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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 847 records · Page 47
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Performance of Cow Dung Reinforced Biodegradable Poly(Lactic Acid) Biocomposites for Structural Applications

In this work, performance of cow dung (CD) reinforced poly(lactic acid) (PLA) biocomposites was investigated for the potential use in load bearing application. CD of average 4 mm size was blended with PLA at different CD ratios (0–50 wt%) and their effects on the biocomposite properties were studied. The results showed an improvement in the flexural properties, while the tensile and impact strength dropped by 20 and 28% with the addition of 50% CD. The decline in the tensile and impact strength was due to micro-cracking and voids formation at higher CD content. Also, the incorporation of CD slightly decreased the thermal stability of the biocomposite. However, dynamic mechanical properties of the biocomposites generally improved. SEM analysis of tensile and impact fractured surfaces indicated that the CD had a reasonable adhesion with matrix. Moreover, the SEM micrographs of soil burial studies showed an accelerated degradation of higher CD wt% biocomposites.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Block orbital-selective Mott insulators: A spin excitation analysis

We present a comprehensive study of the spin excitations—as measured by the dynamical spin structure factor S(q,ω)—of the so-called block-magnetic state of low-dimensional orbital-selective Mott insulators. We realize this state via both a multi-orbital Hubbard model and a generalized Kondo-Heisenberg Hamiltonian. Due to various competing energy scales present in the models, the system develops periodic ferromagnetic islands of various shapes and sizes, which are antiferromagnetically coupled. The 2×2 particular case was already found experimentally in the ladder material BaFe2Se3 that becomes superconducting under pressure. Here we discuss the electronic density as well as Hubbard and Hund coupling dependence of S(q,ω) using density matrix renormalization group method. Several interesting features were identified: (1) An acoustic (dispersive spin-wave) mode develops. (2) The spin-wave bandwidth establishes a new energy scale that is strongly dependent on the size of the magnetic island and becomes abnormally small for large clusters. (3) Optical (dispersionless spin excitation) modes are present for all block states studied here. In addition, a variety of phenomenological spin Hamiltonians have been investigated but none matches entirely our results that were obtained primarily at intermediate Hubbard U strengths. Our comprehensive analysis provides theoretical guidance and motivation to crystal growers to search for appropriate candidate materials to realize the block states, and to neutron scattering experimentalists to confirm the exotic dynamical magnetic properties unveiled here, with a rich mixture of acoustic and optical features.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Heterometallic Actinide‐Containing Photoresponsive Metal‐Organic Frameworks: Dynamic and Static Tuning of Electronic Properties

Abstract Acquiring fundamental knowledge of properties of actinide‐based materials is a necessary step to create new possibilities for addressing the current challenges in the nuclear energy and nuclear waste sectors. In this report, we established a photophysics–electronics correlation for actinide‐containing metal‐organic frameworks (An‐MOFs) as a function of excitation wavelength, for the first time. A stepwise approach for dynamically modulating electronic properties was applied for the first time towards actinide‐based heterometallic MOFs through integration of photochromic linkers. Optical cycling, modeling of density of states near the Fermi edge, conductivity measurements, and photoisomerization kinetics were employed to shed light on the process of tailoring optoelectronic properties of An‐MOFs. Furthermore, the first photochromic MOF‐based field‐effect transistor, in which the field‐effect response could be changed through light exposure, was constructed. As a demonstration, the change in current upon light exposure was sufficient to operate a two‐LED fail‐safe indicator circuit.

Martin, Corey R.↗
DOE OSTI2022

Nucleon–nucleon correlations in the extreme oxygen isotopes

There has been an upsurge of interest in two-nucleon decays thanks to the studies of nucleon–nucleon correlations. In our previous work (2021 Phys. Rev. Lett. 126 142501), based on a novel time-dependent three-body approach, we demonstrated that the energy and angular correlations of the emitted nucleons can shed light on the structure of nucleonic pairs formed inside the nucleus. In this work, we apply the new framework to study the decay dynamics and properties of some extreme proton-rich and neutron-rich oxygen isotopes, including two-proton (2p) decays of 11,12 O and two-neutron (2n) decay of 26 O. Here we show that the low- ℓ components of 11,12 O wave functions, which are affected by continuum and configuration-interaction effects, strongly impact decay dynamics and asymptotic correlations. In the calculated wave functions of 11,12 O, diproton and cigarlike structures merge together during the tunneling process and the resulting energy and angular correlations are very consistent with the experimental data. The asymptotic correlations of the 2n decay of 26 O dramatically change as the 2n decay energy approaches the zero-energy threshold. The small reported value of Q 2n suggests that the 2n decay of this nucleus can be understood in terms of the universal phase-space limit.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2020

