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At least 1,459 records · Page 81
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

Structural, vibrational and morphological properties of layered double hydroxides containing Ni{sup 2+}, Zn{sup 2+}, Al{sup 3+} and Zr{sup 4+} cations

Layered double hydroxides are anionic clays with formula [M{sup II}{sub 1−x} M{sup III}{sub x}(OH){sub 2}]{sup q+}[A{sup n−}]{sub q/n}·mH{sub 2}O, finding possible uses as catalyst support, adsorbents and so on. In this paper, we address the phase formation of layered double hydroxides containing Ni{sup 2+}, Zn{sup 2+}, Al{sup 3+} and Zr{sup 4+} cations, namely, NiZn-Al, NiZn-AlZr and NiZn-Zr compositions obtained by the coprecipitation method. Such systems were characterized by X-ray diffraction, confirming the phase formation for NiZn-Al and NiZn-AlZr samples. Infrared and Raman spectroscopies elucidated the anion and water molecules occurrence in the interlayer. Nitrogen physisorption (BET method) determined the presence of pores and specific surface area. The isotherm shapes were Type IV, according to the IUPAC, and represent a mesoporous structure. A morphological study was performed by means of scanning and transmission electron microscopies, and particle size values of 120, 131 and 235 nm for NiZn-Al, NiZn-AlZr and NiZn-Zr, respectively, were determined. Thermogravimetric analysis of the decomposition of the systems revealed that their complete disintegration occurred at ~ 450 °C and resulted in mixed oxides.

36 MATERIALS SCIENCE↗
DOE OSTI2018

High temperature oxidation behavior of a high Al-containing ferritic heat-resistant stainless steel

Highlights: • Oxidation kinetics has been analyzed by discontinuous weighing. • Microstructure and phase composition of oxide films were investigated by SEM, EDS and XRD analysis. • The oxidation resistance of 1000 °C is obviously deteriorated comparing with that at 800 °C and 900 °C. • The oxidation mechanism has been discussed. - Abstract: The high temperature oxidation behavior of a high Al-containing ferritic heat-resistant stainless steel at temperatures of 800, 900, and 1000 °C in air were studied in isothermal oxidation tests. The results showed that the isothermal oxidation kinetic curves obtained at different temperatures followed the parabolic law, and the weight gain per unit at 1000 °C was significantly higher than that at 800 and 900 °C. The oxidation rate at 1000 °C was about three times faster than that at 800 and 900 °C. Continuous and compact multicomponent oxide films mainly composed of Cr{sub 2}O{sub 3}, Al{sub 2}O{sub 3}, spinel MnFe{sub 2}O{sub 4}, and MnCr{sub 2}O{sub 4} were obtained at 800 and 900 °C. The oxide film started delaminating at 1000 °C; the outer layer was composed of Cr{sub 2}O{sub 3}, spinel MnCr{sub 2}O{sub 4}, and MnFe{sub 2}O{sub 4}, the middle layer was composed of Fe{sub 2}O{sub 3} and Fe-Cr matrix, and the inner layer was composed of Al{sub 2}O{sub 3} and SiO{sub 2}. Oxidation resistance at 1000 °C was reduced mainly because of porous Fe{sub 2}O{sub 3} and inner oxidation of Al and Si. In addition, the oxidation mechanism was discussed based on kinetic and morphological observations.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Microstructure evolution and mechanical properties of magnesium alloys containing long period stacking ordered phase

Magnesium alloys containing rare earth (RE) in conjunction with other alloying elements, such as Zn, have drawn increasing interest due to their high strength, high ductility and high creep-resistance with the existence of long period stacking ordered (LPSO) phase. Although the LPSO phase has been studied over a decade, the question remains how it impacts the mechanical properties of Mg-RE-X alloys, where X represents a metallic element with its atomic radius smaller than Mg. This paper provides a tutorial review of the current status on the role of LPSO phase in manipulating the mechanical properties in Mg-RE-X based alloys, where some outstanding issues are also highlighted and discussed.

