bluuebunny/crossref_metadata_2025 huggingface dataset:
Effect of Geopolymerization Reaction on the Flexural Strength of Kaolin-Based Systems
Authors: Gao Binghuan , Li Yangyang , Jang Seongwan , Son Hyeonjin , Lee Heesoo , Bae Chang-Jun
Published: May 2024

Geopolymers exhibit broad application prospects, including construction and radiation shielding, which require excellent mechanical performances. However, investigations on the nature of geopolymerization reactions and their consequential impact on mechanical performance are still vague. In this study, the effect of the major factors of Si/Al ratio and curing time on the geopolymerization reaction and flexural strength were studied based on the microstructure evolution and chemical bonding formation analyzed using the SEM, FTIR, peak deconvolution, and XRD methods. The microstructure of geopolymers was transferred from initially layered smooth particles of kaolinite to a 3D network porous structure, corresponding to sodalite. A spectrum exclusive to the geopolymer structure occurred at 973 cm−1, corresponding to the sodium aluminum silicate hydrate (N-A-S-H) links, the integral area of which represents the degree of geopolymerization reaction. Furthermore, a controllable reaction degree was achieved by adjusting the Si/Al ratio and curing time, where the maximum reaction degree of 55% was achieved at a Si/Al ratio of 1.94 when cured for 7 d. The correlation between the flexural strength and reaction degree was found to follow a proportional relationship, achieving a flexural strength of 21.11 MPa with a degree of 45%. This study provides insight into the development of mechanical strength through controlling the reaction process.
Age of Information in NOMA-IoT Networks: A Temporal Queuing Model Perspective
Authors: Liu Lei , Li Kangjing , Du Pengfei , Jiang Fan , Zhang Xuewei , Han Qi
Published: May 2024

The Internet of Things (IoT) with non-orthogonal multiple access (NOMA) has been anticipated to offer diverse real-time applications, wherein the crux is to guarantee the age of information (AoI) for dynamic traffic. However, the traffic temporal variation provokes the interdependence between queue status and interference, in which context the AoI performance remains to be further explored. In this paper, an analytical framework is established to characterize the AoI performance in NOMA-IoT networks with random Bernoulli and deterministic periodic arrivals. Particularly, a numerical algorithm is devised to obtain the queue service rate, and tractable expressions for AoI violation probability and average AoI under both the first-come first-served (FCFS) and the preemptive last-come first-served (LCFS-PR) service disciplines are derived. Simulations are conducted to validate the proposed analysis. The results unveil that LCFS-PR conduces to better AoI performance than FCFS, and yet the gain diverges for each device with different traffic arrival configurations. In addition, the result shows that with sporadic traffic arrival, the periodic pattern outperforms the Bernoulli pattern, whereas this advantage gradually diminishes with more frequent packet arrival.
A Novel Hybrid Gray MCDM Model for Resilient Supplier Selection Problem
Authors: Ulutaş Alptekin , Krstić Mladen , Topal Ayşe , Agnusdei Leonardo , Tadić Snežana , Miglietta Pier Paolo
Published: May 2024

The current business climate has generated considerable uncertainty and disrupted supply chain processes. Suppliers have frequently been identified as the primary source of hazards responsible for supply chain disruptions. Using a strategic approach to supplier selection that prioritizes providers with resilience features, mitigating the risk exposure inherent in supply chains is possible. This study proposes a comprehensive gray multiple-criteria decision making (MCDM) method incorporating resilience attributes to supplier selection. To determine criteria weights, the gray PSI and gray BWM methodologies were used, and to evaluate and prioritize resilient providers, the gray MCRAT and gray COBRA methodologies were applied. According to the results obtained by the suggested methodology, the supplier that demonstrated the greatest degree of resilience was determined to be the provider categorized as SPIR 4. The sequential sequence of the SPIR numbers is as follows: SPIR 5, SPIR 1, SPIR 3, SPIR 2, and SPIR 6. The data demonstrate that the developed approach produced accurate results.
Key Vulnerable Nodes Discovery Based on Bayesian Attack Subgraphs and Improved Fuzzy C-Means Clustering
Authors: Xu Yuhua , Liu Yang , Sun Zhixin , Xue Yucheng , Liao Weiliang , Liu Chenlei , Sun Zhe
Published: May 2024

