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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 541 records · Page 30
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

A Compact Fusion–Fission Hybrid Reactor

Up today, two hyper research projects to achieve nuclear fusion energy exist; inertial confinement fusion (ICF) driven by laser, called national ignition facility (NIF) and magnetic confinement fusion the international thermonuclear experimental reactor (ITER) project. In reaching the required temperature and pressure, to ignite nuclear fusion reactor, is technologically complex and economically expensive. Thus, a breakthrough and a short cut, other alternative methods should be considered. Pulsed power ICF driver with repetitive pulse operation, mainly dense plasma focus (DPF) machines for high yield fusion neutrons could be taken as drivers for the fission blanket operation. The setup can be a cost-effective and efficient. In this article, we consider a set of two medium energy sizes DPF to produce simultaneously dense plasma columns, operating as thermonuclear plasma driver, to pierce the pellet target for external nuclear fusion reactions. These DPFs produce sufficient fast neutrons for the fission process in the neutral uranium or thorium and/or weak enriched uranium blanket. The drive systems and the concept for delivering thermonuclear plasma to pellets target in the magnetic free zone of central region will be presented. The feasibility of such fusion–fission hybrid reactor will be discussed.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2019

Unconventional Energy Resources: 2017 Review

This review presents six summaries for energy resource commodities including coal and unconventional resources, and an analysis of energy economics and technology for the different commodities, as prepared by the Energy Minerals Division of the American Association of Petroleum Geologists. Unconventional energy resources, as defined in this report, are those energy resources that do not occur in discrete oil or gas reservoirs held within stratigraphic and/or structural traps of sedimentary basins. As defined, such energy resources include coal, coalbed methane (CBM), tight gas and liquids, bitumen and heavy oil, uranium (U), thorium (Th), and associated rare earth elements of interest to industry, and geothermal. Current North American and global research and development activities are summarized for each of the unconventional energy resource commodities in separate topical sections of this report.

58 GEOSCIENCES↗
DOE OSTI2012

Radioactivity in smoke particulates from prescribed burns at the Savannah River Site and at selected southeastern United States forests.

In this study we compare airborne radionuclide concentrations during prescribed burns at the Savannah River Site (SRS) and a sample of forests in the Southeastern United States. The spatial trends of airborne radionuclide concentrations from prescribed burn areas at SRS are also characterized. Total suspended particulate (TSP) samples were taken at three settings (subsequently termed burn sample populations): during prescribed burns at SRS (n = 34), on nonburn days at SRS (n = 12) and during prescribed burns at five offsite locations in the Southeastern United States (n = 2 per location). Mass concentrations of TSP were calculated and alpha, beta and gamma spectroscopy was performed to determine radionuclide activity concentrations. Spatial correlation in radionuclide concentration was assessed and ordinary kriging was used to create continuous surface maps across our study area. Median activity concentrations of natural radionuclides including {sup 40}K, thorium and uranium isotopes (n = 34) were higher in samples from SRS prescribed fires (p < 0.02) compared to offsite locations (n = 10) and nonburn days (n = 12). Median gross beta activity was also higher at SRS (p < 0.0001). Median concentrations of anthropogenic radionuclides did not significantly differ among burn sample populations except for {sup 238}Pu (p = 0.0022) and {sup 239,240}Pu (p = 0.014) with median concentrations of 8.41 x 10{sup -4} and 6.72 x 10{sup -5} pCi m{sup -3} at SRS compared to 1.55 x 10{sup -4} and -7.07 x 10{sup -6} pCi m{sup -3} (nonburn days) and 1.46 x 10{sup -4} and 2.78 x 10{sup -6} pCi m{sup 3} (offsite burns) respectively. Results from our spatial analysis found that only {sup 40}K demonstrated significant spatial correlation (X{sup 2} = 15.48, p = 0.0004) and spatial trends do not appear to directly link areas with higher activity concentrations with SRS facilities.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2024

Optimizing iodine adsorption in functionalized metal-organic frameworks via an unprecedented positional isomerism strategy