36 MATERIALS SCIENCE↗
DOE OSTI2018

A study of microstructure of Fe-Cu-Ni-Sn and Fe-Cu-Ni-Sn-VN metal matrix for diamond containing composites

Highlights: • A nanocrystalline sample of coarse-grained powders of iron, copper, nickel, tin was obtained. • The structure of the sample consists of a supersaturated solid solution of nitrogen and vanadium in α-Fe. • Grain refinement occurs as a result of the decomposition of supersaturated solid solution of nitrogen and vanadium in α-Fe. To obtain bulk of 51Fe–32Cu–9Ni–8Sn and 49.47Fe–31.04Cu–8.73Ni–7.76Sn–3VN nanocomposites, a pressing method at room temperature and subsequent hot pressing in a vacuum was used. The microstructure of the sintered composites by X-ray diffraction and transmission electron microscopy was investigated. It is shown that in the 49.47Fe–31.04Cu–8.73Ni–7.76Sn–3VN composite there was a dissolution of vanadium nitride in γ‑iron and formation of a supersaturated solid solution of nitrogen and vanadium in the α‑iron. As a result, there was a substantial grinding of ferrite grains (from 5 to 50 μm to 20–400 nm) as compared to a sample without vanadium nitride (from 5 to 50 μm to 400–800 nm). Nanocomposites are considered as promising materials to create a new generation of diamond containing composites.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2019

Effect of post annealing on microstructure and mechanical properties in Ni-free N-containing ODS steel

The precipitation behaviour of Y2O3 and MnO nanoparticles after isothermal treatment, in a Ni-free N-containing oxide dispersion strengthened (ODS) steel was studied by wide-angle X-ray scattering (WAXS), ultra-small-angle and small-angle X-ray scattering (USAXS/SAXS), small angle neutron scattering (SANS) and scanning transmission electron microscopy (STEM). Mechanical properties were investigated via tensile and micro-hardness testing. Additional precipitation occurred during annealing, in addition to the precipitates formed during sintering. The highest volume distribution of Y2O3, with average size of 6 nm, was determined by alloy contrast variation (ACV) analysis of SAXS and SANS for the sample annealed at 800 °C; this sample shows the highest hardness and ultimate tensile strength. Above that temperature, coarsening of both matrix and precipitates and depletion of nitrogen from matrix degraded the mechanical properties. The very fine nanoparticles and thermally induced dissolution of nitrogen influenced mechanical properties.

alloy contrast variation (ACV)↗
DOE OSTI2012

Electrical transport properties of manganese containing pyrochlore type semiconducting oxides using impedance analyses

Graphical abstract: DC conductivity variation of CaCe{sub 1−x}Mn{sub x}SnNbO{sub 7−δ} (x = 0, 0.2, 0.4 and 0.6) with inverse of temperature. Variation of conductivity with Mn concentration at 600 °C is shown in the inset. Display Omitted Highlights: ► We have observed that the structural ordering as well as grain size increase with Mn substitution. ► Impedance analysis proved that a correlated barrier hopping type conduction mechanism is involved in the materials. ► Activation energy as well as electrical conductivity increases with increase in Mn substitution. ► Localization of electrons associated with Mn{sup 2+} and structural ordering are the key factors for the increased activation energy with Mn substitution. ► All the materials showed good NTC thermistor properties. -- Abstract: A new series of manganese containing pyrochlore type semiconducting oxides CaCe{sub 1−x}Mn{sub x}SnNbO{sub 7−δ} (x = 0, 0.2, 0.4 and 0.6) have been synthesized to study the effect of Mn substitution on the structure, microstructure and electrical properties of these samples. X-ray diffraction and scanning electron microscopy studies revealed an increase of structural ordering and grain size respectively with increase of Mn substitution. Rietveld analysis and Raman spectroscopy were also employed to corroborate the XRD results. The bulk resistance measurements with temperature exhibit negative temperature coefficient behavior. The impedance analysis of the samples revealed a non-Debye type relaxation existed in the materials. The ac conductivity variation with temperature and frequency indicates a correlated barrier hopping type conduction mechanism in these materials. The barrier height and the intersite separation for hopping influence the electrical conductivity of these samples and are found to be a function of localization of electrons associated with the Mn{sup 2+} ions and the unit cell volume respectively. The Mn substitution increases both electrical conductivity and activation energy contrastingly. This unusual behavior has been explained by correlating the structure, microstructure, defect states, electron localization and intersite separation with the conductivity data of the samples.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Preparation of mesoporous CdS-containing TiO{sub 2} film and enhanced visible light photocatalytic property

