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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 1,351 records · Page 75
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

An integrated environmental and health performance quantification model for pre-occupancy phase of buildings in China

To comprehensively pre-evaluate the damages to both the environment and human health due to construction activities in China, this paper presents an integrated building environmental and health performance (EHP) assessment model based on the Building Environmental Performance Analysis System (BEPAS) and the Building Health Impact Analysis System (BHIAS) models and offers a new inventory data estimation method. The new model follows the life cycle assessment (LCA) framework and the inventory analysis step involves bill of quantity (BOQ) data collection, consumption data formation, and environmental profile transformation. The consumption data are derived from engineering drawings and quotas to conduct the assessment before construction for pre-evaluation. The new model classifies building impacts into three safeguard areas: ecosystems, natural resources and human health. Thus, this model considers environmental impacts as well as damage to human wellbeing. The monetization approach, distance-to-target method and panel method are considered as optional weighting approaches. Finally, nine residential buildings of different structural types are taken as case studies to test the operability of the integrated model through application. The results indicate that the new model can effectively pre-evaluate building EHP and the structure type significantly affects the performance of residential buildings.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Operational and scaling-up barriers of SOEC and mitigation strategies to boost H 2 production- a comprehensive review

Solid oxide electrolysis cells (SOECs) proffer a flexible and environmentally friendly solution to reduce CO 2 emissions and/or produce H 2 fuel for various applications. Here, the integration of this technology with renewable energy systems makes them even more promising in realizing a near-perpetual green energy infrastructure in the near future. SOEC technology has achieved stupendous improvement in recent years, and some of the limiting factors to the commercialization of this technology have been explored. It is, therefore, necessary to have a succinct outlook of the different factors that contribute to the recent developments in SOEC technology. The current work presents a comprehensive review of the state-of-the-art SOEC component materials and their degradation mechanisms, SOEC modeling essentials and efficiencies, and the scalability of SOECs. Although SOEC is considered a highly promising technology and sufficient multifaceted research has been done, yet not been widely commercialized. Despite the improvement to mitigate degradation of the SOEC materials, a large share of the degradation concerns sprang from charge transfer reaction at the triple-phase boundaries of the H 2 -electrode. Part of which can be improved by microkinetic modeling of these materials supported by their characterization to give insight into their development. Some other directions for the future in advancing this technology toward the commercialization stage are thoroughly addressed.

08 HYDROGEN↗
DOE OSTI2026

Multi-material additive manufacturing of aluminum 6061-T6 alloy with stainless steel 304: Suppression of intermetallic compounds and interface growth mechanism

Fabricating integrated aluminum-steel structures is difficult because of metallurgical incompatibilities that promote intermetallic compound (IMC) formation at their interfaces. This work introduces a practical route for additively manufacturing 6061-T6 aluminum alloy (AA6061-T6) directly onto 304 stainless steel (SS304) using a high shear strain rate-assisted interfacial bonding mechanism. Through the friction extrusion deposition-based additive manufacturing method, both single- and multi-layer deposits of AA6061-T6 were successfully fabricated on SS304, yielding a robust hybrid multi-material structure. Comprehensive analyses of deposition quality, interface porosity, and bonding performance showed that the interface achieved a tensile strength exceeding 154 MPa under quasi-static loading. Microstructural observations revealed that the deposited aluminum layers experienced severe plastic deformation, resulting in pronounced grain refinement. Importantly, the interfacial zone was found to be free of brittle IMCs, instead containing a thin amorphous layer that evolved through a non-linear reaction-zone growth law. This solid-state additive strategy establishes a promising pathway for lightweight structural systems, nuclear energy component cladding, and multifunctional engineering components, redefining how dissimilar metals can be integrated for advanced applications.

Aluminum alloy↗
DOE OSTI2013

Single-crystalline CuGeO{sub 3} nanorods: Synthesis, characterization and properties

