Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “Solid Works”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 1,369 records · Page 76
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

In situ microscopy and spectroscopy characterization of microsized Sn anode for sodium-ion batteries

Microsized Sn is a promising anode material for sodium-ion batteries in terms of cost, specific capacity, and volumetric energy density, which however suffers from huge volume changes and rapid cell degradation upon cycling. Despite recent advances via nanostructured electrode design and interface engineering, the correlation between mechanical stability, solid-electrolyte interphase (SEI) and reaction kinetics/reversibility remains controversial and elusive. Here, in this work, by combining in situ scanning electron microcopy and X-ray absorption spectroscopy as well as X-ray photoelectron spectroscopy, we have investigated the underlying electro-chemo-mechanical behavior and their coupling effects during charge/discharge of microsized Sn anode. Our results revealed that microsized Sn is pulverized into nanoparticles with simultaneous formation of numerous voids and pores upon the 1st charge/discharge, while the electrolytes composition plays a critical role on the consequent parasitic reactions and eventually the sodiation/de-sodiation reversibility. In contrast to carbonate-based electrolytes, ether-based electrolytes enabled formation of inorganic species dominated SEI with improved mechanical strength, thus leading to higher specific capacity and improved cycling stability. The present findings are crucial for future development of microsized anode materials for rechargeable batteries with high volumetric energy density.

25 ENERGY STORAGE↗
DOE OSTI2019

Diffusion-Limited Formation of Nonequilibrium Intermetallic Nanophase for Selective Dehydrogenation

In this work, nonequilibrium intermetallic phases in the nanoscale were realized by diffusion-controlled solid-state transformation, forming SiO 2 supported NPs with Pd core and a CsCl type Pd 1 M 1 shell, where M is Sn or Sb. The core–shell geometry is identified from scanning transmission electron microscopy and infrared spectroscopy and the crystal structure is confirmed from in situ synchrotron X-ray diffraction and X-ray absorption spectroscopy. The highly symmetric Pd 1 M 1 intermetallic phase has not been reported previously and contains catalytic ensembles with high selectivity toward dehydrogenation of propane. The kinetically limited solid-state reaction is generally applicable to nanoparticle synthesis and could produce materials with desired structures and properties beyond conventional structural limits

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2026

Operando Depth-Resolved Measurement of Solvation Entropy, Interfacial Transport, and Charge-Transfer Kinetics in Lithium-Ion Batteries

Understanding and improving the performance and longevity of lithium-ion batteries critically depends on insight into the dynamic processes occurring at buried electrode-electrolyte interfaces. However, direct, depth-resolved, and operando diagnosis of these interfaces remains a longstanding challenge due to their inaccessibility beneath bulk materials, the limitations of conventional surface- and bulk-sensitive characterization tools, and the difficulty of maintaining realistic cell environments during measurement. These challenges have made it nearly impossible to uniquely resolve important interfacial properties such as charge transfer resistance, SEI (solid electrolyte interphase) resistance, and solvation entropy at the individual electrode interfaces within a working cell, information that is essential for mechanistic insight and accelerated battery design. Here, in this study, we report the development of multiharmonic electro-thermal spectroscopy (METS), an operando technique that enables depth-resolved measurement of solvation entropy, interfacial transport resistance, charge-transfer resistance, and SEI resistance at individual electrode-electrolyte interfaces within practical lithium-ion batteries. By leveraging frequency-dependent, thermal-wave sensing and interface-specific modeling, METS uniquely attributes interfacial properties to specific electrodes, as validated by comparison with traditional electrochemical impedance spectroscopy (EIS). The ability to spatially and temporally resolve interfacial processes in real time provides new diagnostic capabilities that are crucial for mechanistic studies of battery degradation and for the rapid development of next-generation energy storage systems.

Chalise, Divya [University of California, Berkeley↗
DOE OSTI2018

Microwave-Assisted Synthesis of Classically Immiscible Ag–Ir Alloy Nanoparticle Catalysts

