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DOE OSTI2024

Piezocatalytic ZnS:Mn 2+ Nanocrystals for Enhanced Organic Dye Degradation

Piezocatalysis, an emerging approach that harnesses mechanical energy to drive chemical reactions, has garnered significant attention due to its potential applications in diverse fields, particularly in environmental remediation. Its broader application, however, is often hindered by the low efficiency of existing piezocatalytic materials. Here, we report the synthesis of Mn 2+ -doped ZnS nanocrystals with improved piezoelectric properties using an emulsion-based colloidal assembly technique. Through well-controlled Mn 2+ doping, these nanocrystals demonstrate high piezocatalytic activity for degrading organic dyes under ultrasonic vibration. The optimal performance is achieved with 3% Mn 2+ doping, outperforming many existing piezocatalysts. Mechanistic studies reveal the generation of reactive oxygen species as the primary driving force for degradation. Notably, pre-excitation with UV light further boosts the piezocatalytic efficiency of these metal ion-doped ZnS nanocrystals by filling electron trap states, leading to improved overall performance. This research paves the way for developing high-performance piezocatalysts, expanding the potential of piezocatalysis for a wide range of applications.

36 MATERIALS SCIENCE↗

NASA NTRS1973

Chemical evolution - Recent syntheses of bioorganic molecules.

Review of the important developments that have occurred in abiological biomonomer and biopolymer synthesis since about 1967, and discussion of their significance for the field of chemical evolution and the origin of life. The major portion of the review is devoted to important developments in the abiotic formation of bioorganic monomers and their condensation to biopolymers under conditions presumed to have prevailed on the primeval earth. Special attention is given to contributions shedding light on the mechanism of synthesis and selection of amino acids and on interactions of amino acids and polypeptides with nucleotides and oligonucleotides.

Stephen-Sherwood, E.↗

NASA NTRS1975

Ultrabasic breccias in layered intrusions - The Rhum complex

Two breccias in the southwest part of the ultrabasic Rhum complex are considered. Aspects of field relations are discussed along with questions regarding the petrography of the matrix. Attention is given to textures and chemical mineralogy, the mechanism of brecciation, matrix magmas, and the possible implications of the findings. It is concluded that the Harris Bay and Ard Mheall ultrabasic breccias formed by brecciation due to the intrusion of feldspathic peridotite magmas.

Donaldson, C. H.↗

NASA NTRS1975

Gamma ray astrophysics

Gamma-ray production processes are considered, taking into account Compton scattering between cosmic-ray electrons and starlight microwave background photons, synchrotron radiation, bremsstrahlung interactions, nucleon-antinucleon annihilations, the form of the spectrum from pion production at high energies, and gamma rays from photomeson production at ultrahigh energies. Attention is also given to gamma-ray absorption mechanisms, gamma rays observed from the Galaxy, and extragalactic gamma rays.

Stecker, F. W.↗

NASA NTRS1977

On the large-scale structure in turbulent free shear flows

The interaction between the large-scale structure and the disparately fine-grained turbulence in a free turbulent shear flow, in particular, the mixing region is considered. New results pertaining to the spatial problem are presented. An incompressible fluid is considered. An energy integral description is discussed, giving attention to shape assumptions, the interaction problem, energy transfer mechanisms, the spectral dependence of the interaction, and the control of the large-scale structure.

Liu, J. T. C.↗

NASA NTRS1978

The LPSP instrument on OSO 8. II - In-flight performance and preliminary results

The paper describes the in-flight performance for the first 18 months of operation of the LPSP (Laboratoire de Physique Stellaire et Planetaire) instrument incorporated in the OSO 8 launched June 1975. By means of the instrument, an absolute pointing accuracy of nearly one second was achieved in orbit during real-time operations. The instrument uses a Cassegrain telescope and a spectrometer simultaneously observing six wavelengths. In-flight performance is discussed with attention to angular resolution, spectral resolution, dispersion and grating mechanism (spectral scanner) stability, scattered light background and dark current, photometric standardization, and absolute calibration. Real-time operation and problems are considered with reference to pointing system problems, target acquisition, and L-alpha modulation. Preliminary results involving the observational program, quiet sun and chromospheric studies, quiet chromospheric oscillation and transients, sunspots and active regions, prominences, and aeronomy investigations are reported.

Bonnet, R. M.↗

NASA NTRS1984

An Eulerian transport/transformation/removal model for SO2 and sulfate. I - Model development. II - Model calculation of SO(x) transport in the eastern United States

A three-dimensional, time dependent Eulerian atmospheric SO2 and sulfate transport/transformation/removal model is described and applied to the eastern U.S. The model was developed in anticipation of increased input to the atmospheric sulfur content by coal-burning power plants in the near future and is intended as an aid in identifying sources of SO2. The Eulerian transport model incorporates functions for chemical transformations, dry deposition, spatial topographical variations, spatial and temporal variations of mixing layer heights, the wind field, eddy diffusivities, deposition velocities, and temperature and water concentration profiles. Attention is also given to the SO2 photochemical oxidation mechanism and rates. Results from a 72-hr simulation of SO(x) transport over the eastern U.S., using actual 1974 meteorological data, illustrate the model's capability to depict interactions between emissions, transport, chemistry and removal. Concentration distributions are demonstrated to have significant spatial and temporal variations.

