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Search Results (353)

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Keywords = isotope separation

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42 pages, 4717 KB  
Article
Intelligent Advanced Control System for Isotopic Separation: An Adaptive Strategy for Variable Fractional-Order Processes Using AI
by Roxana Motorga, Vlad Mureșan, Mihaela-Ligia Ungureșan, Mihail Abrudean, Honoriu Vǎlean and Valentin Sita
AI 2025, 6(10), 246; https://doi.org/10.3390/ai6100246 - 1 Oct 2025
Abstract
This paper provides the modeling, implementation, and simulation of fractional-order processes associated with the production of the enriched 13C isotope due to chemical exchange processes between carbamate and CO2. To demonstrate and simulate the process most effectively, an execution of [...] Read more.
This paper provides the modeling, implementation, and simulation of fractional-order processes associated with the production of the enriched 13C isotope due to chemical exchange processes between carbamate and CO2. To demonstrate and simulate the process most effectively, an execution of a new approximating solution of fractional-order systems is required, which has become possible due to the utilization of advanced AI methods. As the separation process exhibits extremely strong nonlinearity and fractional-order-based performance, it was similarly necessary to utilize the fractional-order system theory to mathematically model the operation, which consists of the comparison of its output with an integrator function. The learning of the dynamic structure’s parameters of the derived fractional-order model is performed by neural networks, which are AI-based domain solutions. Thanks to the approximations executed, the concentration dynamics of the enriched 13C isotope can be simulated and predicted with a high level of precision. The solutions’ effectiveness is corroborated by the model’s response comparison with the reaction of the actual process. The current implementation uses neural networks trained specifically for this purpose. Furthermore, since the isotopic separation processes are long-settling-time processes, this paper proposes some control strategies that are developed for the 13C isotopic separation process, in order to improve the system performances and to avoid the loss of enriched product. The adaptive controllers were tuned by imposing them to follow the output of a first-order-type transfer function, using a PI or a PID controller. Finally, the paper confirms that AI solutions can successfully support the system throughout a range of responses, which paves the way for an efficient design of the automatic control for the 13C isotope concentration. Such systems can similarly be implemented in other industrial processes. Full article
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19 pages, 1418 KB  
Article
Development of the Direct Deuteration Method for Amino Acids and Characterization of Deuterated Tryptophan
by Chie Shibazaki, Haruki Sugiyama, Misaki Ueda, Takayuki Oku, Motoyasu Adachi, Zoë Fisher and Kazuhiro Akutsu-Suyama
Bioengineering 2025, 12(9), 981; https://doi.org/10.3390/bioengineering12090981 - 16 Sep 2025
Viewed by 501
Abstract
Proteins and peptides are vital biomolecules, and deuterated amino acids are increasingly applied in areas such as drug discovery, metabolic tracing, and neutron scattering studies. In this study, we performed deuteration on all 20 proteinogenic amino acids, including their side chains, and established [...] Read more.
Proteins and peptides are vital biomolecules, and deuterated amino acids are increasingly applied in areas such as drug discovery, metabolic tracing, and neutron scattering studies. In this study, we performed deuteration on all 20 proteinogenic amino acids, including their side chains, and established efficient methods for 13 amino acids. Using a Pt/C-catalyzed hydrogen–deuterium exchange reaction, the reaction parameters were optimized to achieve the selective and stable incorporation of deuterium. In addition, the resulting deuterated compounds, focusing on tryptophan, were characterized in order to assess their physicochemical properties. Because the deuteration reaction caused significant racemization of amino acids, deuterated D/L-tryptophan was isolated using a chiral separation method. Deuterated tryptophan characterization studies confirmed that the photostability was markedly enhanced by deuteration, whereas the acid stability showed no clear isotopic effect. The X-ray crystal structure analyses revealed minimal changes upon the hydrogen-to-deuterium substitution. These results provide a robust platform for the supply of deuterated amino acids, facilitating their application in drug development, structural analysis, and creation of advanced functional biomaterials. Full article
(This article belongs to the Special Issue Design and Synthesis of Functional Deuterated Biomaterials)
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13 pages, 3408 KB  
Article
Efficient Separation of Lu from Yb Using Rext-P350@Resin: A Promising Route for No-Carrier-Added 177Lu Production
by Jiuquan Qi, Qianwen Chen, Chuanying Liu, Chengliang Xiao and Shuainan Ni
Separations 2025, 12(8), 215; https://doi.org/10.3390/separations12080215 - 15 Aug 2025
Viewed by 505
Abstract
Due to the nearly identical chemical properties of Lu and Yb, the production of no-carrier-added (NCA) 177Lu faces significant challenges in their separation. Achieving efficient and streamlined separation of Lu and Yb is crucial for the production of NCA 177Lu. This [...] Read more.