Graphical abstract: - Highlights: • Single crystalline CuGeO{sub 3} nanorods were prepared via a hydrothermal route. • The material exhibits greatly enhanced activity in photocatalytic degradation of dyes. • The magnetic susceptibility measurements indicate spin-Peierls transition properties. • CuGeO{sub 3} nanorods may be of potential application in future integrated optical devices. - Abstract: Single crystalline CuGeO{sub 3} nanorods with a diameter of 20–35 nm and a length up to 1 μm have been prepared via a facile hydrothermal route with the assistance of ethylenediamine. Some influencing factors such as the reaction time, reaction temperature, the volume of ethylenediamine were revealed to play crucial roles in the formation of the CuGeO{sub 3} nanorods. A possible growth mechanism was proposed based on the experimental results. Significantly, this is the first time that CuGeO{sub 3} was used as a photocatalyst for organic pollutant degradation under UV light irradiation. The reaction constant (k) of CuGeO{sub 3} nanorods was five times that of the sample prepared by solid-state reaction under UV light irradiation. Additionally, the optical and magnetic properties of CuGeO{sub 3} nanorods were systematically studied.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Photoluminescence, enhanced ferroelectric, and dielectric properties of Pr{sup 3+}-doped SrBi{sub 2}Nb{sub 2}O{sub 9} multifunctional ceramics

Pr{sup 3+}-doped SrBi{sub 2}Nb{sub 2}O{sub 9} (SBN) multifunctional ceramics were synthesized by the conventional solid state method. The photoluminescence (PL) excitation and emission spectra, enhanced ferroelectric and dielectric properties were investigated. The X-ray diffraction (XRD) and FESEM analyses indicated that the samples were simple phase and uniform flake-structure. Under the 250–350 nm ultraviolet (UV) excitations, the red emission was obtained and the optimal emission intensity was investigated when Pr doping level was 0.005 mol. With the increasing of the Pr{sup 3+} ion contents, the ferroelectric properties were enhanced obviously. As a new multifunctional material, the Pr{sup 3+}-doped SBN ceramics could be used for a wide range of application, such as integrated electro-optical devices.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Integrated carbon cloth supported LiFePO4/N-C films as high-performance cathode for lithium ion batteries

Highlights: • Construct carbon cloth supported LiFePO{sub 4}/N-C films via hydrothermal. • The LiFePO{sub 4}/N-C films show high capacity and good cycles. • Carbon cloth and N-C layer work together to provide fast ion/electron transfer. - Abstract: Fabricating advanced cathode is critical for the development of high-performance lithium ion batteries (LIBs). In this work, we develop a facile hydrothermal method for construction of LiFePO{sub 4}/N-C films on the carbon cloth forming integrated binder-free cathode. The LiFePO{sub 4}/N-C films are composed of interconnected nanoscale LiFePO{sub 4}/N-C particles with diameters of 100–200 nm. High porosity and good adhesion are obtained in the carbon cloth supported LiFePO{sub 4}/N-C films (CC + LiFePO{sub 4}/N-C films). As compared to the LiFePO{sub 4}/C powder nanoparticles, the CC + LiFePO{sub 4}/N-C films show much better electrochemical properties with higher capacities, smaller polarization and better high-rate cycling life. A high capacity of 169 mAh g{sup −1} at 1C is achieved for the carbon cloth supported LiFePO{sub 4}/N-C films, superior to the LiFePO{sub 4}/C powder nanoparticles (154 mAh g{sup −1} at 5C). This enhancement is owing to the unique integrated porous architecture and N-C coating. Our work shows a new way to construct integrated cathode for application in LIBs.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2018

Graphene foam supported LiFePO4 nanosheets composite as advanced cathode for lithium ion batteries

Highlights: • Construct self-supported porous LiFePO{sub 4}/GF composite film. • Porous LiFePO{sub 4}/GF composite film show superior cycling life. • Hierarchical porous nanosheets structure boost fast electron/ion transfer. - Abstract: Smart design of advanced cathode plays a significantly important role for the development of high-performance lithium ion batteries (LIBs). In this work, we synthesized a new kind of LiFePO{sub 4}/Graphene foam (LFP/GF) integrated binder-free cathode via chemical vapor deposition (CVD) + hydrothermal method. The LFP is composed of interconnected LiFePO{sub 4} nanosheets with numerous nanopores of 50–500 nm. High porosity and good adhesion endow LiFePO{sub 4}/GF film superior electrochemical properties with remarkable high-rate capacities, small polarization and stable cycling life. A high-rate capacity of 110 mAh g{sup −1} at 24 C is obtained for the LiFePO{sub 4}/GF composite. Moreover, a high capacity retention of 95% is acquired after 160 cycles. This enhancement is due to the unique integrated porous LiFePO{sub 4} nanosheets and good support of graphene foam providing fast ion/electron transfer. Our work displays a new insight in constructing integrated cathode for application in high-performance LIBs.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2019

