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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 685 records · Page 38
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

Trends in Hydrogen Evolution Activity of Metal-Modified Molybdenum Carbides in Alkaline and Acid Electrolytes

Relatively high surface area nanocrystalline molybdenum carbide (Mo 2 C) was modified with 5 w% silver, copper, nickel, platinum, and palladium nanoparticles and subsequently assessed for its hydrogen evolution reaction (HER) activity in alkaline and acid electrolytes. Density functional theory (DFT)-calculated hydrogen binding energies predicted that Pt–Mo 2 C and Pd–Mo 2 C should be most active, which was confirmed with experimental results. Similar activity trends were observed at both high and low pH values, with Cu–Mo 2 C being the least active. X-ray photoelectron spectroscopy (XPS) confirmed that metal particles remained on the sample before and after HER testing. Pt-modified nanocrystalline Mo 2 C showed superior HER activity compared with Pt-modified commercial Mo 2 C, making it a potential replacement for bulk Pt in alkaline membrane electrolyzers. Further, the positive effect on the HER activity of the metal contact with non-passivated Mo 2 C surfaces was also demonstrated.

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

Zeolitic-Imidazolate Framework Derived Intermetallic Nickel Zinc Carbide Material as a Selective Catalyst for CO 2 to CO Reduction at High Pressure

The conversion of CO 2 into CO is an important step in CO 2 utilization to achieve clean fuels and value-added chemicals. Herein, we explored the pyrolysis of zeolitic imidazolate framework-8 (ZIF-8) loaded with different amounts of Ni 2+ to obtain Ni-Zn carbide (Ni 3 ZnC) embedded in N-doped carbon. Ni is present in the intermetallic compound, while Zn excess remains on the N-doped carbon. The Ni 3 ZnC phase catalyzes the selective hydrogenation of CO 2 into CO via the reverse water gas shift reaction, reaching 100 % CO selectivity at ~30 % CO 2 conversion at 450 °C and atmosphere pressure (CO 2 :H 2 =1:4, GHSV=30000 mL g cat -1 h -1 ). The methanation reaction of CO 2 /CO, which is usually favored over Ni catalysts, is suppressed. The selectivity to CO at the expense of CH 4 is related to the stability of chemisorbed CO in the Ni 3 ZnC surface, which is lower compared to Ni surfaces. The Ni 3 ZnC@NC catalyst is selective towards CO over a wide range of conditions, including high pressure, that is usually required for the conversion of CO to hydrocarbons and alcohols via the Fisher-Tropsch synthesis (FTS) process. Contrarily, a classical Ni/SiO 2 catalyst prepared by impregnation produces CH 4 under high pressure.

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

Raman spectroscopy of neutron irradiated silicon carbide: Correlation among Raman spectra, swelling, and irradiation temperature

The effects of neutron irradiation on microstructural evolution and the resultant changes in physical and mechanical properties are of critical importance for the development of silicon carbide (SiC) materials for nuclear applications. This study neutron–irradiated β–SiC under a wide range of conditions at temperatures between 235 and 750°C and neutron doses of 0.01–11.8 displacements per atom, and then evaluated the effects on the SiC structure using Raman spectroscopy. The SiC optical phonon lines were shifted to lower wavenumbers by irradiation. Correlations were found among the wavenumber of the longitudinal optical phonon line, irradiation–induced swelling, and irradiation temperature. The peak shift also correlated indirectly with decreasing thermal conductivity of irradiated SiC. The irradiation–induced peak shift is explained by combinations of lattice strain, reduction of the elastic modulus, and other factors including decreasing coherent domain size. Lastly, these findings bridge irradiation–induced microstructural changes and property changes and illustrate how Raman spectroscopy is a useful tool for nondestructively assessing irradiated SiC materials for nuclear applications.

36 MATERIALS SCIENCE↗
DOE OSTI2012

Short-lived fission product measurements from >0.1 MeV neutron-induced fission using boron carbide.