Porous metal–organic frameworks (MOFs) have emerged as highly promising adsorbents for capturing radioiodine, a predominant fission product released during nuclear fuel reprocessing. However, systematic investigations into the correlation between MOF structure and iodine uptake capacity remain scarce. Here, we present a novel approach to enhance the iodine adsorption capacity of MOFs by optimizing linker functionalization. Using ligand-functionalized thorium-based MOFs as a structural platform, we demonstrate that ortho-amino-substitution near the node of the dicarboxylate linker significantly increases iodine adsorption capacity compared to meta-amino-substitution, where the amino groups are directed away from the node. Specifically, ortho-substituted Th-UiO-68-3,3”-(NH 2 ) 2 exhibits higher iodine uptake capacities than the meta-substituted Th-UiO-68-2,2”-(NH 2 ) 2 via both vapor diffusion-based (2.042 vs. 1.087 g/g) and solution-based (0.841 vs. 0.784 g/g) processes. Notably, the I 2 vapor adsorption capacity (2.042 g/g) of Th-UiO-68-3,3”-(NH 2 ) 2 represents the second highest among all reported Th-MOFs. Pair distribution function (PDF) studies reveal that the superior iodine uptake performance of ortho-functionalized MOFs can be attributed to the reduced steric hindrance of the amino groups compared with the meta-substituted variants. Finally, this research highlights how positional isomerism and its subtle alterations can significantly influence host–guest interactions, extending beyond simple structural considerations.

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

Effects of the background electrolyte on Th(IV) sorption to muscovite mica

The adsorption of tetravalent thorium on the muscovite mica (001) basal plane was studied by X-ray crystal truncation rod (CTR), and resonant anomalous X-ray reflectivity (RAXR) measurements and alpha spectrometry in the presence of perchlorate background electrolytes LiClO 4 , NaClO 4 , and KClO 4 ([Th(IV)] = 0.1 mM, I = 0.1 M or 0.01 M, pH = 3.3 ± 0.3). RAXR data directly reveal a strong influence of the background electrolyte on the actinide sorption. No significant Th adsorption was observed in 0.1 M NaClO 4 , i.e., the Th coverage θ(Th), the number of Th per unit cell area of the muscovite surface (A UC = 46.72 Å 2 ), was ≤ 0.01 Th/A UC , whereas limited uptake (θ(Th) ~ 0.04 Th/A UC ) was detected at a lower ionic strength (I = 0.01 M). These results are in stark contrast to the behavior of Th in 0.1 M NaCl which showed a coverage of 0.4 Th/A UC (Schmidt et al., 2012a). Th uptake was also influenced by the electrolyte cation. Weak adsorption was observed in 0.1M KClO 4 (θ(Th) ~ 0.07 Th/AUC) similar to the results in NaClO 4 at lower ionic strength. In contrast, strong adsorption was found in 0.1 M LiClO 4 , with θ(Th) = 4.9 Th/A UC , a ~10-fold increase compared with that previously reported in NaCl. These differences are confirmed independently by ex situ alpha spectrometry, which shows no measurable Th coverage in 0.1 M NaClO 4 background in contrast to a large coverage of 1.6 Th/A UC in 0.1 M LiClO 4 . The CTR/RAXR analyses of Th-LiClO 4 show the sorption structure consisting of Th species that are broadly distributed, centered at heights of 4.1 Å and 29 Å distance from the interface. Neither the very large distribution height of the second species nor the high coverage can be explained with (hydrated) ionic adsorption, suggesting that the enhanced uptake is presumably due to the formation and sorption of Th nanoparticles.

interfacial reactivity↗
DOE OSTI2019

Selective capture of radionuclides (U, Pu, Th, Am and Co) using functional nanoporous sorbents

Using our self-assembled silanol technology, we developed eight functional nanoporous silica sorbents for capturing two classes of radionuclides: the actinide uranium (U), thorium (Th), plutonium (Pu), americium (Am) and the transition metal cobalt (Co). We tested them in sea, ground, and river water that were adjusted to pH 0-8.0 and doped with competing metals (Mg, Ca, K, Se, Mn, Fe, Co, Cu, Zn, and Mo) at levels encountered in environmental or physiological samples. Sorbents having three analogs of hydroxypyridinones (HOPO) and acetamide phosphonate (Ac-Phos) were exceptional at capturing U, Th, and Pu from pH 2.0 to 8.0, and very good at capturing Am from pH 5.0 to 8.0 with the affinity ranged from 3,4-HOPO > 1,2-HOPO > 3,2-HOPO > Ac-Phos. However, the affinity is reversed at near zero pH. For capturing Co, a family of glycine derivatives on nanoporous silica has been developed and the affinity for Co ranged from IDAA ~ DE4A > ED3A between pH 5.0-8.0. Our materials significantly outperformed the commercially available cation sorbents such as Chelex-100 and activated carbon in terms of binding affinity and rate; thus demonstrating great potential to be used as decorporation agents for water treatment and recovery of valuable actinides.

uranium (U), thorium (Th), plutonium (Pu), americi↗
DOE OSTI2018

Trace element migration during UF4 bomb reduction: Implications to metal fuel production, worker health and safety, and nuclear forensics