Functional, Hierarchical Colloidal Liquid Crystal Gels and Liquid Crystal Elastomers Nanocomposites. Final Report

Biological systems rely on a hierarchy of dynamic, complex and reconfigurable compartments to carry out functions essential for life. This hierarchical organization serves as an amplifier that allows highly localized, molecular events to propagate into the mesoscale, resulting in dynamic functional properties of biological systems that have not yet been fully realized in synthetic material designs. We pursued a program of research in which we recreated such principles using synthetic liquid crystals (LC) as a versatile platform. We elucidated new hierarchical design strategies that heavily leverage surface anchoring, coexisting phases and interfacial tension gradient to realize equilibrium and non-equilibrium, dynamic mesoscale phenomena in the context of micrometer-sized LC droplets containing multiple compartments. Specifically, we unmasked how equilibrium and dynamical phenomena emerged from hierarchical organizations in reconfigurable, thermotropic liquid crystalline assemblies. The long-term impact of the project is to advance new hierarchical designs of complex soft matter systems in which biomimetic principles, including the propagation of events or information over multiple temporal and spatial scales, are enacted in a facile manner.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Heterometallic Actinide-Containing Photoresponsive Metal-Organic Frameworks: Dynamic and Static Tuning of Electronic Properties

Acquiring fundamental knowledge of properties of actinide-based materials is a necessary step to create new possibilities for addressing the current challenges in the nuclear energy and nuclear waste sectors. Here in this report, we established a photophysics–electronics correlation for actinide-containing metal-organic frameworks (An-MOFs) as a function of excitation wavelength, for the first time. A stepwise approach for dynamically modulating electronic properties was applied for the first time towards actinide-based heterometallic MOFs through integration of photochromic linkers. Optical cycling, modeling of density of states near the Fermi edge, conductivity measurements, and photoisomerization kinetics were employed to shed light on the process of tailoring optoelectronic properties of An-MOFs. Furthermore, the first photochromic MOF-based field-effect transistor, in which the field-effect response could be changed through light exposure, was constructed. As a demonstration, the change in current upon light exposure was sufficient to operate a two-LED fail-safe indicator circuit.

36 MATERIALS SCIENCE↗
DOE OSTI2026

The CP-PAW Code Package for First-Principles Calculations from a User’s Perspective

CP-PAW is a combined electronic structure and ab initio molecular dynamics code to perform mixed quantum and classical simulations of atomistic condensed phase systems, such as solids, liquids, and molecular systems. As the name suggests, the CP-PAW code unifies the all-electron projector augmented-wave (PAW) method with the Car–Parrinello (CP) approach to determine not only the electronic and nuclear ground states of condensed matter but also to study their properties and dynamics. In addition to briefly outlining the underlying theory, the focus will be on the unique aspects of CP-PAW and how to correctly employ them as a user. How to install CP-PAW using the new build system will also be briefly mentioned.

Blöchl, Peter E [Institute for Theoretical Physic↗
NASA NTRSDate not supplied

An Investigation of the Dragonfly Mission Aeroshell/Parachute Dynamics through Subscale Drop Tests

The Dragonfly mission will place a rotorcraft/lander on Titan by 2034. The entry, descent, and landing system of the Dragonfly mission includes two parachutes: a drogue and a main. To provide needed data, subscale drop tests were used to conduct an experimental investigation of the aeroshell/parachute dynamics. The drop tests used a Disk-Gap-Band drogue parachute and two types of Ringslot main parachutes. All tests used a representative aeroshell which included the heatshield. All models were geometrically scaled to 16.7 percent. The model aeroshell had a diameter of 0.75 m. The model parachute nominal diameters were 0.9 m for the drogue and 2.78 m for the main. The aeroshell’s mass properties were dynamically scaled to simulate flight at an altitude of 4 km at Titan. This dynamic scaling allowed the conversion of model test results to full-scale Titan conditions. Onboard instrumentation on the aeroshell provided data on the rotation rates, from which the Euler angles were determined. Tests were conducted by lifting the models with a drone to an altitude of 350 m and dropping them inverted. Key results from these tests were: 1) the models were able to recover from the extreme inverted initial condition and settle to low-amplitude oscillations; 2) ninety nine percent of the time the oscillation amplitudes observed with the drogue parachute were 11.4 degrees or less; 3) ninety nine percent of the time the oscillation amplitudes observed with the 20 percent porosity main parachute were 15.4 degrees or less.

