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At least 991 records · Page 55
All sourcesNASA NTRSDOE OSTI
DOE OSTI2014

Low electric-field driven ultrahigh electrostrains in Sb-substituted (Na,K)NbO{sub 3} lead-free ferroelectric ceramics

Lead-free (Na{sub 0.52}K{sub 0.48})(Nb{sub 1−y}Sb{sub y})O{sub 3} (NKNS{sub y}) ferroelectric ceramics were reported to exhibit an ultrahigh electrostrain (dynamic d{sub 33}* (=S/E) of 800–1100 pm/V) in a relatively low driving electric field range (1–4 kV/mm). As evidenced by in-situ synchrotron x-ray diffraction and dielectric measurements, the mechanism of generating large strains was ascribed to both the low-field induced reversible rhombohedral-monoclinic phase transition (1–2 kV/mm) and the enhanced domain switching (2–4 kV/mm) owing to the normal to relaxor phase transformation, which contribute to ∼62% and ∼38% of the total strain, respectively. The results indicate that the NKNS{sub y} compositions would have excellent potentials for applications of lead-free actuator ceramics.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Pressure, temperature, and electric field dependence of phase transformations in niobium modified 95/5 lead zirconate titanate

Ceramic niobium modified 95/5 lead zirconate-lead titanate (PZT) undergoes a pressure induced ferroelectric to antiferroelectric phase transformation accompanied by an elimination of polarization and a volume reduction. Electric field and temperature drive the reverse transformation from the antiferroelectric to ferroelectric phase. The phase transformation was monitored under pressure, temperature, and electric field loading. Pressures and temperatures were varied in discrete steps from 0 MPa to 500 MPa and 25 °C to 125 °C, respectively. Cyclic bipolar electric fields were applied with peak amplitudes of up to 6 MV m{sup −1} at each pressure and temperature combination. The resulting electric displacement–electric field hysteresis loops were open “D” shaped at low pressure, characteristic of soft ferroelectric PZT. Just below the phase transformation pressure, the hysteresis loops took on an “S” shape, which split into a double hysteresis loop just above the phase transformation pressure. Far above the phase transformation pressure, when the applied electric field is insufficient to drive an antiferroelectric to ferroelectric phase transformation, the hysteresis loops collapse to linear dielectric behavior. Phase stability maps were generated from the experimental data at each of the temperature steps and used to form a three dimensional pressure–temperature–electric field phase diagram.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2016

Investigate of atmospheric arsenic, cadmium, chromium, lead, and mercury levels in moss species found around Zilkale, by EDXRF Spectrometry

Zilkale is a castle located in Fırtına Valley and it is one of the most important historical structures in Çamlihemşin district of Rize Province in the Black Sea Region of Turkey. The castle surrounded by very high mountains that poke up into the clouds, and it rains here all year round. Tourism businesses or industrial plants are not so much there yet. In recent years, Zilkale region has begun the attract tourist, people on treaking holidays in the Kaçkar. But many domestic and foreign tourists come to this region by own car or tour buses. The aim of this study is to investigate the atmospheric concentrations of arsenic, cadmium, chromium, lead, and mercury levels in five different moss species collected around Zilkale by using Energy Dispersive X-ray Fluorescence (EDXRF) Spectrometry. The average concentrations of heavy metals in moss samples ranged from 0.79-4.63 ppm for arsenic, 54.47-143.39 ppm for chromium, 39.97-81.03 ppm for lead. The values of cadmium and mercury were found below the detection limit. This study has shown that Hypnum cupressiforme, Abietinella abietina, Rhytidium rugosum, Plagiomnium undulate, and Thuidium tamariscinum samples collected around Zilkale were used to assess the potential contamination of atmospheric As, Cd, Cr, Pb, Hg contamination in the region and made important contributions toward the understanding of atmospheric As, Cd, Cr, Pb, Hg baseline data can be used for identification of changes in the levels of these heavy metals in the studied area.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Giant strain with low cycling degradation in Ta-doped [Bi{sub 1/2}(Na{sub 0.8}K{sub 0.2}){sub 1/2}]TiO{sub 3} lead-free ceramics