In this work, we present the synthesis of Ag–Ir alloys in the form of solid-solution nanoparticles (NPs). Ag and Ir are classically immiscible in the bulk and therefore the physical properties of Ag–Ir alloys are unknown. A convenient microwave-assisted, solution-phase method that employs readily available Ag(NO 3 ) and IrCl 3 precursors enables the preparation of small (2.5–5.5 nm) Ag–IrNPs with alloyed structures. Ag $x$ Ir (100–$x$) NPs can be obtained by this method between $x$ = 6–31. The Ag–IrNPs resist dealloying upon heating up to 300 °C. Ir-rich Ag–IrNPs dispersed on amorphous silica are significantly more active gas-phase alkene hydrogenation catalysts than pure IrNPs. Density functional theory (DFT) and theoretical modeling studies reveal that the Ag–IrNPs—which are consistently larger than monometallic IrNPs prepared under the same conditions—have comparatively fewer strong H-binding edge sites. This promotes faster H atom transfer to coadsorbed alkenes. Ag–IrNPs supported on amorphous Co 3 O 4 show a linear composition dependence in the selective hydrogenation of C$=$O versus C$=$C bonds: more Ag-rich Ag–IrNPs are more selective toward C$=$O hydrogenation of the α,β-unsaturated aldehyde crotonaldehyde, yielding the industrially desirable crotyl alcohol. Furthermore, deposition of Ag–IrNPs inside Co 3 O 4 mesopores results in an additional ~56% selectivity enhancement.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Equation of State Measurements on Iron Near the Melting Curve at Planetary Core Conditions by Shock and Ramp Compressions

The outer core of the Earth is composed primarily of liquid iron, and the inner core boundary is governed by the intersection of the melt line and the geotherm. While there are many studies on the thermodynamic equation of state for solid iron, the equation of state of liquid iron is relatively unexplored. In this work, we use dynamic compression to diagnose the high-pressure liquid equation of state of iron by utilizing the shock-ramp capability at Sandia National Laboratories’ Z-Machine. This technique enables measurements of material states off the Hugoniot by initially shocking samples and subsequently driving a further, shockless compression. Planetary studies benefit greatly from isentropic, off-Hugoniot experiments since they can cover pressure-temperature (P-T) conditions that are close to adiabatic profiles found in planetary interiors. We used this method to drive iron to P-T conditions similar to those of the Earth’s outer-inner core boundary, along an elevated-temperature isentrope in the liquid from 275 GPa to 400 GPa. We derive the equation of state using a hybrid backward integration – forward Lagrangian technique on particle velocity traces to determine the pressure-density history of the sample. Our results are in excellent agreement with SESAME 92141, a previously published equation of state table. With our data and previous experimental data on liquid iron we provide new information on the iron melting line and derive new parameters for a Vinet-based equation of state. The table and our parameterized equation of state are applied to provide an updated means of modeling the pressure, mass, and density of liquid iron cores in exoplanetary interiors.

58 GEOSCIENCES↗
DOE OSTI2021

Probing the Damage Zone at Parkfield

Rocks are heterogeneous materials that exhibit nonlinear elastic (anelastic) behavior at scales ranging from the laboratory to Earth. In the laboratory, typical, complex relationships exist between stress and strain that include hysteresis, finite relaxation times, strain rate, and history dependence. These behaviors are linked to important characteristics such as stress, porosity, permeability, material integrity, and material failure. In this work, we adopted a “pump-probe” type experiment common in laboratory studies, using solid earth tides as the low-frequency pump and empirical Green's function as the high-frequency probe. By probing the velocity at different points in the pump cycle, we constrained important information about the strain-modulus relationship. Near the San Andreas Fault, we observed strongly nonlinear elastic behavior that characterizes the damage zone. We also constrained important aspects of hysteretic behavior that are related to damage properties and possibly pore pressure. Away from the fault, the nonlinear behavior is diminished.

58 GEOSCIENCES↗
DOE OSTI2020

Negative and zero thermal expansion in α-(Cu 2-x Znx)V 2 O 7 solid solutions

Negative or zero thermal expansion (NTE or ZTE) of materials is intriguing for controllable thermal expansion. In this work, we report a series of orthorhombic α-Cu 2- x Zn x V 2 O 7 ( x = 0, 0.1, 0.2), in which the volumetric coefficients of thermal expansion are successfully tuned from -10.19 × 10 -6 K -1 to -1.58 × 10 -6 K -1 in the temperature range of 100–475 K by increasing the content of Zn 2+ . It has been revealed that the transverse vibrations of oxygen bonded with vanadium are dominant in the contraction of the bc plane, leading to the overall volume NTE in α-Cu 2 V 2 O 7 . The introduction of Zn 2+ densifies the crystal structure, which is presumed to suppress the space of transverse vibrations and results in the ZTE in α-Cu 1.8 Zn 0.2 V 2 O 7 . This work presents an effective method to realize ZTE in anisotropic framework systems.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Decoupling first-cycle capacity loss mechanisms in sulfide solid-state batteries