Parachutes↗
NASA NTRSDate not supplied

An Investigation of the Dragonfly Mission Aeroshell/Parachute Dynamics through Subscale Drop Tests

The Dragonfly mission will place a rotorcraft/lander on Titan by 2034. The entry, descent, and landing system of the Dragonfly mission includes two parachutes: a drogue and a main. To provide needed data, subscale drop tests were used to conduct an experimental investigation of the aeroshell/parachute dynamics. The drop tests used a Disk-Gap-Band drogue parachute and two types of Ringslot main parachutes. All tests used a representative aeroshell which included the heatshield. All models were geometrically scaled to 16.7 percent. The model aeroshell had a diameter of 0.75 m. The model parachute nominal diameters were 0.9 m for the drogue and 2.78 m for the main. The aeroshell’s mass properties were dynamically scaled to simulate flight at an altitude of 4 km at Titan. This dynamic scaling allowed the conversion of model test results to full-scale Titan conditions. Onboard instrumentation on the aeroshell provided data on the rotation rates, from which the Euler angles were determined. Tests were conducted by lifting the models with a drone to an altitude of 350 m and dropping them inverted. Key results from these tests were: 1) the models were able to recover from the extreme inverted initial condition and settle to low-amplitude oscillations; 2) ninety nine percent of the time the oscillation amplitudes observed with the drogue parachute were 11.4 degrees or less; 3) ninety nine percent of the time the oscillation amplitudes observed with the 20 percent porosity main parachute were 15.4 degrees or less.

Parachutes↗
DOE OSTI2019

Progress towards a phenomenological picture and theoretical understanding of glassy dynamics and vitrification near interfaces and under nanoconfinement

The nature of alterations to dynamics and vitrification in the nanoscale vicinity of interfaces-commonly referred to as "nanoconfinement" effects on the glass transition-has been an open question for a quarter century. We first analyze experimental and simulation results over the last decade to construct an overall phenomenological picture. Key features include the following: after a metrology- and chemistry-dependent onset, near-interface relaxation times obey a fractional power law decoupling relation with bulk relaxation; relaxation times vary in a double-exponential manner with distance from the interface, with an intrinsic dynamical length scale appearing to saturate at low temperatures; the activation barrier and vitrification temperature T-g approach bulk behavior in a spatially exponential manner; and all these behaviors depend quantitatively on the nature of the interface. We demonstrate that the thickness dependence of film-averaged T-g for individual systems provides a poor basis for discrimination between different theories, and thus we assess their merits based on the above dynamical gradient properties. Entropy-based theories appear to exhibit significant inconsistencies with the phenomenology. Diverse free-volume-motivated theories vary in their agreement with observations, with approaches invoking cooperative motion exhibiting the most promise. The elastically cooperative nonlinear Langevin equation theory appears to capture the largest portion of the phenomenology, although important aspects remain to be addressed. A full theoretical understanding requires improved confrontation with simulations and experiments that probe spatially heterogeneous dynamics within the accessible 1-ps to 1-year time window, minimal use of adjustable parameters, and recognition of the rich quantitative dependence on chemistry and interface. Published under license by AIP Publishing.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Isotope effects in dynamics of water isotopologues induced by core ionization at an x-ray free-electron laser

Dynamical response of water exposed to x-rays is of utmost importance in a wealth of science areas. We exposed isolated water isotopologues to short x-ray pulses from a free-electron laser and detected momenta of all produced ions in coincidence. By combining experimental results and theoretical modeling, we identify significant structural dynamics with characteristic isotope effects in H 2 O 2+ , D 2 O 2+ , and HDO 2+ , such as asymmetric bond elongation and bond-angle opening, leading to two-body or three-body fragmentation on a timescale of a few femtoseconds. A method to disentangle the sequences of events taking place upon the consecutive absorption of two x-ray photons is described. The obtained deep look into structural properties and dynamics of dissociating water isotopologues provides essential insights into the underlying mechanisms.