Understanding the migration of trace contaminants during the production of U metal is vital for fabricating advanced nuclear fuels, for managing worker health and safety at foundry and processing facilities, and for advancing nuclear forensic science. A common method used to produce actinide metals is the bomb reduction of suitable U precursors. Here, we report the results of a series of experiments designed to quantitatively track the trace contaminants Th, Ca, and, Mg through a bomb reduction of UF4 using a vacuum induction furnace. In this series, UF4 charges were doped with increasing levels of elemental Th from 0-1000 ppm Th/U. Following reduction, the metal ingot products and the associated slag and crucibles were individually digested and analyzed using inductively coupled plasma-mass spectrometry. The results show that Th fractionation occurred at all concentrations but was most significant, and near quantitative, in samples starting with Th concentrations below 100 ppm. Thorium was found to incorporate into the slag and crucible in roughly equal proportions. A significant amount of U and Ca migrated into the crucible walls, each correlated with Mg migration from the MgO crucible to the U metal product.

Reilly, Dallas D.↗
DOE OSTI2023

A laboratory-scale process for producing dilithium beryllium tetrafluoride (FLiBe) with dissolved uranium tetrafluoride

Flibe Energy, Incorporated (FEI)'s conceptual Lithium Fluoride Thorium Reactor (LFTR) incorporates a chemical processing facility aimed at recovering uranium and other valuable volatile radionuclides while managing harmful radionuclides from the used fuel. The fuel utilized in this reactor is a combination of dilithium beryllium tetrafluoride (Li 2 BeF 4 or FLiBe) and uranium tetrafluoride (UF 4 ), (FLiBe/U). FEI's plan involves extracting the uranium and other valuable volatile fluoride-forming radionuclides using nitrogen trifluoride (NF 3 ). To facilitate laboratory-scale testing of uranium extraction using NF 3 and address the toxicity and physical hazards associated with beryllium and beryllium fluoride (BeF 2 ), we used a two-step process to prepare the simulated fuel salt. The first step entailed thermally decomposing ammonium beryllium tetrafluoride [(NH 4 ) 2 BeF 4 ] (ABeF) through a nominal 3-step process, combined with appropriate amounts of lithium fluoride (LiF) and UF 4 , resulting in the formation of beryllium fluoride (BeF 2 ). In the second step, the mixture was repeatedly melted and frozen at the melting point of FLiBe to prepare the eutectic FLiBe with dissolved UF 4 . Although the concept appears straightforward, the production of FLiBe/U involved various challenges. These challenges included transporting the gaseous decomposition products of ABeF, hydrogen fluoride (HF) and ammonia (NH 3 ), while preventing the formation of ammonium fluoride (NH 4 F). Additionally, it was necessary to control the reaction between the higher-than-anticipated water content in the commercial ABeF with NH 3 , HF, and the condensed NH 4 F, protect UF 4 from forming an unknown black compound, select suitable structural materials to mitigate fluoride corrosion, address the risks associated with beryllium toxicity through equipment design and operational protocols, and monitor process conditions. This article provides an account of the thermal decomposition chemistry observed in the commercial ABeF, describes the FLiBe/U production apparatus, describes the experiences and process refinements developed to prepare FLiBe/U, and presents our characterizations of prepared FLiBe/U.

Ammonium beryllium fluoride thermal decomposition↗
DOE OSTI2024

Phonon modal analysis of thermal transport in ThO 2 with point defects using equilibrium molecular dynamics

Defects can significantly degrade the thermal conductivity of ThO 2 , an advanced nuclear fuel material as well as a surrogate for other fluorite-structured materials. Here, we investigate how point defects in ThO 2 impact phonon mode-resolved thermal transport. By incorporating phonon modes from lattice dynamics, we decompose the trajectory and heat flux to phonon normal mode space and extract key phonon properties, including phonon relaxation times and their contributions to thermal conductivity. We implement two methods. The first method is based on the Green Kubo formalism to resolve the contribution of each phonon mode to thermal conductivity. The second resolves the lifetime of individual phonon modes and the thermal conductivity is calculated using the Boltzmann transport equation within relaxation time approximation. Notably, a lower contribution of acoustic modes is revealed compared to perturbative approaches considering only three-phonon scattering processes. The effects of four types of point defects are evaluated. The strongest impact on a reduction in thermal conductivity is from Th interstitials, followed by Th vacancies. O interstitials/vacancies have a similar impact, albeit smaller than defects on the thorium sublattice. These observations are consistent with previous studies.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2017