Due to the nearly identical chemical properties of Lu and Yb, the production of no-carrier-added (NCA) 177Lu faces significant challenges in their separation. Achieving efficient and streamlined separation of Lu and Yb is crucial for the production of NCA 177Lu. This study systematically investigated the separation performance of the commercial Rext-P350 extraction resin for Lu and Yb. Static adsorption experiments revealed that, at a solid–liquid ratio of 8 g/L, both Lu3+ and Yb3+ were nearly completely adsorbed, with saturation adsorption capacities of 25.8 mg/g and 21.5 mg/g, respectively. An increase in the nitric acid concentration in the aqueous phase significantly inhibited adsorption, but the separation factor for Lu3+/Yb3+ remained above 1.88. The adsorption kinetics followed a pseudo-second-order model (R2 > 0.99), with equilibrium reached within 15 min, demonstrating fast adsorption kinetics. Characterization by SEM, FT-IR, and XPS confirmed the chemical coordination between the resin and Lu3+/Yb3+. Dynamic chromatographic separation experiments showed that the Rext-P350 resin exhibited significantly better separation performance for Lu3+/Yb3+ compared to 2-ethylhexylphosphoric acid mono-2-ethylhexyl ester (P507) extraction resin. Leveraging the excellent performance of Rext-P350 resin, a two-stage continuous extraction chromatography process was designed, achieving efficient separation of 0.045 mg of Lu3+ from 200 mg of Yb3+ with a Lu3+ purity of 90.9% and a yield of 98.4%. This study provides a feasible separation technique for the purification of NCA 177Lu. Full article
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14 pages, 1820 KB  
Review
Approaches for Identifying LncRNA-Associated Proteins for Therapeutic Targets and Cancer Biomarker Discovery
by Mohammad Shabir Hussain, Puneet Vij, Sudhir Kotnala, Shadab Ahmad, Subhash C. Chauhan and Manish K. Tripathi
Targets 2025, 3(3), 27; https://doi.org/10.3390/targets3030027 - 11 Aug 2025
Viewed by 788
Abstract
Long non-coding RNAs (lncRNAs) are increasingly recognized as key regulators of gene expression and cellular signaling in cancer. Their functions are primarily mediated through interactions with specific protein partners that modulate chromatin structure, epigenetic remodeling, transcription, and signal transduction. In this review, we [...] Read more.