Highlights: • Well-dispersed distribution of CdS nanoparticles inside of TiO{sub 2} mesoporous structures was fabricated. • The sensitization of CdS nanoparticles significantly extends the response of TiO{sub 2} mesoporous film in the visible region. • An improved visible light photocatalytic activity was observed by the CdS–MTF. - Abstract: Mesoporous TiO{sub 2} films containing CdS nanocrystals were successfully fabricated by a two-step process of successive ionic layer adsorption and reaction (SILAR) technique and a solvothermal method followed by annealing. The distribution of CdS nanoparticles in the inner structures of the TiO{sub 2} mesoporous films is confirmed by field emission scanning electron microscope. The CdS modification of the mesoporous films results in an increase in the visible light adsorption, and exhibits more excellent photocatalytic degradation of methyl orange (MO) under visible light irradiation.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Free-standing anode of N-doped carbon nanofibers containing SnO{sub x} for high-performance lithium batteries

Highlights: • Self-standing SnO{sub x} N-CNF electrodes were synthesized by electrospinning. • The SnO{sub x} N-CNFs anode exhibits high capacity, good cyclic stability, and excellent rate performance for lithium ion batteries. • The enhanced performance is ascribed to the synergetic effects between N-CNFs and SnO{sub x} nanoparticles. - Abstract: Free-standing paper of N-doped carbon nanofibers (NCNFs) containing SnO{sub x} was prepared by electrospinning. The structure and morphology of the sample were analyzed by XRD, XPS, SEM, and TEM. The results show that nitrogen atoms were successfully doped into CNFs. The SnO{sub x} were homogenously embedded in the N-doped CNFs via annealing treatment. Subsequently, the SnO{sub x} NCNF paper was cut into disks and used as anodes for lithium ion batteries (LIBs). The anodes of SnO{sub x} NCNFs exhibit excellent cycling stability and show high capacity of 520 mA h g{sup −1} tested at a 200 mA g{sup −1} after 100 cycles. More importantly, at a high current density of 500 mA g{sup −1}, a large reversible capacity of 430 mA h g{sup −1} after 100 cycles can still be obtained. The good electrochemical performance should be attributed to the good electronic conductivity from the NCNFs and the synergistic effects from NCNFs and SnO{sub x} materials.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Erbium-doped borosilicate glasses containing various amounts of P{sub 2}O{sub 5} and Al{sub 2}O{sub 3}: Influence of the silica content on the structure and thermal, physical, optical and luminescence properties

Highlights: • Er{sup 3+} doped borosilicate glasses were processed with different compositions and characterizations. • An increase in the SiO{sub 2} content leads to a silicate-rich environment around the Er{sup 3+} site. • An increase in the SiO{sub 2} content decreases the Er{sup 3+} absorption cross-section at 980 nm. • Glasses with 60 mol% of SiO{sub 2} exhibit a stronger emission intensity at 1530 nm than glasses with x = 50. • Highest 1.5 μm emission intensity was achieved for the Al and P containing glass with 60 mol% of SiO{sub 2}. - Abstract: The influence of the silica content on several properties of Er-doped borosilicate glasses in the presence of various amounts of P{sub 2}O{sub 5} and Al{sub 2}O{sub 3} has been investigated. The introduction of P{sub 2}O{sub 5} and/or Al{sub 2}O{sub 3} are responsible for structural modifications in the glass network through a charge-compensation mechanism related to the formation of negatively-charged PO{sub 4} and AlO{sub 4} groups or through the formation of AlPO{sub 4}-like structural units. In this paper, we show that an increase in the SiO{sub 2} content leads to a silicate-rich environment around the Er{sup 3+} site, resulting in an increased dependence of the Er{sup 3+} ions optical and luminescence properties on the P{sub 2}O{sub 5} and/or Al{sub 2}O{sub 3} concentration. The highest emission intensity at 1.5 μm was achieved for the glass with an equal proportion of P and Al in the glass system with 60 mol% of SiO{sub 2}.

36 MATERIALS SCIENCE↗
DOE OSTI2015

In situ phase transformation of Laves phase from Chi-phase in Mo-containing Fe–Cr–Ni alloys

For an in situ phase transformation of the Chi (χ) phase to the Laves phase we observed in a Fe–Cr–Ni–Mo model alloy. The morphology, composition, and crystal structure of the χ and Laves phases, and their orientation relationship with the matrix austenite phase were investigated. The resulted Laves phase has larger lattice mismatch with the matrix phase than the χ phase, leading to the increase of local strain fields and the formation of dislocations. Moreover, this finding is helpful to understand the precipitation behavior of the intermetallic phases in the Mo-containing austenitic stainless steels.