A boron carbide shield was designed, custom fabricated, and used to create a fast fission energy neutron spectrum. The fissionable isotopes 233, 235, 238U, 237Np, and 239Pu were separately placed inside of this shield and irradiated under pulsed conditions at the Washington State University 1 MW TRIGA reactor. A unique set of fission product gamma spectra were collected at short times (4 minutes to 1 week) post-fission. Gamma spectra were collected on single-crystal high purity germanium detectors and on Pacific Northwest National Laboratory's (PNNL's) Direct Simultaneous Measurement (DSM) system composed of HPGe detectors connected in coincidence. This work defines the experimental methods used to produce and collect the gamma data, and demonstrates the validity of the measurements. It is important to fully document this information so the data can be used with high confidence for the advancement of nuclear science and non-proliferation applications. The gamma spectra collected in these and other experiments will be made publicly available at https://spcollab.pnl.gov/sites/gammadata or via the link at http://rdnsgroup.pnl.gov. A revised version of this publication will be posted with the data to make the experimental details available to those using the data.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2013

Fission Yield Measurements from Highly Enriched Uranium Irradiated Inside a Boron Carbide Capsule

A boron carbide capsule was previously designed and tested by Pacific Northwest National Laboratory (PNNL) and Washington State University (WSU) for spectral-tailoring in mixed spectrum reactors. The presented work used this B4C capsule to create a fission product sample from the irradiation of highly enriched uranium (HEU) with a fast fission neutron spectrum. An HEU foil was irradiated inside of the capsule in WSU’s 1 MW TRIGA reactor at full power for 200 min to produce 5.8 × 1013 fissions. After three days of cooling, the sample was shipped to PNNL for radiochemical separations and analysis by gamma and beta spectroscopy. Fission yields for products were calculated from the radiometric measurements and compared to measurements from thermal neutron induced fission (analyzed in parallel with the non-thermal sample at PNNL) and published evaluated fast-pooled and thermal nuclear data. Reactor dosimetry measurements were also completed to fully characterize the neutron spectrum and total fluence of the irradiation.

boron carbide↗
DOE OSTI2018

Physical and Mechanical Properties of W-Ni-Fe-Co Metal Foam Modified by Titanium Tungsten Carbide Alloying

The paper studies physical and mechanical properties of tungsten-nickel-iron-cobalt metal foam alloyed with titanium tungsten carbide. Test specimens are obtained by the liquid phase sintering of powder materials, including those containing tungsten nanopowders. High porosity metal foams are prepared through varying the porosity of powder specimens and the content of filling material. The penetration capability of cylinder projectiles made of new alloys is explored in this paper. It is shown that their penetration depth exceeds that of the prototype with relevant weight and size, made of tungsten-nickel-iron alloy, other factors being equal.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Silicon Carbide Formation Enhanced by In-Situ-Formed Silicon Nitride: An Approach to Capture Thermal Energy of CO-Rich Off-Gas Combustion

Carbothermic smelting of ores to produce metals or alloys in alternating current open/semiclosed and closed submerged arc furnaces, or in closed direct current furnaces, results in large volumes of CO-rich off-gas being generated. Most of the CO-rich off-gas is cleaned and flared on stacks, since the storing of large volumes is problematic due to the associated toxic and explosive risks. Flaring of CO-rich off-gas results in significant wastage of energy. In this study, an alternative method to partially capture the thermal energy associated with off-gas combustion, in the form of silicon carbide (SiC) generated from waste materials (quartz and anthracite fines), is proposed. SiC can partially replace conventional carbonaceous reductants used to produce alloys such as ferrochromium. The influences of quartz and anthracite particle size, treatment temperature, and gaseous atmosphere (nitrogen or air) on SiC formation were investigated. A quartz-anthracite mixture with 90 pct of the particles < 350.9 µm carbothermically treated at 1873.15 K (1600 °C) resulted in almost complete conversion of quartz to SiC in both nitrogen and air atmospheres. The study indicated significant potential for industrial application of the process.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Biocompatibility of Hydrogen-Diluted Amorphous Silicon Carbide Thin Films for Artificial Heart Valve Coating