Long non-coding RNAs (lncRNAs) are increasingly recognized as key regulators of gene expression and cellular signaling in cancer. Their functions are primarily mediated through interactions with specific protein partners that modulate chromatin structure, epigenetic remodeling, transcription, and signal transduction. In this review, we explore reports and strategies for the proteomic characterization of lncRNA-associated proteins, particularly emphasizing high-throughput liquid chromatography–mass spectrometry (LC-MS)-based techniques. Affinity-based methods such as RNA pull-down, ChIRP MS, RAP-MS, BioID-MS, and SILAC-MS enable sensitive and specific mapping of lncRNA and protein complexes. These approaches reveal cancer-specific proteomic signatures, post-translational modifications, and mechanistic insights into tumor biology. The use of label-free quantification, bituminization, and crosslinking strategies further enhances the resolution of dynamic RNA–protein networks. Validation tools following bioinformatic analyses, such as Western blotting, immunohistochemistry, immunofluorescence, and ELISA, are used to prioritize and confirm findings. Candidate biomarkers from hepatocellular carcinoma to colorectal and prostate cancers, profiling lncRNA-associated proteins, hold promise for identifying clinically actionable biomarkers and therapeutic targets. This review highlights the translational relevance of lncRNA protein studies and advocates for their broader adoption in oncological research. In LC-MS workflows, proteins bound to lncRNAs are enzymatically digested into peptides, separated via nano-LC, and analyzed using high-resolution tandem MS. Label-free or isotope-labeled methods quantify differential enrichment, followed by bioinformatics-driven pathway annotation. Full article
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27 pages, 1491 KB  
Article
Spent Nuclear Fuel—Waste to Resource, Part 1: Effects of Post-Reactor Cooling Time and Novel Partitioning Strategies in Advanced Reprocessing on Highly Active Waste Volumes in Gen III(+) UOx Fuel Systems
by Alistair F. Holdsworth, Edmund Ireland and Harry Eccles
J. Nucl. Eng. 2025, 6(3), 29; https://doi.org/10.3390/jne6030029 - 5 Aug 2025
Viewed by 870
Abstract
Some of nuclear power’s primary detractors are the unique environmental challenges and impacts of radioactive wastes generated during fuel cycle operations. Key benefits of spent fuel reprocessing (SFR) are reductions in primary high active waste (HAW) masses, volumes, and lengths of radiotoxicity at [...] Read more.
Some of nuclear power’s primary detractors are the unique environmental challenges and impacts of radioactive wastes generated during fuel cycle operations. Key benefits of spent fuel reprocessing (SFR) are reductions in primary high active waste (HAW) masses, volumes, and lengths of radiotoxicity at the expense of secondary waste generation and high capital and operational costs. By employing advanced waste management and resource recovery concepts in SFR beyond the existing standard PUREX process, such as minor actinide and fission product partitioning, these challenges could be mitigated, alongside further reductions in HAW volumes, masses, and duration of radiotoxicity. This work assesses various current and proposed SFR and fuel cycle options as base cases, with further options for fission product partitioning of the high heat radionuclides (HHRs), rare earths, and platinum group metals investigated. A focus on primary waste outputs and the additional energy that could be generated by the reprocessing of high-burnup PWR fuel from Gen III(+) reactors using a simple fuel cycle model is used; the effects of 5- and 10-year spent fuel cooling times before reprocessing are explored. We demonstrate that longer cooling times are preferable in all cases except where short-lived isotope recovery may be desired, and that the partitioning of high-heat fission products (Cs and Sr) could allow for the reclassification of traditional raffinates to intermediate level waste. Highly active waste volume reductions approaching 50% vs. PUREX raffinate could be achieved in single-target partitioning of the inactive and low-activity rare earth elements, and the need for geological disposal could potentially be mitigated completely if HHRs are separated and utilised. Full article
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15 pages, 2382 KB  
Article
Study of Metabolite Detectability in Simultaneous Profiling of Amine/Phenol and Hydroxyl Submetabolomes by Analyzing a Mixture of Two Separately Dansyl-Labeled Samples
by Sicheng Quan, Shuang Zhao and Liang Li
Metabolites 2025, 15(8), 496; https://doi.org/10.3390/metabo15080496 - 23 Jul 2025
Viewed by 512
Abstract
Background: Liquid chromatography-mass spectrometry (LC-MS), widely used in metabolomics, is often limited by low ionization efficiency and ion suppression, which reduce overall metabolite detectability and quantification accuracy. To address these challenges, chemical isotope labeling (CIL) LC-MS has emerged as a powerful approach, offering [...] Read more.