Non-textured polycrystalline [Bi{sub 1/2}(Na{sub 0.8}K{sub 0.2}){sub 1/2}](Ti{sub 1−x}Ta{sub x})O{sub 3} ceramics are fabricated and their microstructures and electrical properties are characterized. Transmission electron microscopy reveals the coexistence of the rhombohedral R3c and tetragonal P4bm phases in the form of nanometer-sized domains in [Bi{sub 1/2}(Na{sub 0.8}K{sub 0.2}){sub 1/2}]TiO{sub 3} with low Ta concentration. When the composition is x = 0.015, the electrostrain is found to be highly asymmetric under bipolar fields of ±50 kV/cm. A very large value of 0.62% is observed in this ceramic, corresponding to a large-signal piezoelectric coefficient d{sub 33}* of 1240 pm/V (1120 pm/V under unipolar loading). These values are greater than most previously reported lead-free polycrystalline ceramics and can even be compared with some lead-free piezoelectric single crystals. Additionally, this ceramic displays low cycling degradation; its electrostrain remains above 0.55% even after undergoing 10 000 cycles of ±50 kV/cm bipolar fields at 2 Hz. Therefore, Ta-doped [Bi{sub 1/2}(Na{sub 0.8}K{sub 0.2}){sub 1/2}]TiO{sub 3} ceramics show great potential for large displacement devices.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2016

Morphotropic NaNbO{sub 3}-BaTiO{sub 3}-CaZrO{sub 3} lead-free ceramics with temperature-insensitive piezoelectric properties

A morphotropic NaNbO{sub 3}-based lead-free ceramic was reported to have temperature-insensitive piezoelectric and electromechanical properties (d{sub 33} = 231 pC/N, k{sub p} = 35%, T{sub c} = 148 °C, and low-hysteresis strain ∼0.15%) in a relatively wide temperature range. This was fundamentally ascribed to the finding of a composition-axis vertical morphotropic phase boundary in which coexisting ferroelectric phases are only compositionally driven and thermally insensitive. Both phase coexistence and nano-scaled domain morphology deserved well enhanced electrical properties, as evidenced by means of synchrotron x-ray diffraction and transmission electron microscopy. Our study suggests that the current lead-free ceramic would be a very promising piezoelectric material for actuator and sensor applications.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Structural and optical studied of nano structured lead sulfide thin films prepared by the chemical bath deposition technique

Lead (II) Sulfide PbS thin films were deposited on glass substrates at 25°C by chemical bath deposition (CBD) method. The structural properties of the films were studied as a function of the concentration of Thiourea (CS (NH{sub 2}){sub 2}) as Source of Sulfide and deposition time. The surface morphology of the films was characterized by X-ray diffraction and SEM. The obtained results showed that the as-deposited films Polycrystalline had cubic crystalline phase that belong to S.G: Fm3m. We found that they have preferred orientation [200]. Also the thickness of thin films decrease with deposition time after certain value and, it observed free sulfide had orthorhombic phase. Optical properties showed that the thin films have high transmission at visible range and low transmission at UV, IR range. The films of PbS have direct band gap (I.68 - 2.32 ev) at 300 K the values of band energy decreases with increases thickness of the Lead (II) Sulfide films.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2016

Thickness effect on the structure, grain size, and local piezoresponse of self-polarized lead lanthanum zirconate titanate thin films

Polycrystalline lanthanum lead zirconate titanate (PLZT) thin films were deposited on Pt/TiO{sub 2}/SiO{sub 2}/Si substrates to study the effects of the thickness and grain size on their structural and piezoresponse properties at nanoscale. Thinner PLZT films show a slight (100)-orientation tendency that tends to random orientation for the thicker film, while microstrain and crystallite size increases almost linearly with increasing thickness. Piezoresponse force microscopy and autocorrelation function technique were used to demonstrate the existence of local self-polarization effect and to study the thickness dependence of correlation length. The obtained results ruled out the bulk mechanisms and suggest that Schottky barriers near the film-substrate are likely responsible for a build-in electric field in the films. Larger correlation length evidence that this build-in field increases the number of coexisting polarization directions in larger grains leading to an alignment of macrodomains in thinner films.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2023

Potassium jarosite seeding of soils decreases lead and arsenic bioaccessibility: A path toward concomitant remediation