36 MATERIALS SCIENCE↗
DOE OSTI2021

High-performance multiblock PEMs containing a highly acidic fluorinated-hydrophilic domain for water electrolysis

The present paper describes the design and evaluation of novel hydrophilic–hydrophobic poly(arylene ether sulfone) (PAES) multiblock copolymers for their synergistic effects upon transport properties and their potential use in proton exchange membrane water electrolysis. The multiblock copolymers are prepared via a coupling reaction between (i) a hydrophilic segment consisting of a disulfonated quinone fluorinated biphenyl group that contains fluorine moieties next to the sulfonated groups to increase the acidity, and (ii) hydrophobic segments composed of non-sulfonated biphenyl sulfone to provide dimensional stability. Two different lengths (molecular weights; 5k and 10k, where k represents 10 3 g mol -1 ) of hydrophobic segments are used to investigate the effects of the membrane properties compared with those of Nafion® and PAES random copolymer (i.e., BPSH40). Atomic force microscopy images of the BPSH40 and multiblock membranes are shown to agree closely with a mesoscale simulation, thus confirming the importance of the morphological effect upon the transport properties. Furthermore, the multiblock copolymer with a higher proportion of hydrophilic segments (10 k–5k) was shown to provide enhanced performance (3.41 A cm -2 at 1.9 V) compared to the multiblock copolymer with equal proportions of hydrophilic and hydrophobic segments (10 k–10 k) due to the greater continuity of nano-sized ionic channels.

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

New sterically hindered polyvinylamine-containing membranes for CO 2 capture from flue gas

Amine-containing facilitated transport membranes can have both high permeability and selectivity due to the reversible reaction between CO 2 and amino groups for effective carbon capture from flue gas. In this study, we have developed an improved method for the synthesis of high-molecular-weight sterically hindered polyvinylamine (PVAm) as the new fixed-site carrier in thin-film composite membranes for CO 2 capture. Commercially available PVAm was N-monomethylated into poly-N-methyl-N-vinylamine (PVAm-CH 3 ) using the stepwise reductive amination with a highly polar fluorinated alcohol as the solvent to enhance the equilibrium shift to the formation of the imine intermediate. The method prevented over-alkylation, resulting in the increased yield of the target product. PVAm-CH 3 exhibited excellent CO 2 facilitation with a CO 2 permeability of 445.7 Barrer (1 Barrer = 3.349 x 10 –16 mol m m –2 s –1 Pa –1 ) and a CO 2 /N 2 selectivity of 70.3, which are above the Robeson 2008 upper bound. The PVAm-CH 3 solution retained a sufficiently high viscosity after incorporating the aminoacid salt, 2-(1-piperazinyl)ethylamine sarcosinate (PZEA-Sar), as the mobile carrier for the membrane coating on nanoporous polyethersulfone (PES) substrates without any penetration issues. The resultant thin-film composite PVAm-CH3/PZEA-Sar membrane with a thickness of approximately 170 nm exhibited a superior CO 2 performance of 1071 GPU (1 GPU = 3.349 x 10 –10 mol m –2 s –1 Pa –1 ) and a CO 2 /N 2 selectivity of 183 at 57°C and a feed gas pressure of 111.64 kPa (1.5 psig). This PVAm-CH 3 /PZEA-Sar membrane surpassed the latest redefined 2019 CO 2 /N 2 upper bound and outperformed other polymer-based membranes. Density functional theory calculations also demonstrated that PVAm-CH 3 showed a stronger preference, relative to PVAm, toward the more efficient bicarbonate pathway. Thus, the steric hindrance effect of PVAm-CH 3 enhanced the solubility of CO 2 in the polymer matrix and resulted in the higher CO 2 permeance.