Amorphous silicon carbide (a-SiC:H) thin films were synthesized using trichloromethylsilane by a hot wire chemical vapor deposition process. The deposited films were characterized by Fourier transform infrared spectroscopy (FTIR), Raman spectroscopy, x-ray diffraction and x-ray photoelectron spectroscopy to confirm its chemical bonding, structural network and composition of the a-SiC:H films. The optical microscopy images reveal that hydrogen dilution increased the surface roughness and pore density of a-SiC:H thin film. The Raman spectroscopy and FTIR spectra reveal chemical network consisting of Si-Si, C-C and Si-C bonds, respectively. The XRD spectroscopy and Raman spectroscopy indicate a-SiC:H still has short-range order. In addition, in vitro cytotoxicity test ensures the behavior of cell–semiconductor hybrid to monitor the proper coordination. The live–dead assays and MTT assay reveal an increase in green nucleus cell, and cell viability is greater than 88%, respectively, showing non-toxic nature of prepared a-SiC:H film. Moreover, the result indicated by direct contact assay, and cell prefers to adhere and proliferate on a-SiC:H thin films having a positive effect as artificial heart valve coating material.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Study on Microstructures and Mechanical Properties of Foam Titanium Carbide Ceramics Fabricated by Reaction Sintering Process

Foam titanium carbide (TiC) ceramics with a three-dimensional network structure were fabricated by the reaction sintering process, in which polyurethane foam was taken as the template, and TiO{sub 2} and phenolic resin were used as the reactants. Phase, microstructures and fracture morphologies of foam TiC ceramics were characterized by x-ray diffraction (XRD) and scanning electron microscopy (SEM), respectively. The results show that when the mass ratios of phenolic resin and TiO{sub 2} (F/T) are (0.8-1.2): 1, foam TiC ceramics with pure TiC phase can be formed. As the F/T ratios increase, crystal lattice parameters of fabricated foam TiC ceramics become bigger. When the value of F/T decreases from 1.2 to 0.8, grain size of TiC grows larger and microstructures get denser; meanwhile, the compressive strength increases from 0.10 to 1.05 MPa. Additionally, either raising the sintering temperatures or extending holding time can facilitate the completion of the reaction process and increase the compressive strength.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Nanostructured CVD Tungsten Carbide Coating on Aircraft Actuators and Gearbox Shafts Reduces Oil Leakage and Improves Durability

Wear and corrosion of aircraft actuator parts, helicopter gearbox rotating shafts and wear of seals working against these parts can lead to oil leaks which require expensive maintenance and increase the risk of failure. The Hardide® nanostructured chemical vapor deposition (CVD) Tungsten Carbide coating was tested on metal parts working against seals as an approach to reduce oil leakage from gearboxes and actuators and increase maintenance intervals. The coating protects metal pistons and shafts from abrasion and corrosion, keeping their surface roughness parameters within optimum ranges for longer; this reduces seal wear and makes the whole unit more durable and reliable. The 50-100 micron-thick CVD Hardide coating can be applied uniformly on internal and external surfaces and has enhanced fatigue and anti-galling properties. The coating has high wear resistance outperforming Hard Chrome by 14 times and Thermal Spray WC-Co (12%) by three times. The fine-grain coating nanostructure wears uniformly so even worn Hardide coating shows no hard micro-grain asperities which are abrasive for seals. The coating is free from porosity and from Cobalt binder and is an effective barrier against corrosion. As a result the coating keeps the optimal seal-friendly surface finish for longer even in abrasive and corrosive environments. The coating was qualified by Airbus as an environmentally friendly replacement for Hard Chrome plating.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Shock-induced amorphization in silicon carbide