Soils are common sources of metal(loid) contaminant exposure globally. Lead (Pb) and arsenic (As) are of paramount concern due to detrimental neurological and carcinogenic health effects, respectively. Pb and/or As contaminated soils require remediation, typically leading to excavation, a costly and environmentally damaging practice of removing soil to a central location (e.g., hazardous landfill) that may not be a viable option in low-income countries. Chemical remediation techniques may allow for in situ conversion of soil contaminants to phases that are not easily mobilized upon ingestion; however, effective chemical remediation options are limited. Here, we have successfully tested a soil remediation technology using potted soils that relies on converting soil Pb and As into jarosite-group minerals, such as plumbojarosite (PLJ) and beudantite, possessing exceptionally low bioaccessibility [i.e., solubility at gastric pH conditions (pH 1.5 to 3)]. Across all experiments conducted, all new treatment methods successfully promoted PLJ and/or beudantite conversion, resulting in a proportional decrease in Pb and As bioaccessibility. Increasing temperature resulted in increased conversion to jarosite-group minerals, but addition of potassium (K) jarosite was most critical to Pb and As bioaccessibility decreases. Our methods of K-jarosite treatment yielded <10% Pb and As bioaccessibility compared to unamended soil values of approximately 70% and 60%, respectively. In conclusion, the proposed treatment is a rare dual remediation option that effectively treats soil Pb and As such that potential exposure is considerably reduced. Research presented here lays the foundation for ongoing field application.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Keldysh tuning of photoluminescence in a lead halide perovskite crystal

In 1964, Keldysh laid the groundwork for strong-field physics in atomic, molecular, and solid-state systems by delineating a ubiquitous transition from multiphoton absorption to quantum electron tunneling under intense AC driving forces. While both processes in semiconductors can generate carriers and result in photon emission through electron-hole recombination, the low quantum yields in most materials have hindered direct observation of the Keldysh crossover. Leveraging the large quantum yields of photoluminescence in lead halide perovskites, we show that we can not only induce bright light emission from extreme sub-bandgap light excitation but also distinguish between photon-induced and electric-field-induced processes. Our results are rationalized by the Landau-Dykhne formalism, providing insights into the non-equilibrium dynamics of strong-field light-matter interactions. These findings open new avenues for light upconversion and sub-bandgap photon detection, highlighting the potential of lead halide perovskites in advanced optoelectronic applications.

FOS: Physical sciences↗
DOE OSTI2025

Techno-Economic Analysis of Gas-Liquid Contactors for Tritium Extraction from Lead-Lithium

To enable a sustainable fuel cycle, any deuterium-tritium fusion reactor must breed its tritium fuel onsite. Lead-lithium (PbLi), a eutectic metal, is a leading liquid breeder material for tritium generation. One challenge with PbLi blanket technology is the extraction of tritium from the molten eutectic. Three technologies are the focus of worldwide research: the vacuum permeator, the vacuum sieve tray, and the gas-liquid contactor (GLC). The present work offers a methodology for designing, sizing, optimizing, and costing a trickle-bed GLC. Here, we analyzed tritium extraction from PbLi using MELODIE experimental data by applying traditional packed bed mass transfer efficiency models along with supplementary models, like film theory. Our analysis revealed that traditional packed bed mass transfer efficiency models do not fit the MELODIE loop experimental data. Moreover, uncertainty in PbLi solubility resulted in a 325-fold increase in required gas flow rates when comparing identical packing heights. The film theory liquid mass transfer coefficient, Delt-Olujic wettability model, and Reiter tritium solubility values fit the MELODIE data best and were used both in the design and to conduct the economic analysis. Techno-economic analysis of the GLC was performed to evaluate three design sizes, all achieving a minimum extraction efficiency of 90 [%] for a total tritium extraction of 31 [kg/yr].

Fusion Fuel Cycle↗
DOE OSTI2024

Tunneling magnetoresistance in MgO tunnel junctions with Fe-based leads in empirically corrected density functional theory

The minority-spin Fe/MgO interface states are at the Fermi level in density functional theory (DFT), but experimental evidence and GW calculations place them slightly higher in energy. This small shift can strongly influence tunneling magnetoresistance (TMR) in junctions with a thin MgO barrier and its dependence on the concentration of Co in the electrodes. Here, in this study, an empirical potential correction to DFT is introduced to shift the interface states up to match the tunnel spectroscopy data. With this shift, TMR in Fe/MgO/Fe junctions exceeds 800% and 3000% at 3 and 4 monolayers (ML) of MgO, respectively. We further consider the effect of alloying of the Fe electrodes with up to 30% Co or 10% V, treating them in the coherent potential approximation (CPA). Alloying with Co broadens the interface states and brings a large incoherent minority-spin spectral weight to the Fermi level. Alloying with V brings the minority-spin resonant states close to the Fermi level. However, in both cases the minority-spin spectral weight at the Fermi level resides primarily at the periphery of the Brillouin zone, which is favorable for spin filtering. Using convolutions of k II -resolved barrier densities of states calculated in CPA, it is found that TMR is strongly reduced by alloying with Co or V but still remains above 500% at 4 ML of MgO up to 30% of Co or 5% V. At 5 ML, the TMR increases above 1000% in all systems considered. However, while TMR declines sharply with increasing bias up to 0.2 eV in the tunnel junctions with pure Fe leads, it remains almost constant up to 0.5 eV if leads are alloyed with Co.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2018