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

Crowded electrolytes containing redoxmers in different states of charge: Solution structure, properties, and fundamental limits on energy density

Nonaqueous redox flow batteries use liquid electrolytes containing redox-active organic molecules (redoxmers) as their energy storage medium. To maximize energy density, the redoxmer concentration needs to be maximized while maintaining low viscosity and high ionic conductivity. During charge, a redoxmer molecule pairs with an ion in the electrolyte while another ion migrates across the membrane to maintain electric neutrality. In a crowded electrolyte, this reconstitution changes physical and chemical properties of the solution. To explore these behaviors, a phenothiazine redoxmer fully miscible with acetonitrile was used, and electrochemical charge was mimicked by chemical oxidation. The solutions were examined using small-angle X-ray scattering, nuclear magnetic resonance, and conductometry and modeled using classical molecular dynamics. Overall, our study indicates that physical and structural properties of redoxmer solutions in both states of charge make it exceedingly difficult to increase the redoxmer concentrations over 2 M at any temperature without compromising dynamic properties of such solutions. The cause for this limitation is proximity to a gel-like regime in which fluidity, diffusivity, and ionic conductivity exponentially decrease with increasing concentration. This tendency is compounded by non-Arrhenius behavior of the electrolyte: a small increase in the concentration outruns gains in fluidity and conductivity at a higher temperature. Thus the properties of crowded electrolytes generally make it impossible to operate when gel-like behavior sets in. Pushing the redoxmer concentration to 2.5-3 M might be possible for small redoxmer molecules, but it would require the use of ionic liquid electrolytes at 340-360 K. (C) 2021 Elsevier B.V. All rights reserved.

25 ENERGY STORAGE↗
DOE OSTI2022

Synthesis and characterization of magnetic ionic liquids containing multiple paramagnetic lanthanide and transition metal centers and functionalized diglycolamide ligands

Magnetic ionic liquids (MILs) containing paramagnetic centers have gained widespread recognition as sustainable solvents due to their ability to respond to an external magnetic field. The physico-chemical properties of MILs are dependent on the choice of anion/cation ligands and metal centers; the search for highly tunable ligands and precursors that can confer favorable characteristics, such as low viscosity, is ongoing. Diglycolamides employed as cationic ligands have been previously shown to form hydrophobic MILs that can simultaneously incorporate multiple lanthanide metal centers in both the anion/cation. Despite their enhanced magnetic susceptibility, the effect of diglycolamide chemical structure modifications on the physico-chemical properties of MILs has not been thoroughly studied. Additionally, the possibility of forming diglycolamide-based MILs with popularly employed transition metals has not been investigated and combinations that can simultaneously embed two different types of metal centers in both the anion/cation have not been explored. In this study, thirty (30) MILs comprised of lanthanide and transition metals were synthesized by examining their chelation to both straight-chained and branched diglycolamides. Here, transition metal-based MILs were found to possess high thermal stabilities up to 235 °C compared to 192 °C for those comprised of lanthanides. While MILs comprised of rare-earth metal centers exhibited the lowest viscosities, substituting lanthanides with transition metals in just the anion or cation resulted in enhanced thermal stability and reduced viscosity. The effective magnetic moment for these MILs varied between 4.71 and 21.08 µ B and was much higher compared to all previous classes of MILs prepared using the same metals. Results from this study explore all possible modifications that can be made to these MILs in an effort to demonstrate their structural tunability, which is often highly desirable in various applications, including organic synthesis and chemical separations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2017

Processability evaluation of a Mo-containing FeCrAl alloy for seamless thin-wall tube fabrication

The processability of a Mo-containing FeCrAl alloy (Fe-13Cr-5.2Al-2Mo base, in wt%), developed for accident-tolerant nuclear fuel claddings, was evaluated through a stepwise rolling process at 400 °C under two different inter-pass annealing conditions (i.e., 650 °C for 1 h and at 870 °C for 30 min). The inter-pass annealing at 870 °C easily softened the FeCrAl alloy; however, it led to the formation of coarse grains of ~200 µm. On the other hand, the FeCrAl alloy maintained elongated, deformed grains with the inter-pass annealing at 650 °C, but the annealed samples showed relatively high deformation resistance and strong texture. Important aspects concerning the processability and microstructural control of FeCrAl alloys, such as deformation inhomogeneity, texture development, and grain coarsening, were discussed. Optimized processing conditions were recommended, based on the results, to achieve desirable microstructures with balanced processability and mechanical properties.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Antibacterial dental adhesive resins containing nitrogen-doped titanium dioxide nanoparticles