Background: Liquid chromatography-mass spectrometry (LC-MS), widely used in metabolomics, is often limited by low ionization efficiency and ion suppression, which reduce overall metabolite detectability and quantification accuracy. To address these challenges, chemical isotope labeling (CIL) LC-MS has emerged as a powerful approach, offering high sensitivity, accurate quantification, and broad metabolome coverage. This method enables comprehensive profiling by targeting multiple submetabolomes. Specifically, amine-/phenol- and hydroxyl-containing metabolites are labeled using dansyl chloride under distinct reaction conditions. While this strategy provides extensive coverage, the sequential analysis of each submetabolome reduces throughput. To overcome this limitation, we propose a two-channel mixing strategy to improve analytical efficiency. Methods: In this approach, samples labeled separately for the amine/phenol and hydroxyl submetabolomes are combined prior to LC-MS analysis, leveraging the common use of dansyl chloride as the labeling reagent. This integration effectively doubles throughput by reducing LC-MS runtime and associated costs. The method was evaluated using human urine and serum samples, focusing on peak pair detectability and metabolite identification. A proof-of-concept study was also conducted to assess the approach’s applicability in putative biomarker discovery. Results: Results demonstrate that the two-channel mixing strategy enhances throughput while maintaining analytical robustness. Conclusions: This method is particularly suitable for large-scale studies that require rapid sample processing, where high efficiency is essential. Full article
(This article belongs to the Special Issue Method Development in Metabolomics and Exposomics)
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22 pages, 2041 KB  
Article
An Improved and Updated Method for the Determination of Imidazole Compounds in Geological Samples
by Henan Li, Zhiling You, Kunde Lin, Yuncong Ge, Qian Wang and Meng Chen
Water 2025, 17(14), 2062; https://doi.org/10.3390/w17142062 - 10 Jul 2025
Viewed by 565
Abstract
The widespread environmental dissemination of imidazole compounds necessitates robust analytical monitoring tools. This study developed a novel isotope-labeled surrogate-based high-performance liquid chromatography coupled with tandem mass spectrometry (HPLC-MS/MS) method for the simultaneous determination of 21 imidazoles in water, sediment, and soil. The optimized [...] Read more.
The widespread environmental dissemination of imidazole compounds necessitates robust analytical monitoring tools. This study developed a novel isotope-labeled surrogate-based high-performance liquid chromatography coupled with tandem mass spectrometry (HPLC-MS/MS) method for the simultaneous determination of 21 imidazoles in water, sediment, and soil. The optimized SPE protocol using Oasis HLB cartridges achieved high recoveries, with chromatographic separation completed in 25 min. Six isotope-labeled standards effectively corrected matrix effects (−57% to 8%), yielding MQLs < 1.0 ng·L−1 (water) and <1.0 μg·kg−1 (sediment/soil). Validation confirmed linearity (R2 > 0.995), accuracy (60–120% recovery for 20/21 analytes), and precision (relative standard deviation, RSD < 15%). Its application in Jiulong River revealed significant contamination, detecting eight imidazoles in both water (up to 49.29 ng·L−1) and sediment (up to 24.01 μg·kg−1). This standardized tool enables routine monitoring of pharmaceutical residues across environmental compartments, supporting regulatory frameworks. Full article
(This article belongs to the Section Water Quality and Contamination)
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18 pages, 939 KB  
Article
Estimates of Isotope Ratios in the Magnetosphere and Implications for Implantation of Atmosphere in Lunar Regolith
by James R. Lyons and Sarah Uddin
Atmosphere 2025, 16(7), 823; https://doi.org/10.3390/atmos16070823 - 7 Jul 2025
Viewed by 409
Abstract
The plasma in Earth’s magnetosphere is comprised of ions from the solar wind and from Earth’s polar wind, with the orientation of the interplanetary magnetic field (IMF) acting to modulate the relative contributions from these two sources. Although ion composition and charge state [...] Read more.