Solid-state batteries (SSBs) promise more energy-dense storage than liquid electrolyte lithium-ion batteries (LIBs). However, first-cycle capacity loss is higher in SSBs than in LIBs due to interfacial reactions. The chemical evolution of key interfaces in SSBs has been extensively characterized. Electrochemically, however, we lack a versatile strategy for quantifying the reversibility of solid electrolyte (SE) redox for established and next-generation SSB electrolytes. In this work, we perform tailored electrochemical tests and operando X-ray diffraction to disentangle reversible and irreversible sources of capacity loss in positive electrodes composed of Li 6 PS 5 Cl SE, Li(Ni 0.5 Mn 0.3 Co 0.2 )O 2 (NMC), and carbon conductive additives. We leverage an atypically low voltage cutoff (2.0 V vs. Li/Li + ) to quantify the reversibility of SE redox. Using slow (5.5 mA g NMC −1 ) cycling paired with >100 h low-voltage holds, our cells achieve a surprising 96.2% first-cycle coulombic efficiency, which is higher than previously reported (mean: 72%, maximum: 91.6% across surveyed literature). We clarify that sluggish NMC relithiation kinetics have been historically mistaken for permanently irreversible capacity loss. In conclusion, through systematic decoupling of loss mechanisms, we uncover the unexpected reversibility of SE redox and isolate the major contributors to capacity loss, outlining a strategy for accurate assessment of next-generation SE materials and interface modifications.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2015

Investigation of photoresponse in cadmium sulfide nanoparticles

In this work, we report on the photo-response of CdS nanoparticles prepared by simple solid state reaction method. The X-ray diffraction (XRD) study has confirmed the formation of cubical zinc blende (c) phase. In the photo-response study, voltage dependence of photocurrent and darkcurrent as well as temporal rise and decay of photocurrent of CdS nanoparticles have been investigated. The photo-response of prepared sample has been measured under visible illumination using thick film of powder with out any binder. The photocurrent (I{sub pc}) and darkcurrent (I{sub dc}) follow power law with applied voltage i.e. I α V{sup r}. The rise and decay of photocurrent show negative photoconductivity.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Study of the properties of thin Li films and their relationship with He plasmas using ion beam analysis in the DIONISOS experiment

Plasma facing component (PFC) conditioning dramatically affects plasma performance in magnetic confinement fusion experiments. Lithium (Li) has been used in several machines to condition PFC with subsequent improvements to plasma performance. Multiple studies have investigated the interactions of Li with deuterium (D) and oxygen (O) in order to ascertain the mechanisms behind the enhanced plasma performance. Ion Beam Analysis (IBA) is a useful tool to interrogate PFC surfaces as they interact with plasmas. Dynamics of ion implantation and sputtering of surfaces (DIONISOS) is a linear plasma device, capable of generating discharges with fluxes ~10 21 m -2 s -1 and Te ~6 eV, coupled to an ion accelerator. DIONISOS is capable of analyzing samples using Elastic Recoil Detection (ERD) and Rutherford Backscattering Spectroscopy (RBS) during plasma exposures. The facility has been equipped with a Li deposition system for evaporation of thin coatings on different substrates. The evaporator enables real time ERD and RBS measurements of deposition and erosion of Li coatings on different substrates and the interaction of the Li with the vacuum and plasma. Considerations for ERD, e.g., ion species, energy, and data acquisition frequency, are presented. Furthermore, this work is the basis for further investigation of He, H, and D retention in solid and liquid Li.

47 OTHER INSTRUMENTATION↗
DOE OSTI2017

Three-dimensional stable lithium metal anode with nanoscale lithium islands embedded in ionically conductive solid matrix

Significance Lithium metal anode holds great promises for next-generation high-energy lithium battery systems. This work introduces an electrolyte-proof design of three-dimensional lithium metal anode where most of the lithium domains are embedded in a lithium-ion conductive matrix. In this architecture, the lithium-ion conductive matrix can isolate the embedded lithium domains from liquid electrolyte and thus prevent severe initial side reactions, while the matrix can simultaneously transport lithium ion and maintain the electrochemical activity of the embedded lithium. The design principle enables highly stable, high-power, and safe lithium metal anodes with minimal side reactions and negligible volume variation during cycling, which paves the way for viable lithium metal batteries in the future.