47 OTHER INSTRUMENTATION↗
DOE OSTI2019

Thermal and Mechanical Properties of CO{sub 2}-Based Biodegradable Poly(cyclohexene carbonate)/Organically Modified Layered Zinc Phenylphosphonate Nanocomposites

A new sustainable composite material was fabricated using CO{sub 2}-based poly(cyclohexene carbonate) (PCHC) and organically modified layered zinc phenylphosphonate (m-PPZn) via a solution mixing process. Analysis by wide-angle X-ray diffraction (WAXD) showed that the interlayer spacing of the m-PPZn was enlarged to 30.4 Å. The morphology of the PCHC/m-PPZn nanocomposites was characterized by transmission electron microscopy and WAXD, which revealed that the layered materials were partially delaminated and randomly dispersed in the PCHC matrix. The enhancement of the dynamic mechanical properties of the 1 wt% PCHC/m-PPZn nanocomposite at 80 °C was approximately 114% relative to those of the neat PCHC matrix. The thermal properties of the PCHC/m-PPZn nanocomposites characterized using thermogravimetric analysis were substantially improved upon incorporation of m-PPZn. With the addition of 0.25 wt% m-PPZn into the PCHC matrix, the decomposition temperature associated with 10 wt% loss of the nanocomposites was substantially increased by approximately 24 °C compared with that of the PCHC matrix. The isothermal degradation data demonstrated that the activation energy of the composites was higher than that of the PCHC. This finding was attributed to the addition of m-PPZn to PCHC increasing the thermal energy required for degradation, thus inducing a reduction in the degradation rate and an increase in the residual weight for the PCHC/m-PPZn nanocomposites.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2025

Expansion dynamics of femtosecond laser-induced plasmas: Influence of thermophysical plasma properties

This study investigates the expansion dynamics of femtosecond laser-induced plasmas, emphasizing the impact of plasma thermophysical properties and ambient gas composition. Through shadowgraphy experiments and multiphase computational fluid dynamics (CFD) simulations, the influence of parameters such as heat capacity, molecular weight, and thermal conductivity on plume morphology, shockwave evolution, and energy dissipation mechanisms is examined. A mixture multiphase model is implemented to capture the interaction between the plasma and the surrounding gas. Simulation results reveal that plasma expansion is strongly inertia-driven. Results show that differences in plasma properties and ambient conditions affect the shape and temperature distribution of the expanding plume. The early-stage dynamics are primarily dictated by pressure forces, whereas thermal and viscous effects play a growing role in the plume's behavior during later stages of expansion. The CFD findings show the necessity of accurate initial condition characterization, including crater geometry and plasma pressure and temperature, for reliable modeling of plasma evolution in laser ablation processes.

CFD modeling↗
DOE OSTI2019

Sustainable Use of Chloroprene Rubber Waste as Blend Component with Natural Rubber, Epoxidized Natural Rubber and Styrene Butadiene Rubber

Recycling of rubber waste and finding the effective methods to extend its use are one of major challenges nowadays. The potential approach to reduce rubber waste is to blend it with virgin rubber, perhaps with synergistic advantages. In this study, chloroprene rubber waste (CRw) is used as blend component in binary blends with natural rubber (NR), epoxidized natural rubber with 50 mol% epoxidation level (ENR50), and styrene butadiene rubber (SBR). The effects of blend ratio [95/5, 85/15, 75/25, 65/35 and 50/50 (phr/phr)] on the properties were studied. The results indicate that CRw prolongs scorch and curing times, due to the differences in unsaturation contents and cure incompatibility. The maximum torque (M{sub H}), minimum torque (M{sub L}), and torque difference (M{sub H}–M{sub L}) in all cases increased with CRw content in the blend. Because CRw has a crosslink precursor, crosslink density also increased with CRw content. This is clearly confirmed by the combination of swelling resistance, crosslink density and dynamic mechanical properties observed. SEM micrographs showed mostly rough surface and tearing areas for low CRw contents in the blends. The blends also showed less crack paths with increasing CRw content over 50 phr. Further increase in CRw content obviously enhanced the thermal stability of the blends, with elevated decomposition temperatures in TGA results.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Electrochemical Control of the Ultrafast Lattice Response of a Layered Semimetal