Carmichael, G. R.↗

NASA NTRS1986

Comparison of solar hard X-ray and UV line and continuum bursts with high time resolution

A comparison of data sets from the UV Spectrometer and Polarimeter and Hard X-ray Burst Spectrometer instruments on SMM has established the close relationship of the impulsive phase hard X-ray and UV continuum and OV line emissions, lending support to the notion that they have a similar origin low in the solar atmosphere. These results severely constrain models that attempt to explain impulsive phase hard X-rays and UV emission; alternative processes of impulsive-phase UV continuum production should accordingly be considered. Attention is given to an electron beam 'hole boring' mechanism and a photoionization radiation transport mechanism.

Orwig, L. E.↗

NASA NTRS1988

Interpenetrating polymer network approach to tougher and more microcracking resistant high temperature polymers. I - LaRC-RP40

Interpenetrating polymer networks in the form of the LaRC-RP40 resin, prepared by the in situ polymerization of a thermosetting imide prepolymer and thermoplastic monomer reactants, are presently used to obtain toughness and microcracking resistance in a high-temperature polymer. Attention is presently given to the processing, physical, and mechanical properties, as well as the thermooxidative stability, of both the neat resin and the resin as a graphite fiber-reinforced matrix. Microcracking after thermal cycling was also tested. LaRC-RP40 exhibits significant resin fracture toughness improvements over the PMR-15 high-temperature matrix resin.

Pater, Ruth H.↗

NASA NTRS1990

The role of magnetic fields in cluster cooling flows

An investigation is made of the dynamical effects of the intracluster magnetic field, whose radial inflow and shear can produce a dramatic increase in the field's strength while rendering it more radial, with cooling flows. It is found that field reconnection is the most likely dominant-loss mechanism, so that buoyancy effects are probably not important. Attention is given to the effect of the magnetic field on thermal instabilities. The most important observable effect of the magnetic field in cooling flows will probably be very strong Faraday rotation of the polarization of radio sources within or behind the cooling flow.

Soker, Noam↗

NASA NTRS1990

Magnetic reconnection, merging, and viscous interaction in the magnetosphere

This paper discusses the historical development of the reconnection theory, with consideration given to the effects of a magnetic field within the plasma and the mechanisms of magnetic reconnection, merging, and viscouslike interaction. Particular attention is given to Dungey's (1958, 1961) steady-state reconnection model of the magnetosphere and to its criticism. Observational evidence supporting the reconnection model is presented.

Heikkila, W. J.↗

NASA NTRS1992

Inflated concepts for the earth science geostationary platform and an associated flight experiment

Large parabolic reflectors and solar concentrators are of great interest for microwave transmission, solar powered rockets, and Earth observations. Collector subsystems have been under slow development for a decade. Inflated paraboloids have a great weight and package volume advantage over mechanically erected systems and, therefore, have been receiving greater attention recently. The objective of this program was to produce a 'conceptual definition of an experiment to assess in-space structural damping characteristics and effects of the space meteoroid environment upon structural integrity and service life of large inflatable structures.' The flight experiment was to have been based upon an inflated solar concentration, but much of that was being done on other programs. To avoid redundancy, the Earth Science Geostationary Platform (ESGP) was selected as a focus mission for the experiment. Three major areas were studied: the ESGP reflector configuration; flight experiment; and meteoroids.

Friese, G.↗

NASA NTRS1992

CSM solutions of rotating blade dynamics using integrating matrices

The dynamic behavior of flexible rotating beams continues to receive considerable research attention as it constitutes a fundamental problem in applied mechanics. Further, beams comprise parts of many rotating structures of engineering significance. A topic of particular interest at the present time involves the development of techniques for obtaining the behavior in both space and time of a rotor acted upon by a simple airload loading. Most current work on problems of this type use solution techniques based on normal modes. It is certainly true that normal modes cannot be disregarded, as knowledge of natural blade frequencies is always important. However, the present work has considered a computational structural mechanics (CSM) approach to rotor blade dynamics problems in which the physical properties of the rotor blade provide input for a direct numerical solution of the relevant boundary-and-initial-value problem. Analysis of the dynamics of a given rotor system may require solution of the governing equations over a long time interval corresponding to many revolutions of the loaded flexible blade. For this reason, most of the common techniques in computational mechanics, which treat the space-time behavior concurrently, cannot be applied to the rotor dynamics problem without a large expenditure of computational resources. By contrast, the integrating matrix technique of computational mechanics has the ability to consistently incorporate boundary conditions and 'remove' dependence on a space variable. For problems involving both space and time, this feature of the integrating matrix approach thus can generate a 'splitting' which forms the basis of an efficient CSM method for numerical solution of rotor dynamics problems.