Nanoelectronics with proximitized materials

While materials design for many device applications usually relies on adding impurities, recent advances in scaling-down heterostructures with improved interfacial properties offer a different way to transform a large class of materials. A given material can be drastically changed by inheriting properties leaking from its neighboring regions, such as magnetism, superconductivity, or spin-orbit coupling. While these proximity effects often have a short range and are considered negligible, the situation is qualitatively different in atomically thin and two-dimensional materials where the extent of proximity effects can exceed their thickness. Consequently, proximitized materials have a potential to display novel properties and device opportunities, absent in any of the constituent region of the considered heterostructures. Such proximitized materials could provide platforms for a wide range of emerging applications: from seamless integration of memory and logic, to fault-tolerant topologically protected quantum computing.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Electrostatic Control of Polymorphism in Charged Amphiphile Assemblies

Stimuli-induced structural transformations of molecular assemblies in aqueous solutions are integral to nanotechnological applications and biological processes. In particular, pH responsive amphiphiles as well as proteins with various degrees of ionization can reconfigure in response to pH variations. Here, we use in situ small and wide-angle X-ray scattering (SAXS/WAXS), transmission electron microscopy (TEM), and Monte Carlo simulations to show how charge regulation via pH induces morphological changes in the assembly of a positively charged peptide amphiphile (PA). Monte Carlo simulations and pH titration measurements reveal that ionic correlations in the PA assemblies shift the ionizable amine pK ~ 8 from pK ~ 10 in the lysine headgroup. SAXS and TEM show that with increasing pH, the assembly undergoes spherical micelle to cylindrical nanofiber to planar bilayer transitions. SAXS/WAXS reveal that the bilayer leaflets are interdigitated with the tilted PA lipid tails crystallized on a rectangular lattice. The details of the molecular packing in the membrane result from interplay between steric and van der Waals interactions. We speculate that this packing motif is a general feature of bilayers comprised of amphiphilic lipids with large ionic headgroups. Altogether, our studies correlate the molecular charge and the morphology for a pH-responsive PA system and provide insights into the Å-scale molecular packing in such assemblies.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Confinement and Processing Can Alter the Morphology and Periodicity of Bottlebrush Block Copolymers in Thin Films

Bottlebrush block copolymers (BBCPs) are intriguing architectural variations on linear BCPs with highly tunable structure. Confinement can have a significant impact on polymer assembly, giving rise to changes in morphology, assembly kinetics, and properties like the glass transition. Given that confinement leads to significant changes in the persistence length of bottlebrush homopolymers, it is reasonable to expect that BBCPs will see significant changes in their structure and periodicity relative to the bulk morphology. Understanding how confinement influences assembly will be important for designing BBCPs for thin film applications including membranes, integrated photonic structures, and potentially BCP lithography. In this work, in order to study the effects of confinement on BBCP conformation and morphology, a blade coating was used to prepare films with continuous variation in film thickness. Unlike thin films of linear BCPs, islands/holes were not observed, and instead mixtures of parallel and perpendicular morphologies emerge after annealing. The lamellar periodicity ($L_0$) of the morphologies is found to be thickness dependent, increasing $L_0$ with decreasing film thickness for blade coated films. Films coated out of tetrahydrofuran (THF) resulted in a single well-defined lamellar periodicity, verified through atomic force microscopy (AFM) and grazing incidence small-angle X-ray scattering (GISAXS), which increases dramatically from the bulk value (30.6 nm) and continues to increase as the film thickness decreases. The largest observed $L_0$ was 65.5 nm, and this closely approaches the estimated upper limit of 67 nm corresponding to a fully extended backbone in a bilayer arrangement. Films coated out of propylene glycol methyl ether acetate (PGMEA) resulted in a mixture of perpendicular lamellae and a smaller, likely cylindrical morphology. The lamellar portion of the film shows the same thickness dependence as the lamellae observed in the THF coated films. The scaling of the lamellar $L_0$ with respect to film thickness follows predictions for confined semiflexible polymers with weak excluded volume interactions and can be related to models for confinement of DNA. Spin coated films shows the same reduction in periodicity, although at very different film thicknesses. This result suggests that the material has shallow free-energy barriers to transitioning between different $L_0$ and morphologies, a property that could be taken advantage of for patterning diverse structures with a single material.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Size-Dependent Biexciton Quantum Yields and Carrier Dynamics of Quasi-Two-Dimensional Core/Shell Nanoplatelets