The plasma in Earth’s magnetosphere is comprised of ions from the solar wind and from Earth’s polar wind, with the orientation of the interplanetary magnetic field (IMF) acting to modulate the relative contributions from these two sources. Although ion composition and charge state are strong indicators of ion provenance, here we consider isotope ratios as a possible additional method for tracing plasma provenance. Solar wind isotope ratios have been well characterized, but isotope ratios have not been measured for magnetospheric plasma, and only a few measurements have been made for Earth’s ionosphere. Accounting for diffusive separation in the ionosphere, and using a magnetospheric source flux model, we estimate isotope ratios for several light ions (H+, He+, N+ and O+) in the magnetosphere. The primary source of N and O magnetospheric ions is the polar wind, and He ions come primarily from the solar wind. H ions come from both polar and solar winds. The extreme diffusive separation of O+ isotopes argues against the polar wind as a significant source of O to the lunar regolith during the passage of the Moon through the magnetotail. Full article
(This article belongs to the Special Issue Research and Space-Based Exploration on Space Plasma)
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16 pages, 8215 KB  
Article
Assessment of a Translating Fluxmeter for Precision Measurements of Super-FRS Dipole Magnets
by Pawel Kosek, Anthony Beaumont and Melvin Liebsch
Metrology 2025, 5(2), 37; https://doi.org/10.3390/metrology5020037 - 17 Jun 2025
Viewed by 360
Abstract
In particle physics experiments, fragment separators utilize dipole magnets to distinguish and isolate specific isotopes based on their mass-to-charge ratio as particles traverse the dipole’s magnetic field. Accurate fragment selection relies on precise knowledge of the magnetic field generated by the dipole magnets, [...] Read more.
In particle physics experiments, fragment separators utilize dipole magnets to distinguish and isolate specific isotopes based on their mass-to-charge ratio as particles traverse the dipole’s magnetic field. Accurate fragment selection relies on precise knowledge of the magnetic field generated by the dipole magnets, necessitating dedicated measurement instrumentation to characterize the field in the constructed magnets. This study presents measurements of the two first-of-series dipole magnets (Type II—11 degrees bending angle—and Type III—9.5 degrees bending angle) for the Superconducting Fragment Separator that is being built in Darmstadt, Germany. Stringent field quality requirements necessitated a novel measurement system—the so-called translating fluxmeter. It is based on a PCB coil array installed on a moving trolley that scans the field while passing through the magnet aperture. While previous publications have discussed the design of the moving fluxmeter and the characterization of its components, this article presents the results of a measurement campaign conducted using the new system. The testing campaign was supplemented with conventional methods, including integral field measurements using a single stretched wire system and three-dimensional field mapping with a Hall probe. We provide an overview of the working principle of the translating fluxmeter system and validate its performance by comparing the results with those obtained using conventional magnetic measurement methods. Full article
(This article belongs to the Special Issue Advances in Magnetic Measurements)
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26 pages, 2541 KB  
Protocol
Synthesis of DOTA-Based 43Sc Radiopharmaceuticals Using Cyclotron-Produced 43Sc as Exemplified by [43Sc]Sc-PSMA-617 for PSMA PET Imaging
by Jason P. Meier, Mohammed Bhuiyan, Richard Freifelder, Hannah J. Zhang, Lucas Gonzalez, Antonino Pusateri, Hsiu-Ming Tsai, Lara Leoni, Kaustab Ghosh, Erica Markiewicz, Christopher Henning, Yuhan Zhang, Ralph Weichselbaum, Jerry Nolen, David A. Rotsch, Chien-Min Kao, Russell Z. Szmulewitz, Chin-Tu Chen and Satish K. Chitneni
Methods Protoc. 2025, 8(3), 58; https://doi.org/10.3390/mps8030058 - 4 Jun 2025
Viewed by 1181
Abstract
The implementation of theranostics in oncologic nuclear medicine has exhibited immense potential in improving patient outcomes in prostate cancer with the implementation of [68Ga]Ga-PSMA-11 PET and [177Lu]Lu-PSMA-617 into clinical practice. However, the correlation between radiopharmaceutical biodistributions seen with [ [...] Read more.