While silicon carbide (SiC) has been predicted to undergo pressure-induced amorphization, the microstructural evidence of such a drastic phase change is absent as its brittleness usually prevents its successful recovery from high-pressure experiments. In this paper we report on the observation of amorphous SiC recovered from laser-ablation-driven shock compression with a peak stress of approximately 50 GPa. Transmission electron microscopy reveals that the amorphous regions are extremely localized, forming bands as narrow as a few nanometers. In addition to these amorphous bands, planar stacking faults are observed. Large-scale non-equilibrium molecular dynamic simulations elucidate the process and suggest that the planar stacking faults serve as the precursors to amorphization. Finally, our results suggest that the amorphous phase produced is a high-density form, which enhances its thermodynamical stability under the high pressures combined with the shear stresses generated by the uniaxial strain state in shock compression.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Insight into the synergistic effect between nickel and tungsten carbide for catalyzing urea electrooxidation in alkaline electrolyte

Tungsten carbide modified nickel (Ni-WC/C) catalyst is synthesized through the sequential impregnation method and evaluated for the electrooxidation of urea in alkaline electrolyte. Both the activity and stability of Ni are enhanced by the introduction of WC. In situ Fourier transform infrared (FTIR) measurements combined with electrochemical analysis were used to provide a better understanding of the mechanism for urea electrooxidation on the Ni-based catalysts. The formation of CO 2 and NCO – species is detected during urea oxidation, and the synergistic effect resulting from the interaction of Ni and WC is also proposed. The Ni-WC/C electrode contributes to the improved C–N bond cleavage in urea than that on Ni/C, resulting in a higher activity. Furthermore, the introduction of WC also enhances the anti-poisoning ability, thus promoting more complete oxidation of urea to produce CO 2 , which leads to a higher energy conversion efficiency than that on Ni/C. In conclusion, this work provides a new strategy for designing highly efficient catalysts for urea electrooxidation.

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

X-ray photoelectron spectroscopy of select multi-layered transition metal carbides (MXenes)

A detailed high resolution X-ray photoelectron spectroscopy (XPS) analysis is presented in this work for select MXenes—a recently discovered family of two-dimensional (2D) carbides and carbonitrides. Given their 2D nature, understanding their surface chemistry is paramount. Thus we identify and quantify the surface groups present before, and after, sputter-cleaning as well as freshly prepared vs. aged multi-layered cold pressed discs. The nominal compositions of the MXenes studied here are Ti 3 C 2 T x , Ti 2 CT x , Ti 3 CNTx, Nb 2 CT x and Nb 4 C 3 T x , where T represents surface groups that this work attempts to quantify. In all the cases, the presence of three surface terminations, single bondO, single bondOH and single bondF, in addition to OH-terminations relatively strongly bonded to H 2 O molecules, was confirmed. Moreover, from XPS peak fits, it was possible to establish the average sum of the negative charges of the terminations for the aforementioned MXenes. Based on this work, it is now possible to quantify the nature of the surface terminations. This information can, in turn, be used to better design and tailor these novel 2D materials for various applications.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Zirconium-diboride silicon-carbide composites: A review

Zirconium diboride (ZrB 2 ) and silicon carbide (SiC) composites have long been of interest since it was observed that ZrB 2 improved the thermal shock resistance of SiC. However, processing of these materials can be difficult due to high and different sintering temperatures and differences in the thermodynamic stability of each material. ZrB 2 –SiC composites have been processed in a variety of ways including hot-pressing, spark-plasma sintering, reactive melt infiltration, pack cementation, chemical vapor deposition, chemical vapor infiltration, stereolithography, direct ink writing, selective laser sintering, electron beam melting, and binder jet additive manufacturing. Each manufacturing method has its own pros and cons. This review serves to summarize more than 60 years of research and provide a coherent resource for the variety of methods and advancements in development of ZrB 2 –SiC composites.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Development of a silicon carbide ceramic based counter-flow heat exchanger by binder jetting and liquid silicon infiltration for concentrating solar power