Quasi-two-dimensional nanoplatelets (NPLs) possess fundamentally different excitonic properties from zero-dimensional quantum dots. We study lateral size-dependent photon emission statistics and carrier dynamics of individual NPLs using second-order photon correlation (g( 2 )(τ)) spectroscopy and photoluminescence (PL) intensity-dependent lifetime analysis. Room-temperature radiative lifetimes of NPLs can be derived from maximum PL intensity periods in PL time traces. It first decreases with NPL lateral size and then stays constant, deviating from the electric dipole approximation. Analysis of the PL time traces further reveals that the single exciton quantum yield in NPLs decreases with NPL lateral size and increases with protecting shell thickness, indicating the importance of surface passivation on NPL emission quality. Second-order photon correlation (g( 2 )(τ)) studies of single NPLs show that the biexciton quantum yield is strongly dependent on the lateral size and single exciton quantum yield of the NPLs. In large NPLs with unity single exciton quantum yield, the corresponding biexciton quantum yield can reach unity. In conclusion, these findings reveal that by careful growth control and core–shell material engineering, NPLs can be of great potential for light amplification and integrated quantum photonic applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Towards a fully automated algorithm driven platform for biosystems design

Large-scale data acquisition and analysis are often required in the successful implementation of the design, build, test, and learn (DBTL) cycle in biosystems design. However, it has long been hindered by experimental cost, variability, biases, and missed insights from traditional analysis methods. Here, we report the application of an integrated robotic system coupled with machine learning algorithms to fully automate the DBTL process for biosystems design. As proof of concept, we have demonstrated its capacity by optimizing the lycopene biosynthetic pathway. This fully-automated robotic platform, BioAutomata, evaluates less than 1% of possible variants while outperforming random screening by 77%. A paired predictive model and Bayesian algorithm select experiments which are performed by Illinois Biological Foundry for Advanced Biomanufacturing (iBioFAB). BioAutomata excels with black-box optimization problems, where experiments are expensive and noisy and the success of the experiment is not dependent on extensive prior knowledge of biological mechanisms.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2026

Electrochemically mediated disproportionation for selective formaldehyde upcycling in acid

Formaldehyde (FA) electrolysis is attractive for paired production of value‑added chemicals. However, conventional electrolysis adopts alkaline electrolytes, which triggers FA self-disproportionation and severe feed loss. Here we introduce a sustainable and selective strategy for valorizing FA through electrochemically mediated disproportionation in acidic electrolytes. By leveraging a dual-electrode system consisting of a hydrophobic copper tetraminophthalocyanine layer (CuTAPc-layer) cathode and a Pt 2 Ru bimetallic anode, we efficiently convert FA into methanol and formic acid at high Faradaic efficiencies of 93.2% and 91.3%, respectively. Compared with alkaline FA oxidation, which can lose up to 76% FA and complicate downstream separation, the acidic system suppresses side reactions to ensure high product purity. Mechanism studies reveal that the hydrophobic microenvironment of CuTAPc-layer suppresses hydrogen evolution, while the stronger oxophilicity of Pt 2 Ru enhances FA activation and lowers the key deprotonation barrier for FA oxidation. The integrated device demonstrates application potential in polyoxymethylene upgrading, delivering 374.2 mA at 4 V with ~90% single-pass conversion, establishing a scalable and eco-friendly electrochemical pathway for chemical upcycling.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Tailoring diamond’s optical properties via direct femtosecond laser nanostructuring

We demonstrate a rapid, accurate, and convenient method for tailoring the optical properties of diamond surfaces by employing laser induced periodic surface structuring (LIPSSs). The characteristics of the fabricated photonic surfaces were adjusted by tuning the laser wavelength, number of impinging pulses, angle of incidence and polarization state. Using Finite Difference Time Domain (FDTD) modeling, the optical transmissivity and bandwidth was calculated for each fabricated LIPSSs morphology. The highest transmission of ~99.5% was obtained in the near-IR for LIPSSs structures with aspect ratios of the order of ~0.65. The present technique enabled us to identify the main laser parameters involved in the machining process, and to control it with a high degree of accuracy in terms of structure periodicity, morphology and aspect ratio. We also demonstrate and study the conditions for fabricating spatially coherent nanostructures over large areas maintaining a high degree of nanostructure repeatability and optical performance. While our experimental demonstrations have been mainly focused on diamond anti-reflection coatings and gratings, the technique can be easily extended to other materials and applications, such as integrated photonic devices, high power diamond optics, or the construction of photonic surfaces with tailored characteristics in general.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Inspection of 56 Fe γ -Ray angular distributions as a function of incident neutron energy using optical model approaches