The implementation of theranostics in oncologic nuclear medicine has exhibited immense potential in improving patient outcomes in prostate cancer with the implementation of [68Ga]Ga-PSMA-11 PET and [177Lu]Lu-PSMA-617 into clinical practice. However, the correlation between radiopharmaceutical biodistributions seen with [68Ga]Ga-PSMA-11 PET imaging and downstream [177Lu]Lu-PSMA-617 therapy remains imperfect. This suggests that prostate cancer theranostics could potentially be further refined through the implementation of true theranostics, tandem pairs of diagnostic and therapeutic radiopharmaceuticals that utilize the same ligand and element, thus yielding identical pharmacokinetics. The radioscandiums are one such group of true theranostic radiopharmaceuticals. The radioscandiums consist of two β+ emitting scandium isotopes (43Sc/44Sc), as well as a β emitting therapeutic isotope (47Sc), which can all conjugate with PSMA-targeting PSMA-617. This potential has led to extensive investigations into the production of the radioscandiums as well as pre-clinical assessments with several ligands; however, there is a lack of literature extensively describing the complete synthesis of scandium radiopharmaceuticals. which therefore limits the accessibility of radioscandium research in theranostics. As such, this work aims to present an easily translatable protocol for the synthesis of [43Sc]Sc-PSMA-617 from a [42Ca]CaCO3 starting material, including target formation, nuclear production via 42Ca(d,n)43Sc reaction, chemical separation, radiolabeling, solvent reformulation, and target recycling. Full article
(This article belongs to the Section Biochemical and Chemical Analysis & Synthesis)
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15 pages, 2160 KB  
Article
Testing Low-Density Polyethylene Membranes for Lithium Isotope Electromigration System
by Andreea Maria Iordache, Ramona Zgavarogea, Ana Maria Nasture, Erdin Feizula, Roxana Elena Ionete, Rui Santos and Constantin Nechita
Materials 2025, 18(11), 2519; https://doi.org/10.3390/ma18112519 - 27 May 2025
Viewed by 518
Abstract
The growing energy demand has emphasized the importance of developing nuclear technologies and high-purity lithium isotopes (6Li and 7Li) as raw materials. This study investigates how voltage and migration time affect two types of low-density polyethylene membranes—one impregnated with ionic [...] Read more.
The growing energy demand has emphasized the importance of developing nuclear technologies and high-purity lithium isotopes (6Li and 7Li) as raw materials. This study investigates how voltage and migration time affect two types of low-density polyethylene membranes—one impregnated with ionic liquids and the other non-impregnated—for lithium isotope separation via electromigration from a lithium-loaded organic phase to an aqueous solution. We developed a laboratory-made setup for high-precision lithium isotope measurements (2RSD = ±0.30‰) of natural carbonate samples (LSVEC) and an optimized protocol for isotope ratio measurements using quadrupole ICP-MS with the sample-standard bracketing method (SSB). The results document that both impregnated and non-impregnated membranes can achieve promising 6Li enrichment under different environmental conditions, including ionic liquids and organic solutions in the cathode chamber. Lithium-ion mobility is influenced by voltage in an environment assisted by 0.1 mol/L tetrabutylammonium perchlorate and increases quasi-linearly from 5 to 15 V. Between 20 and 25 h, the lithium-ion concentration had the maximum value, after which the trend declined. In the BayesGLM model, we incorporated all data and systematically eliminated those with a low enrichment factor, either individually or in groups. Our findings indicated that the model was not significantly affected by the exclusion of measurements with low α. This suggests that voltage and migration time are crucial, and achieving a better enrichment factor depends on applying the optimal ratio of ionic liquids, crown ethers, and organic solvents. Ionic liquids used for impregnation sustain enrichment in the first hours, particularly for 7Li; however, after 25 h, 6Li demonstrated a higher enrichment capacity. The maximum single-stage separation factor for 6Li/7Li was achieved at 24 and 48 h for an impregnated membrane M2 (α = 1.021/1.029) and a non-impregnated membrane M5 (α = 1.031/1.038). Full article
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13 pages, 899 KB  
Article
Quantification of Plutonium and Americium in Environmental Matrices Using Accelerator Mass Spectrometry
by Elena Moroianu, Iuliana Stanciu, Doru Pacesila, Andreea Dima, Oana Gaza and Daniel Vasile Mosu
Atoms 2025, 13(5), 45; https://doi.org/10.3390/atoms13050045 - 21 May 2025
Viewed by 2989
Abstract
This study focused on the measurement of anthropogenic radionuclides such as americium (Am) and plutonium (Pu) in environmental samples. Plutonium isotopes, particularly Pu239, Pu240, and Pu241, originated from nuclear weapons testing, nuclear power plants, and accidents like [...] Read more.