Lin, Dingchang↗
DOE OSTI2024

Triboplasma assisted chemical conversion in granular systems: a semi-analytic model

We present a semi-analytic model for a novel plasma-assisted chemical conversion pathway using triboplasmas generated in granular flows. Triboelectric charge relaxation is a well known phenomena where the potential generated from contact charging of particles exceeds the breakdown voltage of the background gas. In this work, we extend the triboelectric charge relaxation theory to include non equilibrium plasma energy and particle balance equations to predict the formation of dissociated and excited species that act as precursors to chemical conversion, for example in plasma-assisted ammonia synthesis. Our example case study with nitrogen background gas and teflon/aluminum tribomaterial system yielded high excited nitrogen species densities per collision that are comparable to current plasma-assisted conversion pathways. We also present a regime diagram for various gases where Paschen breakdown parameters are used to determine whether triboplasmas can be formed for a given effective work-function difference between two materials. Our sensitivity studies indicate particle velocity, particle radius, solids fraction and space charge effects play a critical role in overall plasma densities and excited species production.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2019

X-Ray Phase Contrast Imaging of Liquid Film and Spray Development Inside an Aircraft Engine Swirler

Modern aircraft engines combine liquid fuel and air using an intricate flow device with many fuel and air flow passages. To date, the process by which the fuel atomizes within this swirler set has not been examined directly due to optical access limitations. In this work, high-speed X-ray phase-contrast imaging of a liquid spray inside a gas turbine engine swirler geometry is presented. Measurements were carried out at the 7-BM beamline of the Advanced Photon Source at Argonne National Laboratory using the high-energy broadband X-ray beam. The synchrotron X-ray source provides the necessary photon energy and flux to capture time-resolved fluid phenomena within the confines of the relevant geometry while liquid and air are flowing. Spray nozzle hardware and geometries were provided by the National Jet Fuels Combustion Program (NJFCP), allowing for characterization of the spray using a commercially relevant configuration. Modified swirlers were three-dimensional printed with acrylic to improve imaging access while maintaining influential internal features. Water was used as a surrogate fluid for these studies to demonstrate the visualization capabilities. The experiments were conducted at atmospheric exit pressure conditions with a pressure drop of 6% across the swirler. High-speed imaging of the pilot spray cone revealed sheet breakup several millimeters downstream of the orifice exit, upon interaction with the radial assist air flow. These droplets and ligaments were observed to impinge on the inner filming surface of the swirler and flow toward the exit while developing a tangential flow. Under these conditions, the liquid film grows up to several hundred microns in thickness on the filming surface, and subsequently forms ligaments up to several millimeters in length before breaking up. This work demonstrates the capability of X-ray diagnostics in visualizing liquid flows within solid geometries of technical relevance. Furthermore, the spatial quantification of filming flows and liquid interaction with the swirler air provides validation data for modeling of the multiphase flows and surface interactions within the swirler.

Sforzo, Brandon A.↗
DOE OSTI2022

Alkali metal halide–coated perovskite redox catalysts for anaerobic oxidative dehydrogenation of n -butane

Oxidative dehydrogenation (ODH) of n-butane has the potential to efficiently produce butadiene without equilibrium limitation or coke formation. Despite extensive research efforts, single-pass butadiene yields are limited to <23% in conventional catalytic ODH with gaseous O 2 . This article reports molten LiBr as an effective promoter to modify a redox-active perovskite oxide, i.e., La 0.8 Sr 0.2 FeO 3 (LSF), for chemical looping–oxidative dehydrogenation of n-butane (CL-ODHB). Under the working state, the redox catalyst is composed of a molten LiBr layer covering the solid LSF substrate. Characterizations and ab initio molecular dynamics (AIMD) simulations indicate that peroxide species formed on LSF react with molten LiBr to form active atomic Br, which act as reaction intermediates for C–H bond activation. Meanwhile, molten LiBr layer inhibits unselective CO 2 formation, leading to 42.5% butadiene yield. The redox catalyst design strategy can be extended to CL-ODH of other light alkanes such as iso-butane conversion to iso-butylene, providing a generalized approach for olefin production.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