Neutron inelastic scattering cross sections measured directly through (n,n) or deduced from g-ray production cross sections following inelastic neutron scattering (n,n0) are a focus of basic and applied research at the University of Kentucky Accelerator Laboratory (www.pa.uky.edu/accelerator). For nuclear data applications, angle-integrated cross sections are desired over a wide range of fast neutron energies. Several days of experimental beam time are required for a data set at each incident neutron energy, which limits the number of angular distributions that can be measured in a reasonable amount of time. Approximations can be employed to generate cross sections with a higher energy resolution, since at 125°, the a 2 P 2 term of the Legendre expansion is identically zero and the a 4 P 4 is assumed to be very small. Provided this assumption is true, a single measurement at 125o would produce the g-ray production cross section. Finally, this project tests these assumptions and energy dependences using the codes CINDY/SCAT and TALYS/ECIS06/SCAT. It is found that care must be taken when interpreting g-ray excitation functions as cross sections when the incident neutron energy is <1000 keV above threshold or before the onset of feeding.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2020

Extreme Compression for Large Scale Data Store

For the last 5 years Accelogic pioneered and perfected a radically new theory of numerical computing codenamed “Compressive Computing”, which has an extremely profound impact on real-world computer science [1]. At the core of this new theory is the discovery of one of its fundamental theorems which states that, under very general conditions, the vast majority (typically between 70% and 80%) of the bits used in modern large-scale numerical computations are absolutely irrelevant for the accuracy of the end result. This theory of Compressive Computing provides mechanisms able to identify (with high intelligence and surgical accuracy) the number of bits (i.e., the precision) that can be used to represent numbers without affecting the substance of the end results, as they are computed and vary in real time. The bottom line outcome would be to provide a state-of-the-art compression algorithm that surpasses those currently available in the ROOT framework, with the purpose of enabling substantial economic and operational gains (including speedup) for High Energy and Nuclear Physics data storage/analysis. In our initial studies, a factor of nearly x4 (3.9) compression was achieved with RHIC/STAR data where ROOT compression managed only x1.4.In this contribution, we will present our concepts of “functionally lossless compression”, have a glance at examples and achievements in other communities, present the results and outcome of our current, ongoing R&D, as well as present a high-level view of our plan to move forward with a ROOT implementation that would deliver a basic solution readily integrated into HENP applications. As a collaboration of experimental scientists, private industry, and the ROOT Team, our aim is to capitalize on the substantial success delivered by the initial effort and produce a robust technology properly packaged as an open-source tool that could be used by virtually every experiment around the world as means for improving data management and accessibility.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2013

Luminescent, dielectric, and ferroelectric properties of Pr doped Bi{sub 7}Ti{sub 4}NbO{sub 21} multifunctional ceramics

Pr doped Bi{sub 7}Ti{sub 4}NbO{sub 21} (BTN) multifunctional ceramics were prepared by a conventional sintering technique and their luminescent, dielectric, and ferroelectric properties were investigated. The X-ray diffraction data showed that the samples were single phase, and the scanning electron microscopy image indicated that the ceramics had flake-like grains with uniform thickness. The red emission was observed under the ultraviolet and blue light excitation at room temperature. The thermal quench of luminescence was measured and the result indicated that Pr doped BTN ceramics might be potentially applied in luminescent probes and temperature sensors. With the increasing Pr{sup 3+} content, the intensity of the photoluminescence increased initially and then decreased due to concentration quenching; The Curie temperature T{sub c} was slightly shifted to the lower temperature; the ferroelectric properties was almost unchanged by doping. As a new multifunctional material, the Pr doped BTN ceramics could be used for a wide range of application, such as integrated electro-optical devices.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Coupling mid-infrared light from a photonic crystal waveguide to metallic transmission lines

We propose and theoretically study a hybrid structure consisting of a photonic crystal waveguide (PhC-wg) and a two-wire metallic transmission line (TL), engineered for efficient transfer of mid-infrared (mid-IR) light between them. An efficiency of 32% is obtained for the coupling from the transverse magnetic (TM) photonic mode to the symmetric mode of the TL, with a predicted intensity enhancement factor of 53 at the transmission line surface. The strong coupling is explained by the small phase velocity mismatch and sufficient spatial overlapping between the modes. This hybrid structure could find applications in highly integrated mid-IR photonic-plasmonic devices for biological and gas sensing, among others.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