Lead apatites: structural variations among Pb 5 ( B O 4 ) 3 Cl with B = P (pyromorphite), As (mimetite) and V (vanadinite)

The crystal structure of four Pb apatite samples, Pb 5 ( B O 4 ) 3 Cl, was refined with synchrotron high-resolution powder X-ray diffraction data, Rietveld refinements, space group P 6 3 / m and Z = 2. For this isotypic series, B = P 5+ is pyromorphite, B = As 5+ is mimetite and B = V 5+ is vanadinite. The ionic radius for As 5+ (0.355 Å) is similar to that of V 5+ (0.335 Å), and this is twice as large as that for P 5+ (0.170 Å). However, the c unit-cell parameter for mimetite is surprisingly different from that of vanadinite, although their unit-cell volumes, V , are almost equal to each other. No explanation was available for this peculiar c -axis value for mimetite. Structural parameters such as average $\langle$ B —O$\rangle$ [4], $\langle$Pb1—O 9 $\rangle$ [9] and $\langle$Pb2—O 6 Cl 2 $\rangle$ [8] distances increase linearly with V (the coordination numbers for the cations are given in square brackets). Mimetite has a short Pb2—O1 distance, so the O1 oxygen atom interacts with the 6 s 2 lone-pair electrons of the Pb 2+ cation that causes the Cl—Cl distance (= c /2) to increase to the largest value in the series because of repulsion, which causes the c -axis to increase anomalously. Although Pb apatite minerals occur naturally in ore deposits, they are also formed as scaly deposits in lead water pipes that give rise to lead in tap water, as was found recently in Flint, Michigan, USA. It is important to identify Pb-containing phases in water-pipe deposits.

chemistry↗
DOE OSTI2021

Structural Stability of Tin-Lead Halide Perovskite Solar Cells

One of the key features that makes halide perovskite solar cells such an attractive and intensely researched photovoltaic (PV) technology, is the tunability of the bandgap of these halide perovskite materials [1], [2]. Shortly after it was established that the bandgap could be increased to 1.7-1.8 eV, investigations into the application for silicon based tandem solar cells launched. Within a few years, conversion efficiencies of up to 28 % have been reported [3]. Concurrently, the interest in commercial application of this technology emerged and have rapidly increased. Whereas there are advantages to piggy backing on an established PV technology such as silicon, efforts to develop all-perovskite tandem solar cells are of considerable interest. Partly substituting the metal cation in the ABX3 perovskite enables the low bandgap absorbers required for an all-perovskite tandem solar cell. One common approach is to partially substitute the lead with tin, however these materials often suffered from poor stability. Therefore the development of an efficient, stable mixed tin-lead perovskite is key to enabling all-perovskite tandem solar cells.

degradation↗
DOE OSTI2014

SU-E-T-10: A Dosimetric Comparison of Copper to Lead-Alloy Apertures for Electron Beam Therapy

Purpose: To evaluate dosimetric differences of copper compared to conventional lead-alloy apertures for electron beam therapy. Methods: Copper apertures were manufactured by .decimal, Inc. and matching lead-alloy, Cerrobend, apertures were constructed for 32 square field sizes (2×2 – 20×20 cm{sup 2}) for five applicator sizes (6×6–25×25 cm{sup 2}). Percent depth-dose and off-axis-dose profiles were measured using an electron diode in water with copper and Cerrobend apertures for a subset of aperture sizes (6×6, 10×10, 25×25 cm{sup 2}) and energies (6, 12, 20 MeV). Dose outputs were measured for all field size-aperture combinations and available energies (6–20 MeV). Measurements were taken at 100 and 110 cm SSDs. Using this data, 2D planar absolute dose distributions were constructed and compared. Passing criteria were ±2% of maximum dose or 1-mm distance-to-agreement for 99% of points. Results: A gamma analysis of the beam dosimetry showed 93 of 96 aperture size, applicator, energy, and SSD combinations passed the 2%/1mm criteria. Failures were found for small field size-large applicator combinations at 20 MeV and 100-cm SSD. Copper apertures showed a decrease in bremsstrahlung production due to copper's lower atomic number compared to Cerrobend (greatest difference was 2.5% at 20 MeV). This effect was most prominent at the highest energies with large amounts of shielding material present (small field size-large applicator). Also, an increase in electrons scattered from the collimator edge of copper compared to Cerrobend resulted in an increased dose at the field edge for copper at shallow depths (greatest increase was 1% at 20 MeV). Conclusion: Apertures for field sizes ≥6×6 cm{sup 2} at any energy, or for small fields (≤4×4 cm{sup 2}) at energies <20 MeV, showed dosimetric differences less than 2%/1mm for more than 99% of points. All field size-applicator size-energy combinations passed 3%/1mm criteria for 100% of points. Work partially funded by .decimal, Inc. (Sanford, FL)