Exploiting the Reactivity of Actinide Fluoride Bonds for the Synthesis of a New Class of Bis(azide) Uranium Complexes

The terminal actinide fluoride bonds in (C 5 Me 5 ) 2 ThF 2 (py) (py = pyridine) and (C 5 Me 5 ) 2 UF 2 (O=PR 3 ) (R = Me, Ph) react with two equivalents of Me 3 SiN 3 in toluene to form the polymeric thorium bis(azide), [(C 5 Me 5 ) 2 Th(N 3 )2] ∞ , and a new class of monometallic uranium bis(azide) complexes, (C 5 Me 5 ) 2 U(N 3 )2(O=PR 3 ), respectively. Full characterization of the novel complexes (C 5 Me 5 ) 2 ThF 2 (py) and (C 5 Me 5 ) 2 UF 2 (O=PR 3 ) are reported, including the solid-state structures of (C 5 Me 5 ) 2 ThF 2 (py) and (C 5 Me 5 ) 2 U(N 3 ) 2 (O=PPh 3 ). Lastly, electronic absorption spectral data are also reported for (C 5 Me 5 ) 2 AnF 2 (py) (An = Th, U) and (C 5 Me 5 ) 2 U(N 3 ) 2 (O=PR 3 ) to confirm metal oxidation state and enable elucidation of the fluoride and azide ligand bonding in these complexes.

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

Two actinide-organic frameworks constructed by a tripodal flexible ligand: Occurrence of infinite ((UO{sub 2})O{sub 2}(OH){sub 3}){sub 4n} and hexanuclear (Th{sub 6}O{sub 4}(OH){sub 4}) motifs

Two new actinide metal-organic frameworks were constructed by using a tripodal flexible ligand tris (2-carboxyethyl) isocyanurate (H{sub 3}tci) under hydrothermal condition. The combination of H{sub 3}tci and uranyl nitrate hexahydrate in aqueous solution leads to the isolation of [(UO{sub 2}){sub 2}(H{sub 2}O){sub 4}]{sub 0.5}(tci){sub 2}(UO{sub 2}){sub 4}(OH){sub 4}·18H{sub 2}O (1), which contains two distinct UO{sub 2}{sup 2+} coordination environments. Four uranyl cations, linked through μ{sub 3}-OH respectively, result in the edge-sharing ribbons. Then, the layer structure is constructed by U-O clusters linked through other eight-coordinated uranyl unions, giving rise to a porous structure in the space. Topological analysis reveals that complex 1 belongs to a (4, 8)-connected net with a schläfli symbol of (3{sup 4.}2{sup 6.}3){sub 2}(3{sup 4.}4{sup 6.}5{sup 6.}6{sup 8.}7{sup 3.}8). Th{sub 3}(tci){sub 2}O{sub 2}(OH){sub 2}(H{sub 2}O){sub 3}·12H{sub 2}O (2) generated by the reaction of H{sub 3}tci and thorium nitrate tetrahydrate, possesses nine-fold coodinated Th(IV) centers with a monocapped square antiprismatic geometry. The hexamers “Th{sub 6}O{sub 4}(OH){sub 4}” motifs are connected together by the carboxylate groups, showing a three-dimensional structures. Complex 2 takes on an 8-connected architecture and the point symbol is (4{sup 24.}6{sup 4}). - Graphical abstract: Two new 3D actinide metal-organic frameworks were constructed by using a tripodal flexible ligand tris (2-carboxyethyl) isocyanurate (H3tci) and their topological structures were displayed. The infinite ((UO{sub 2})O{sub 2}(OH){sub 3}){sub 4n} and hexanuclear (Th{sub 6}O{sub 4}(OH){sub 4}) motifs were found in the title actinides networks.

36 MATERIALS SCIENCE↗
DOE OSTI2010

Reducing ultra-low thermal expansion of {beta}-Zr{sub 2}O(PO{sub 4}){sub 2} by substitutions?

The ultra-low thermal expansion of {beta}-Zr{sub 2}O(PO{sub 4}){sub 2} could still be reduced by chemical modifications, according to previous works on uranium and thorium IV homologues that evidenced a contracting effect of big cations. However, the present study shows that the only isovalent cations likely to substitute for Zr{sup IV} or P{sup V} are either harmful, or unstable, chemically or thermally. Furthermore, aliovalent modifications seem to be forbidden by the crystal structure of the material, leaving probably very few perspectives of improvement. Vanadium however improves significantly the crystallinity of the material and lowers the {alpha}-{beta} transition temperature.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Warm white light emitting ThO{sub 2}:Sm{sup 3+} nanorods: Cationic surfactant assisted reverse micellar synthesis and Photoluminescence properties