A silicon carbide ceramic counter-flow heat exchanger with integrated headers was printed by binder jetting additive manufacturing process. Multiple phenolic binder infiltration cycles (3 or 5) followed by pyrolysis were conducted to increase the net carbon content of the printed SiC specimens. Subsequently, to attain full densification, silicon melt infiltration was used. The microstructure and mechanical properties were comprehensively characterized on the densified material. The chemical compositions and visual distribution of the various regions in the specimens were determined via scanning electron microscopy, while X-ray diffraction and synchrotron µ-computed tomography were used to provide a quantitative assessment of the volume fractions of the identified phase regions. Microhardness measurements showed dependence on the local microstructure. The fracture strength of the material was correlated with the specimen density and agreed with the reported values in the literature. High-temperature exposure at 750 °C for up to 200h did not degrade the strength for the specimens with three phenolic-binder infiltrations; however, the strengths degraded for ones with five phenolic-binder infiltrations. The associated fracture toughnesses of the specimens were ~3.4 MPam 1/2 at room temperature and 750°C, and the thermal conductivities varied from >150 W/mK at room temperature to ~45 W/mK at 750°C. Hence, this study validated the use of the binder-jetting printed SiC ceramic materials for high-temperature heat exchanges. Lastly, we also present in this work the first successful fabrication of a binder-jetting printed one-piece dense SiC ceramic heat exchanger body with unblocked channels that can be used for the flow of heat transfer fluids.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Exploring laser-material interactions of zirconium carbide under additive manufacturing conditions

Zirconium carbide (ZrC) is an ultra-high temperature ceramic with a melting temperature above 3000°C and a broad range of high temperature applications. Given the high melting and sintering temperatures of pure ZrC, producing near-net shape and fully dense parts remains challenging with conventional techniques. In this study, we investigate the fundamental laser-material interactions of ZrC under laser powder bed fusion (LPBF) additive manufacturing (AM) conditions. Normalized enthalpy, a scaling law term that is used in welding and AM literature for detailing laser-material interactions in metallic alloys, was calculated to determine the predictive capabilities of melt pool features in ZrC. Further, the melt pool quality of laser irradiated ZrC was used to compare LPBF relevant laser parameter combinations of laser power, scan speed, and beam diameter. Laser build parameters that resulted in desirable melt pool morphologies were applied to the fabrication of ZrC coupons using LPBF AM. A custom LPBF system was used to determine hatch spacing and layer height parameters that resulted in a fabricated sample with a density of 85% as measured by Archimedes and a Vicker's microhardness of 20.9 ± 1.9 GPa. This investigation reveals the laser-material interactions of ZrC under AM relevant conditions and is the first step towards LPBF fabrication of ZrC parts.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Grinding of additively manufactured silicon carbide surfaces for optical applications

Many of the properties of Silicon carbide (SiC) are advantageous for optical applications, such as telescope mirrors and industrial laser systems. However, the base shapes of complex components are costly and difficult to manufacture. Leveraging additive manufacturing, near net complex components are readily processed. In this work, we investigate the post processing of additively manufactured SiC (AM SiC) compared to chemical vapor deposited (CVD) SiC. The specific grinding energy for the AM SiC was lower than CVD, however the trends were the same. A specular finish was observed on both materials but the AM SiC finish was limited due to residual porosity.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Reveal the fast and charge-insensitive lattice diffusion of silver in cubic silicon carbide via first-principles calculations

The lattice diffusion of silver with various charge states in cubic silicon carbide has been investigated by means of high-fidelity spin-polarized density functional theory calculations. The migration energy barrier of the Ag interstitial diffusion is 1.09 eV and 1.11 eV for neutral and q = +1e charge state, respectively, close to the activation energy of Ag diffusion measured in the German HTR fuel program. A general trend is that the migration energy barrier reduces with respect to the increase of charge on Ag, which is much less than the increment in the oxidation energy, suggesting that the lattice diffusion of silver prefers constant neutral state without redox in transition state. Furthermore, our results indicate a scenario that once Ag is deposited to interstitials via the kickout mechanism, it will highly likely perform lattice diffusion across the SiC layer leading to fast release of Ag in Tristructural-Isotropic fuel induced by irradiation.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