The AGHS at JET and preparations for a future DT campaign

The Active Gas Handling System (AGHS) at JET is a unique facility enabling JET to perform reactor like, DT operations. As a future DT experimental campaign (DTE2) is scheduled for 2017 this paper provides a brief overview of the AGHS and a summary of ongoing work supporting the currently JET experimental campaign. In order to improve tritium accountancy a solid state based detector for tritium is being developed. Another important upgrade concerns tritium injection, 4 existing GIMs (Tritium Gas Introduction Module) will inject a mix of D and T rather than T{sub 2} in the divertor region rather than in the torus mid plane enabling a far better control and variability of the introduction of tritium into the plasma. An overview of the scale of DTE2 is included as well as an example of some of the upgrades currently being undertaken to fully exploit the learning opportunities for ITER and DEMO DTE2 provides. (authors)

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2014

Novel Modified Optical Fibers for High Temperature In-Situ Miniaturized Gas Sensors in Advanced Fossil Energy Systems

This report covers the technical progress on the program “Novel Modified Optical Fibers for High Temperature In-Situ Miniaturized Gas Sensors in Advanced Fossil Energy Systems”, funded by the National Energy Technology Laboratory of the U.S. Department of Energy, and performed by the Materials Science & Engineering and Electrical & Computer Engineering Departments at Virginia Tech, and summarizes technical progress from July 1st, 2005 –June 30th, 2014. The objective of this program was to develop novel fiber materials for high temperature gas sensors based on evanescent wave absorption in optical fibers. This project focused on two primary areas: the study of a sapphire photonic crystal fiber (SPCF) for operation at high temperature and long wavelengths, and a porous glass based fiber optic sensor for gas detection. The sapphire component of the project focused on the development of a sapphire photonic crystal fiber, modeling of the new structures, fabrication of the optimal structure, development of a long wavelength interrogation system, testing of the optical properties, and gas and temperature testing of the final sensor. The fabrication of the 6 rod SPCF gap bundle (diameter of 70μm) with a hollow core was successfully constructed with lead-in and lead-out 50μm diameter fiber along with transmission and gas detection testing. Testing of the sapphire photonic crystal fiber sensor capabilities with the developed long wavelength optical system showed the ability to detect CO 2 at or below 1000ppm at temperatures up to 1000°C. Work on the porous glass sensor focused on the development of a porous clad solid core optical fiber, a hollow core waveguide, gas detection capabilities at room and high temperature, simultaneous gas species detection, suitable joining technologies for the lead-in and lead-out fibers and the porous sensor, sensor system sensitivity improvement, signal processing improvement, relationship between pore structure and fiber geometry to optical properties, and the development of a sensor packaging prototype for laboratory testing. Analysis and experiments determined that a bonding technique using a CO 2 laser is the most suitable joining technique. Pore morphology alteration showed that transmission improved with increasing annealing temperature (producing smaller pores), while the sensor response time increased and the mechanical strength decreased with increasing annealing temperature. Software was developed for data acquisition and signal processing to collect and interpret spectral gas absorption data. Gas detection on porous glass sensors was completed and the detection limit was evaluated using acetylene and was found to be around 1- 200ppm. A complete materials package for porous glass sensors was manufactured for testing.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Thermoelasticity Model for Niobium

Niobium is a polymorphic (multi-phase) material. Its phase diagram contains two experimentally confirmed solid phases, body-centered cubic (bcc) and orthorhombic Pnma, and is shown in Figs. 1 and 2. The bcc–Pnma phase boundary was determined in a recent work that combines experimental study by Errandonea et al. using laser-heated diamond anvil cell (DAC) and the theoretical calculation of the total free energies of both solid structures using the temperature dependent effective potential (TDEP) method which takes into account anharmonic lattice vibrations.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Basic Research of Intrinsic Tamper Indication Markings and Patterns Defined by Pulsed Laser Irradiation (Final Report)

Pulsed laser irradiation has been used to create complex, intrinsic markings that can be used as unique identifiers for authentication and asset protection. Markings have been made on the surface of various materials by rapidly scanning a focused laser beam across a designated area as large as several square inches. Markings include macro-scale patterns, such as barcodes, that contain encrypted information. More complex markings are comprised of macro-scale patterns and embedded, unique micro-scale features. Micro-scale features form spontaneously during scanned laser irradiation and have different shapes, spacings, color and other characteristics that are virtually impossible to recreate. The macro-scale patterns can be interrogated rapidly in the field using a digital camera, while the embedded micro-scale features are best evaluated in the laboratory using microscopy or related optical techniques. Interrogated markings are compared with archived maps of the original patterns (obtained at the time of their manufacture) to determine component authenticity. The majority of experiments have involved marking planar solids. A new instrument that marks non-planar substrates is described for future work.

36 MATERIALS SCIENCE↗