The unique layer-stacking in two-dimensional (2D) van der Waals materials facilitates the formation of nearly degenerate phases of matter and opens novel routes for the design of low-power, reconfigurable functional materials. Electrochemical ion intercalation between stacked layers offers a promising approach to stabilize bulk metastable phases and to explore the effects of extreme carrier doping and strain. However, in situ characterization methods to study the structural evolution and dynamical functional properties of these intercalated materials remains limited. Here a novel experimental platform is presented capable of simultaneously performing electrochemical lithium-ion intercalation and multimodal ultrafast characterization of the lattice using both electron diffraction and nonlinear optical techniques. Using the layered semimetal WTe 2 as a model system, the interlayer shear phonon mode that modulates stacking between 2Dlayers is probed, showing that small amounts of lithiation enhance the amplitude and lifetime of the phonon, contrary to expectations. This results from the dynamically fluctuating and anharmonic structure between nearly degenerate phases at room temperature, which can be stabilized by electronic carriers accompanying the inserted lithium ions. At high lithiation, the T d ’ structure emerges and quenches the phonon response. This work defines new approaches for using electrochemistry to engineer the dynamic structure of 2D materials.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Evaluation of a fiber-coupled x-ray diffraction detector for dynamic compression experiments

The long-term x-ray diffraction (XRD) detector scheme compatible with Z-containment experiments will involve conversion of the diffracted x-rays to optical light, which will be transported away from the Z-Dynamic Materials Properties (DMP) load and detected on a fast-gated camera. In this so-called DIffraction SCintillator Optic (DISCO) scheme , the scintillator is coupled to a long, coherent imaging fiber bundle using a custom lens system with high numerical aperture. In addition, the DISCO diagnostic incorporates time-gating to allow measurement only during the short time window of the x-ray pulse in which XRD occurs, thereby significantly reducing unwanted background generated by the Z-DMP load. Dynamic compression experiments were performed at the Chama target chamber to evaluate the DISCO diagnostic . Specifically, a Zr sample was laser-shocked with the Chaco laser while the Z-Beamlet (ZBL) laser was used to generate x-rays, which enabled time-gated 6.7-keV XRD patterns from the compressed Zr sample to be obtained.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
NASA NTRS1986

Hybrid deployable/erectable solar dynamic box truss system

The design of a hybrid deployable/erectable solar dynamic box truss power generation system for the initial operation capability (IOC) of the Space Shuttle is examined. An organic Rankine cycle heat engine for IOC solar power generation is studied. The design configuration is a simple parabolic concentration where the receiver is located in the focal plane with its aperture at the focal point. The relationship between concentrator size and collection efficiency is analyzed. The geometry of the deployable graphite/epoxy box truss ring and the reflective panels of the system are described. Mass properties and dynamic analyses are performed to evaluate the center of gravity location and moments of inertia characteristics of the energy conversion subsystem (ECS). The deployable/erectable truss is applicable for large IR space telescopes and center and offset fed ECSs.

Coyner, J. V., Jr.↗
NASA NTRS2023

Dragonfly: A Case Study in Dynamic Stability Characterization

Next decade, the Dragonfly probe will enter Titan’s atmosphere on a mission to explore and characterize its unique and complex organic chemistry. In contrast to Mars entry missions, where the challenge is to slow down in its tenuous atmosphere before impacting the surface, Titan’s thick atmosphere provides generous drag. However, Titan has its own unique EDL challenges. Among these challenges is the long time (on the order of 90 minutes!) the vehicle will need to descend unguided through flow regimes where blunt-body entry probes are known to be dynamically unstable. This elongated timeline, both prior to drogue parachute deployment, and during the ensuing descent, has the potential to allow adverse dynamic instability properties to produce large amplitude oscillations in angle-of-attack. This, in-turn may lead to non-compliance in vehicle attitude requirements for EDL events such as parachute deployment, and lander release, or in the most extreme case, tumbling of the aeroshell and near-assured loss of mission.

EDL↗