Graphical abstract: - Highlights: • ThO{sub 2}:Sm{sup 3+} nanoparticles have been synthesized using cationic surfactant assisted reverse micellar route. • HRTEM shows the formation of thoria nanorods. • Photoluminescence investigation shows host as well as samarium ion emission. • Time resolved fluorescence spectroscopy shows the presence of two types of samarium ion in thoria host. - Abstract: Sm{sup 3+} activated thorium oxide nanorods were synthesized by cationic surfactant assisted reverse micellar route. Phase purity, morphological and luminescent properties were investigated by X-ray diffraction, high resolution transmission electron microscopy and photoluminescence spectroscopy. Upon UV light excitation (245 nm), ThO{sub 2}:Sm{sup 3+} exhibited host emission at 447 nm, along with characteristic emission lines of Sm{sup 3+} at 569, 609, 662 and 716 nm. Lifetime spectroscopy shows the presence of two types of Sm{sup 3+} (τ = 1.1 ms and 4.9 ms) with different asymmetric ratios.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Bond Dissociation Energies and Electronic Calculations on the Actinide Halides ThX and UX (X = Cl, Br, I)

Resonant two-photon ionization spectroscopy has been used to locate predissociation thresholds in the spectra of the actinide halides ThX and UX, where X = Cl, Br, and I. These predissociation thresholds are identified as the bond dissociation energies (BDEs) of the molecules. The resulting values show very similar BDEs for the corresponding ThX and UX species, with the thorium molecules being slightly more strongly bound: D 0 (ThCl) = 5.077(6) eV, D 0 (ThBr) = 4.391(4) eV, D 0 (ThI) = 3.537(8) eV, D 0 (UCl) = 4.989(3) eV, D 0 (UBr) = 4.313(3) eV, and D 0 (UI) = 3.449(8) eV. Here, the estimated error limit is given in parentheses in units of the last reported digit. Spinor-based coupled cluster calculations have also been carried out on the halides of this work, including also ThF and UF. Here, the final D 0 values after including contributions due to basis set incompleteness, outer-core-correlation, picture-change, and QED effects are within 0.04 eV of the present experimental values in each case.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2011

Radiation Damage Study in Natural Zircon Using Neutrons Irradiation

Changes of atomic displacements in crystalline structure of natural zircon (ZrSiO{sub 4}) can be studied by using neutron irradiation on the surface of zircon and compared the data from XRD measurements before and after irradiation. The results of neutron irradiation on natural zircon using Pneumatic Transfer System (PTS) at PUSPATI TRIGA Research Reactor in the Malaysian Nuclear Agency are discussed in this work. The reactor produces maximum thermal power output of 1 MWatt and the neutron flux of up to 1x10{sup 13} ncm{sup -2}s{sup -1}. From serial decay processes of uranium and thorium radionuclides in zircon crystalline structure, the emission of alpha particles can produce damage in terms of atomic displacements in zircon. Hence, zircon has been extensively studied as a possible candidate for immobilization of fission products and actinides.

36 MATERIALS SCIENCE↗
DOE OSTI2011

Radio-Purification of Neodymium Chloride

Organometallic liquid scintillator becomes one of the man detection mediums for neutrino experiment. Liquid-liquid extraction is the method of choice for loading metallic ions of interest into the organic solvents at BNL. High purity of all starting materials is essential for the optimization of synthesis. A newly developed 'self-scavenging' technique was applied to purify undesired radioisotopes from the starting metal compound and found to effectively remove thorium and such containments from the neodymium chloride for SNO+.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗
DOE OSTI2012

Gamma ray spectroscopic analysis of building materials used in Tiruvannamalai, Tamilnadu, India

Building materials cause direct radiation exposure because of their radium, thorium and potassium content. In this paper, samples of commonly used building materials in Tiruvannamalai, city, have been collected randomly over the city. The samples were tested for their radioactivity contents by using gamma spectroscopic measurements. All samples under investigation are within the recommended safety limit when used as building construction.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2013

Neutronics of accelerator-driven subcritical fission for burning transuranics in used nuclear fuel

We report the development of a conceptual design for accelerator-driven subcritical fission in a molten salt core (ADSMS). ADSMS is capable of destroying all of the transuranics at the same rate and proportion as they are produced in a conventional nuclear power plant. The ADSMS core is fueled solely by transuranics extracted from used nuclear fuel and reduces its radiotoxicity by a factor 10,000. ADSMS offers a way to close the nuclear fuel cycle so that the full energy potential in the fertile fuels uranium and thorium can be recovered.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