This study focused on the measurement of anthropogenic radionuclides such as americium (Am) and plutonium (Pu) in environmental samples. Plutonium isotopes, particularly Pu239, Pu240, and Pu241, originated from nuclear weapons testing, nuclear power plants, and accidents like Chernobyl and Fukushima Daiichi. Accurate measurement of these isotopes, considering their half-lives and trace concentrations, provides critical information about their persistence and environmental transport. Using the 1 MV Tandetron accelerator, we expanded the measurement capabilities to include Pu241, Am241. Chemical separation of these isotopes was achieved through ion chromatography, employing reference isotopes Pu242 and Am243 for method validation. Certified reference materials, including IAEA-410 (Bikini Atoll sediment) and Sample 05, were analyzed to ensure accuracy. We validated the Am241/Am243 ratio in an Am standard (IFIN-STD-Am, our laboratory produced standard for Am), achieving a measured value of 0.158 at·at−1 (3%), in good agreement with the nominal value of 0.154 at·at−1. Additionally, we determined the (241Pu + Am241)/242Pu ratio in the ColPuS standard to be equal to 0.029 at ·at−1 (7%). These results demonstrate the potential of AMS for improved detection of actinides at low concentrations and contribute to understanding the behavior of Pu and Am isotopes. Full article
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14 pages, 2359 KB  
Article
Impacts of Thermal Maturity on the Carbon Isotopes of Hopane Compounds in Lacustrine Shale During Compaction Pyrolysis Experiments
by Lu Li, Yan Liu, Xing Wang, Yaohui Xu, Zhigang Wen, Haowei Chen, Gang Yan, Zhongdeng Lu, Zulin Chen and Zeyang Guo
Appl. Sci. 2025, 15(10), 5469; https://doi.org/10.3390/app15105469 - 13 May 2025
Viewed by 566
Abstract
The carbon isotopic behavior of hopane compounds during thermal maturation remains ambiguous due to limitations in current detection techniques. In this study, a low-maturity lacustrine shale sample was pyrolyzed in a hydrous semi-open pyrolysis system. The hopane compounds from the artificially matured samples [...] Read more.
The carbon isotopic behavior of hopane compounds during thermal maturation remains ambiguous due to limitations in current detection techniques. In this study, a low-maturity lacustrine shale sample was pyrolyzed in a hydrous semi-open pyrolysis system. The hopane compounds from the artificially matured samples (Ro = 0.72–1.28%) have been separated and enriched for the test of their carbon isotopes (δ13C). The results show that thermal maturity can somewhat affect the carbon isotopes of monomeric hopane compounds, with a maximum difference value over 21‰. However, thermal maturity has different effects on the δ13C values for different monomeric hopane compounds. For example, the carbon isotopic values of 22S-homohopane at different thermal stages can vary up to 21‰, while only 3‰ for C29βα. In addition, the carbon isotopes of different monomeric hopane compounds show distinct evolution trends. For C29αβ and C29 Ts, their carbon isotopes first become slightly heavier and then become lighter, reaching the lightest value at 350 °C. When the pyrolysis temperature continues to increase, the δ13C values become heavier and finally become lighter. However, the δ13C values of Ts, Tm, 22S-homohopane, and 22R-homohopane show a completely reversed trend. They initially become slightly lighter and then become heavier, reaching the maximum value at 350 °C. When the pyrolysis temperature continues to increase, the δ13C values become lighter and finally become heavier. Meanwhile, the carbon isotopes of C29βα, C30αβ, C30βα, and non-hopane gammacerane almost remain constant at different thermal stages. When the carbon isotopes of hopane compounds are used in the studies of oil–source correlation, it is prudent to consider the effects of thermal maturity on these values. Full article
(This article belongs to the Special Issue Technologies and Methods for Exploitation of Geological Resources)
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16 pages, 5651 KB  
Article
Surface-Dependent Isotopic Adsorption of CO on α-Al2O3: Role of Weak Interactions and Zero-Point Energy
by Qun Yang, Xiyue Cheng, Qian Xu and Shuiquan Deng
Molecules 2025, 30(9), 2067; https://doi.org/10.3390/molecules30092067 - 6 May 2025
Viewed by 668
Abstract
Carbon isotopes, particularly 13C, are critical for applications in food authentication, biomedical diagnostics, and metabolic research; however, their efficient separation remains challenging due to their low natural abundance. This study investigates the adsorption behavior of 12CO and 13CO on various [...] Read more.
