelling and attraction can be controlled by altering the pattern characteristics. In addition, utilizing the relationship between the pattern characteristics and resulting fracture path, fracture growth can be controlled with appropriate inclusion properties. The targeted enhancement in fracture toughness can also be predicted using an effective fracture model linked with the underlying fracture path computed by the proposed mixed-mode phase field model.

36 MATERIALS SCIENCE↗

Study of possible chaotic, quasi-periodic and periodic structures in quantum dusty plasma

Existence of chaotic, quasi-periodic, and periodic structures of dust-ion acoustic waves is studied in quantum dusty plasmas through dynamical system approach. A system of coupled differential equations is derived from the fluid model and subsequently, variational matrix is obtained. The characteristic equation is obtained at the equilibrium point, and the behavior of nonlinear waves is studied numerically using Runge-Kutta method. The behavior of the dynamical system changes significantly when any of plasma parameters, such as the dust concentration parameter, temperature ratio, or the quantum diffraction parameter, is varied. The change of the characteristic of solution of the system is extensively studied. It is found that the system changes its behavior from chaotic pattern to limit cycle behavior.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Behavioral Segmentation and Clustering of Geospatial Trajectories

The rapid growth of global positioning system (GPS) devices has led to a corresponding increase in the size of GPS datasets. While these large GPS datasets contain a wealth of information about the behaviors of the moving objects in them, manual classification and anomaly detection are prohibitively time consuming. We utilize unsupervised machine learning techniques to first identify the behaviors for individual moving objects and then cluster those objects by their behavioral sequences. In this way, trajectories behaving unusually as well as common patterns of behavior are both detectable in large datasets without requiring an a priori definition of "unusual" or "common."

97 MATHEMATICS AND COMPUTING↗

Travel Patterns And Characteristics Of Transit Users In New York State

This research is a detailed examination of the travel behaviors and patterns of transit users within New York State (NYS), primarily based on travel data provided by the National Household Travel Survey (NHTS) in 2009 and the associated Add-on sample households purchased by the New York State Department of Transportation (NYSDOT). Other data sources analyzed in this study include: NYS General Transit Feed Specification (GTFS) to assist in analyzing spatial relationships for access to transit and the creation of Transit Shed geographic areas of 1, 2.5, and 5 miles from transit stop locations, LandScan population database to understand transit coverage, and Census Bureau s American Community Survey (ACS) data to examine general transit patterns and trends in NYS over time. The majority of analyses performed in this research aimed at identifying transit trip locations, understanding differences in transit usage by traveler demographics, as well as producing trip/mode-specific summary statistics including travel distance, trip duration, time of trip, and travel purpose of transit trips made by NYS residents, while also analyzing regional differences and unique travel characteristics and patterns. The analysis was divided into two aggregated geographic regions: New York Metropolitan Transportation Council (NYMTC) and NYS minus NYMTC (Rest of NYS). The inclusion of NYMTC in all analysis would likely produce misleading conclusions for other regions in NYS. TRANSIT COVERAGE The NYS transit network has significant coverage in terms of transit stop locations across the state s population. Out of the 19.3 million NYS population in 2011, about 15.3 million (or 79%) resided within the 1-mile transit shed. This NYS population transit coverage increased to 16.9 million (or 88%) when a 2.5-mile transit shed was considered; and raised to 17.7 million (or 92%) when the 5-mile transit shed was applied. KEY FINDINGS Based on 2009 NHTS data, about 40% of NYMTC households used transit as their means of transportation on any typical day; while only 4% of households located elsewhere in NYS did the same. Regardless of geographic regions, 45% of the transit users came from households with income under $40,000, while 20% of transit users were from the top income group of $100,000 plus households. Travel made by NYMTC transit users were nearly twice as likely to be for work trips as compared to their counterpart non-transit users. Transit users in NYS generally made more trips but with shorter distances; they also drove less, which resulted in fewer miles. Furthermore, NYS transit users spent more time on each trip than their counterpart non-transit users. Because of the intensity of transit network services within NYMTC, 88% of the households reside within the 1-mile transit shed. Outside the NYMTC, however, only 54% of the region s households are located within the same distance. Impact to vehicle ownership was clearly evidenced. Nearly all people from zero-vehicle households in NYMTC lived within a 1-mile radius of transit stops. Elsewhere in NYS, 74% of residents from zero-vehicle households resided within the 1-mile transit shed. Close proximity to transit has a significant impact on increasing transit uses. Transit mode share, as a main mode, was higher for NYS residents that lived within the 1-mile transit shed than others. Based on ACS data, over the period from 2005 to 2013, the total number of NYMTC workers increased more than 9%, while transit commuting grew at a higher rate of more than 15% during the same period. REMARKS Note that transit use in areas outside the NYMTC region generally is not common, resulting in a smaller sample size of transit users in the Rest of NYS region. Caution should be exercised for statistics produced based on small sample sizes that tend to be less precise (i.e., with a larger margin of error). Furthermore, standardized transit network data were not available prior to 2005; comparable analyses using 2001 NHTS therefore was not feasible. As a result, this study focused on examining travel behaviors of transit users using 2009 NHTS data only.

33 ADVANCED PROPULSION SYSTEMS↗

Equilibrium-gated pattern formation: How molecular dissociation thermodynamics drive emergent behavior in dissipative polymeric systems

Emergent patterns in biological systems arise through dissipative processes that balance reaction and transport phenomena, producing highly functional properties from self-regulating mechanisms. Synthetic fabrication, by contrast, often relies on user-controlled, multistep methods that lack the self-organizing capabilities of natural systems. Inspired by nature, we sought chemical systems that integrate strongly coupled reaction and transport phenomena, identifying frontal ring-opening metathesis polymerization (FROMP) as a method capable of creating diverse forms and functions through reactive processing. By employing discrete molecular initiators, FROMP allows precise control of key reaction steps—inhibition, initiation, and propagation. Using an integrated computational and experimental framework, we uncover how near-equilibrium inhibition dynamics, coupled with far-from-equilibrium reaction kinetics, drive pattern formation in frontally polymerized synthetic materials. We propose the concept of equilibrium-gated pattern formation, demonstrating how initiator chemistry can be tuned to achieve programmable macroscale properties. Our study reveals a surprising insight: Emergent behavior in FROMP systems arises from the inhibition-dominated regime of resin composition, expanding prior observations that such behavior is confined to a narrow compositional space near the boundary between front quenching and uniform front propagation. We identify a broader compositional window, far from the quenching regime, where emergent behavior reliably manifests. This expanded design space significantly enhances the operational flexibility of reactive systems and their capacity for self-organization. Furthermore, these insights provide a roadmap for designing bioinspired materials with self-organizing capabilities, unlocking possibilities in synthetic manufacturing.

Architected Polymers↗