Lakin, William D.↗

NASA NTRS1991

A survey of spacecraft thermal design solutions

A review of activities at the NASA/Marshall Space Flight Center in the heat transfer and thermodynamics disciplines as well as attendant fluid mechanics, transport phenomena, and computer science applications is presented. Attention is focused on recent activities including the Hubble Space Telescope, and large space instruments, particularly telescope thermal control systems such as those flown aboard Spacelab 2 and the Astro missions. Emphasis is placed on defining the thermal control features, unique design schemes, and performance of selected programs. Results obtained both by ground testing and analytical means, as well as flight and postflight data are presented.

Humphries, R.↗

NASA NTRS2011

Models of the Solar Atmospheric Response to Flare Heating

I will present models of the solar atmospheric response to flare heating. The models solve the equations of non-LTE radiation hydrodynamics with an electron beam added as a flare energy source term. Radiative transfer is solved in detail for many important optically thick hydrogen and helium transitions and numerous optically thin EUV lines making the models ideally suited to study the emission that is produced during flares. I will pay special attention to understanding key EUV lines as well the mechanism for white light production. I will also present preliminary results of how the model solar atmosphere responds to Fletcher & Hudson type flare heating. I will compare this with the results from flare simulations using the standard thick target model.

Allred, Joel↗

NASA NTRS2021

Effect of Urea Links in the Backbone of Polyimide Aerogels

Flexible, conformal polyimide aerogels with low density, good mechanical properties and high surface areas have attracted much attention for many potential applications such as lightweight antenna substrates, insulating materials for launch vehicles, inflatable structures, aircraft or space suits. Development and improvements to fabrication of polyimide aerogel thin films have been reported over the last decade to meet the needs of many of these applications. However, most starting materials are expensive. In this research, we utilized commercially available, low cost monomers including 4,4’-bis(4-aminophenoxy)propane (BAPP) and 3,3’,4,4’-benzophenone tetracarboxylic dianhydride (BTDA), and 4,4-methylene diphenyl di-isocyanate (MDI) in fabricating polyimide (PI) and polyimide-urea (PIU), which were then cross-linked with 1,3,5-tris(4-aminophenoxy)benzene (TAB). It was found that the addition of MDI into the PI chains not only maintained the flexibility of the aerogel films, but also enhanced the film casting, allowing the production on pilot scale. With the capability in producing robust films at affordable cost, application of the PIU aerogel films can be expanded to terrestrial goods such as winter clothing, or pipe wrapping, etc. In addition, the presence of only a small addition of the urea links in the polyimide chains in PIU aerogels led to lower shrinkage when compared to the corresponding PI aerogels, leading to lower density

Baochau N. Nguyen↗

DOE OSTI2023

Mechanism of Chalcophanite Nucleation in Zinc Hydroxide Sulfate Cathodes in Aqueous Zinc Batteries

Aqueous Zn-ion batteries with MnO 2 -based cathodes have seen significant attention owing to their high theoretical capacities, safety, and low cost; however, much debate remains regarding the reaction mechanism that dominates energy storage. In this work, we report our electron microscopy study of cathodes containing zinc hydroxide sulfate (Zn 4 SO 4 (OH) 6 ·xH 2 O, ZHS) together with carbon nanotubes cycled in electrolytes containing ZnSO 4 with varied amounts of MnSO 4 incorporated. The primary Mn-containing phase is formed in situ in the cathode during cycling, where a dissolution-deposition reaction is identified between ZHS and chalcophanite (ZnMn 3 O 7 ·3H 2 O). Mechanistic details of this reaction, in which the chalcophanite nucleates then separates from the ZHS flakes as the ZHS dissolves while acting as the primary Zn source for the reaction, are revealed using surface sensitive methods. Importantly, these findings indicate the reaction is local to the ZHS flakes, providing new insight toward the importance of ZHS and the cathode microstructure.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2023

Unraveling two distinct polymorph transition mechanisms in one n-type single crystal for dynamic electronics

Cooperativity is used by living systems to circumvent energetic and entropic barriers to yield highly efficient molecular processes. Cooperative structural transitions involve the concerted displacement of molecules in a crystalline material, as opposed to typical molecule-by-molecule nucleation and growth mechanisms which often break single crystallinity. Cooperative transitions have acquired much attention for low transition barriers, ultrafast kinetics, and structural reversibility. However, cooperative transitions are rare in molecular crystals and their origin is poorly understood. Crystals of 2-dimensional quinoidal terthiophene (2DQTT-o-B), a high-performance n-type organic semiconductor, demonstrate two distinct thermally activated phase transitions following these mechanisms. Here we show reorientation of the alkyl side chains triggers cooperative behavior, tilting the molecules like dominos. Whereas, nucleation and growth transition is coincident with increasing alkyl chain disorder and driven by forming a biradical state. We establish alkyl chain engineering as integral to rationally controlling these polymorphic behaviors for novel electronic applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