Carbon isotopes, particularly 13C, are critical for applications in food authentication, biomedical diagnostics, and metabolic research; however, their efficient separation remains challenging due to their low natural abundance. This study investigates the adsorption behavior of 12CO and 13CO on various low-index α-Al2O3 surfaces as a strategy for isotope separation. Density functional theory (DFT) calculations with D3 (BJ) dispersion corrections were employed to optimize surface models for five representative α-Al2O3 facets. Nine adsorption configurations were systematically evaluated by optimizing geometric structures, computing adsorption enthalpies with zero-point energy corrections, and performing Bader charge and charge density difference analyses to elucidate interfacial interactions. The results reveal that CO preferentially adsorbs in a vertical configuration via its carbon end at Al sites, with the (0001) surface exhibiting the lowest surface energy and most favorable adsorption characteristics. Furthermore, we found that facets with lower surface energy not only facilitate stronger CO adsorption but also demonstrate pronounced adsorption enthalpy differences between 12CO and 13CO, driven by vibrational zero-point energy disparities. These findings highlight the potential of low adsorption enthalpy surfaces, particularly (0001), (011¯2), and (112¯0), for enhancing isotope separation efficiency, providing valuable insights for the design of advanced separation materials. Full article
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11 pages, 14103 KB  
Article
Production Optimization of Exotic Hypernuclei via Heavy-Ion Beams at GSI-FAIR
by Samuel Escrig and Christophe Rappold
Particles 2025, 8(2), 54; https://doi.org/10.3390/particles8020054 - 1 May 2025
Viewed by 827
Abstract
Building on the successful demonstration of hypernuclear spectroscopy using heavy-ion beams, the HypHI Collaboration is shifting its focus to investigating proton- and neutron-rich hypernuclei. A crucial component of this research is the implementation of a fragment separator, which facilitates the production and separation [...] Read more.
Building on the successful demonstration of hypernuclear spectroscopy using heavy-ion beams, the HypHI Collaboration is shifting its focus to investigating proton- and neutron-rich hypernuclei. A crucial component of this research is the implementation of a fragment separator, which facilitates the production and separation of rare isotope beams and is vital for accessing hypernuclei far from the stability line. High-precision spectroscopy of these exotic hypernuclei is planned to be conducted at GSI first, which will be followed by experiments at the FAIR facility utilizing the FRS and Super-FRS fragment separators. A thorough systematic investigation paired with an optimization analysis was employed to establish the most favorable experimental setup for producing high-isospin hypernuclei. Theoretical models describing heavy-ion-induced reactions and hypernuclear synthesis guided this process, which was complemented by Monte Carlo simulations to obtain experimental efficiencies for the production and transmission of the exotic secondary beams. The outlined methodology offers insights into the anticipated yields of HeΛ6, CΛ9, and a range of both proton- and neutron-rich hypernuclei. Full article
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