The development of dental adhesive resins with long-lasting antibacterial properties is a possible solution to overcome the problem of secondary caries in modern adhesive dentistry.Objectives: (i) Synthesis and characterization of nitrogen-doped titanium dioxide nanoparticles (N_TiO 2 ), (ii) topographical, compositional and wettability characterization of thin-films (unaltered and experimental) and, (iii) antibacterial efficacy of N_TiO 2 -containing dental adhesives against Streptococcus mutans biofilms.Materials and methods: Nanoparticles were synthesized and characterized using different techniques. Specimens (diameter = 12 mm, thickness ≅ 15 μm) of OptiBond Solo Plus (Kerr Corp., USA) and experimental adhesives [50, 67 and 80% (v/v)] were fabricated, photopolymerized (1000 mW/cm 2 , 1 min) and UV-sterilized (254 nm, 800,000 μJ/cm 2 ) for microscopy, spectroscopy, wettability and antibacterial testing. Wettability was assessed with a contact angle goniometer by dispensing water droplets (2 μL) onto four random locations of each specimen (16 drops/group). Drop profiles were recorded (1 min, 25 frames/s, 37 °C) and contact angles were calculated at time = 0 s (θ INITIAL ) and time = 59 s (θ FINAL ). Antibacterial testing was performed by growing S. mutans (UA159-ldh, JM10) biofilms for either 3 or 24 h (anaerobic conditions, 37 °C) with or without continuous light irradiation (410 ± 10 nm, 3 h = 38.75 J/cm 2 , 24 h = 310.07 J/cm 2 ) against the surfaces of sterile specimens.Results: N_TiO 2 was successfully prepared using solvothermal methods. Doped-nanoparticles displayed higher light absorption levels when compared to undoped titania. Experimental adhesives demonstrated superior antibacterial efficacy in dark conditions.Conclusions: The findings presented herein suggest that N_TiO 2 is a feasible antibacterial agent against cariogenic biofilms.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Microstructural evolution and phase stability in Nb-containing interstitial Fe-Mn-Co-Cr-C high-entropy alloys: An in-situ synchrotron X-ray diffraction study during laser melting

The influence of Nb on phase stability and microstructural evolution in an interstitial Fe-Mn-Co-Cr-C high-entropy alloy was investigated using in-situ synchrotron X-ray diffraction (SXRD) during laser melting. Scheil-Gulliver simulations predict the formation of σ and γ-f.c.c. phases in all three alloys, along with NbC in Nb-containing compositions. SXRD confirmed the presence of most predicted phases, but the σ phase was absent. Nb promotes crystallite refinement and increases dislocation density, though excessive additions reduce refinement efficiency due to solubility limits and secondary phase formation. Furthermore, Nb addition also enhances ε-h.c.p. phase formation by reducing stacking fault energy through NbC-induced carbon depletion. Analysis of intensity peak evolution reveals that Nb alters preferred grain orientations, reducing {111} γ intensity while enhancing {220} γ , leading to a more isotropic grain distribution. Overall, Nb plays a key role in phase selection, microstructure refinement, and preferred orientation evolution, allowing the tailored microstructure of high-entropy alloys via rapid solidification.

Interstitial high entropy alloys↗
DOE OSTI2021

Incorporating bubble growth volume feedback to improve simulation of the response of a structure containing liquid and gas to sudden energy input

The SNS target module is a stainless-steel structure that contains and directs mercury. The mercury is struck with short, intense proton pulses to create neutrons. The pulses deposit energy and cause loads on the target structure and mercury cavitation. Helium bubbles are introduced into the mercury to reduce loads and cavitation. This gas complicates the prediction of the target module’s physical response. The current method used to simulate the structural response to the proton pulse incorporates a simple but effective approach to approximate mercury cavitation effects. This method cannot account for the changes from injected non-condensable gas. The ability to model the target vessel response is a prerequisite for estimating its life. Known approaches for simulating a bubbly fluid mixture’s response are computationally expensive and impractical for detailed engineering models. A constitutive model is proposed for target mercury with injected gas bubbles, with the intent of providing more accurate mercury–vessel response behavior without the computing costs required to track individual bubbles. The model’s assumptions and a computational model embodiment are described. The bubbly mercury computational model is subjected to test problems to assess its potential utility. Here, the model was able to better predict the effect of gas on wave propagation.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