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2017

Chelate complexes of lead(II) with nitrilotris(methylenephosphonic) acid [Pb{μ"5-NH(CH_2PO_3H)_3}] and Na{sub 4}[Pb{sub 2}(H{sub 2}O){sub 2}{μ"3-N(CH_2PO_3)_3H_2}{sub 2}] · 10H{sub 2}O: Synthesis, structure, and asymmetry of lone 6s pair

Two complexes of Pb(II) with nitrilotris(methylenephosphonic) acid are synthesized and their crystal structures are determined. Nitrilotris(methylenephosphonato)lead(II) [Pb{μ"5-NH(CH_2PO_3H)_3}] is a coordination 3D polymer; space group Pī, Z = 2. The coordination polyhedron of Pb is a distorted pentagonal bipyramid with the N atom at one of the equatorial positions. Tetrasodium bis[aquanitrilotris(methylenephosphonatoplumbate( II)] decahydrate Na{sub 4}[Pb{sub 2}(H{sub 2}O){sub 2}{μ"3-N(CH_2PO_3)_3H_2}{sub 2}] · 10H{sub 2}O crystallizes in space group Pī, Z = 2. The degree of asymmetry of the coordination polyhedra of lead atoms characterizing the localization of the lone 6s electron pair is estimated.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Characteristics of Shock-Induced Dust Flux from the Surface of Lead and Copper Samples under Pressure in the Shock Wave of 45–50 GPa with Unloading into Vacuum

The results of experimental studies of the shock-induced particle ejection (“dusting”) from a free rough (R{sub z} = 20) surface of lead and copper samples into an evacuated medium are presented. The experimental methods were based on different physical principles. To determine the size of particles by shadow laser-optical imaging more efficiently, a narrow strip was isolated in the center of the free surface of a sample from which an optically transparent stream of particles was ejected. The rest of the surface, substantially larger in size, ejected particles, parameters of which were reliably recorded using optical heterodyne interferometry detection, radiographic imaging, and piezoelectric techniques. This made it possible to obtain more reliable data on the particle size distribution, the velocity of the front of a particle flux, and the density (weight) distribution of the flow in the direction of its motion, necessary to refine the existing models and create more reliable models to describe the phenomenon. Using lead and copper samples, the material of which melts or does not melt under shock wave loading in selected close conditions (amplitude of the shock wave and roughness of the free surface), made it possible to clearly demonstrate the effect of melting on the qualitative pattern and quantitative characteristics of the shock-induced dusting process.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Phase Transitions in Lead Hafnate under High Pressure

The effect of hydrostatic pressure on phase transitions in lead hafnate (PbHfO{sub 3}) has been studied by the methods of X-ray diffraction and X-ray diffuse scattering. The measurements were performed in the temperature range of 182 < T < 316°C and the pressure range of 1.6 < P < 2.6 GPa. Four regions characterized by different X-ray diffraction patterns and corresponding to an antiferroelectric phase, phases with a long-wavelength modulation of the lead sublattice, and phases with different distortions of the oxygen sublattice are identified. In the temperature region immediately above the region of phases with a long-wavelength modulation, a temperature-dependent maximum in the distribution of diffuse scattering was detected, which means that such a modulation is formed due to condensation of an incommensurate soft mode.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Synthesis and structure of undoped and indium-doped thermoelectric lead telluride nanoparticles

Undoped and indium (In)-doped lead telluride (PbTe) nanostructures were synthesized via solvothermal/hydrothermal route. The crystalline structure of the as-prepared undoped and In-doped PbTe samples was examined by X-ray diffraction (XRD) which indicated the formation of face-centered single-phase cubic crystal. A first principle calculation on indium doping shows that the indium atoms are more likely to replace lead (Pb) rather than to take the interstitial sites. Laser-induced breakdown spectroscopy (LIBS) analysis confirms that indium is incorporated into the PbTe matrix of the indium-doped PbTe samples. The effects of surfactant and synthesis temperature on the structure and morphology of the undoped PbTe were also investigated; it was found that PbTe nanostructures synthesized with the addition of surfactants exhibited uniform shapes and their size increased with the synthesis temperature.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