Aiming at the problem that the search efficiency of key vulnerable nodes in large-scale networks is not high and the consideration factors are not comprehensive enough, in order to improve the time and space efficiency of search and the accuracy of results, a key vulnerable node discovery method based on Bayesian attack subgraphs and improved fuzzy C-means clustering is proposed. Firstly, the attack graph is divided into Bayesian attack subgraphs, and the analysis results of the complete attack graph are quickly obtained by aggregating the information of the attack path analysis in the subgraph to improve the time and space efficiency. Then, the actual threat features of the vulnerability nodes are extracted from the analysis results, and the threat features of the vulnerability itself in the common vulnerability scoring standard are considered to form the clustering features together. Next, the optimal number of clusters is adaptively adjusted according to the variance idea, and fuzzy clustering is performed based on the extracted clustering features. Finally, the key vulnerable nodes are determined by setting the feature priority. Experiments show that the proposed method can optimize the time and space efficiency of analysis, and the fuzzy clustering considering multiple features can improve the accuracy of analysis results.
Robust Control Based on Adaptative Fuzzy Control of Double-Star Permanent Synchronous Motor Supplied by PWM Inverters for Electric Propulsion of Ships
Authors: Ziane Djamel , Zeghlache Samir , Benkhoris Mohamed Fouad , Djerioui Ali
Published: May 2024

This study presents the development of an adaptive fuzzy control strategy for double-star PMSM-PWM inverters used in ship electrical propulsion. The approach addresses the current and speed tracking challenges of double-star permanent magnet synchronous motors (DSPMSMs) in the presence of parametric uncertainties. Initially, a modeling technique employing a matrix transformation method is introduced, generating decoupled and independent star windings to eliminate inductive couplings, while maintaining model consistency and torque control. The precise DSPMSM model serves as the foundation for an unknown nonlinear backstepping controller, approximated directly using an adaptive fuzzy controller. Through the Lyapunov direct method, system stability is demonstrated. All signals in the closed-loop system are ensured to be uniformly ultimately bounded (UUB). The proposed control system aims for low tracking errors, while also mitigating the impact of parametric uncertainties. The effectiveness of the adaptive fuzzy nonlinear control system is validated through tests conducted in hardware-in-the-loop (HIL) simulations, utilizing the OPAL-RT platform, OP4510.
Incorporating the Third Law of Geography with Spatial Attention Module–Convolutional Neural Network–Transformer for Fine-Grained Non-Stationary Air Quality Predictive Learning
Authors: Lin Shaofu , Zhang Yuying , Liu Xiliang , Mei Qiang , Zhi Xiaoying , Fei Xingjia
Published: May 2024

Accurate air quality prediction is paramount in safeguarding public health and addressing air pollution control. However, previous studies often ignore the geographic similarity among different monitoring stations and face challenges in dynamically capturing different spatial–temporal relationships between stations. To address this, an air quality predictive learning approach incorporating the Third Law of Geography with SAM–CNN–Transformer is proposed. Firstly, the Third Law of Geography is incorporated to fully consider the geographical similarity among stations via a variogram and spatial clustering. Subsequently, a spatial–temporal attention convolutional network that combines the spatial attention module (SAM) with the convolutional neural network (CNN) and Transformer is designed. The SAM is employed to extract spatial–temporal features from the input data. The CNN is utilized to capture local information and relationships among each input feature. The Transformer is applied to capture time dependencies across long-distance time series. Finally, Shapley’s analysis is employed to interpret the model factors. Numerous experiments with two typical air pollutants (PM2.5, PM10) in Haikou City show that the proposed approach has better comprehensive performance than baseline models. The proposed approach offers an effective and practical methodology for fine-grained non-stationary air quality predictive learning.
Cross-Cultural Adaptation and Validation of the Romanian Musculoskeletal Tumor Society Scoring System for Patients with Extremity Bone Sarcomas
Authors: Khal Adyb-Adrian , Apostu Dragos , Cosnarovici Rodica , Pesenti Sébastien , Jouve Jean-Luc , Mihu Razvan-Catalin
Published: May 2024

Background and Objectives: Primary malignant bone tumors are rare lesions, and their complex treatment can lead to functional impairment. It is important to have a postoperative assessment tool for patients’ functional outcomes to be evaluated and to consequently adapt future treatments in the pursuit of a continuous improvement of their quality of life. The Musculoskeletal Tumor Society Score (MSTS) is a validated specific system score that is used frequently in the follow-up of these patients. We found no information about a valid translated Romanian version of this score neither for the upper limb nor for the lower limb. We proposed in this study to translate the original version of the MSTS Score into Romanian and to perform validation analysis of the Romanian-language MSTS Score. Materials and Methods: We selected 48 patients who underwent limb-salvage surgery after resection of bone sarcomas. Patients were interrogated twice according to the translated Romanian version of the MSTS Score during their follow-up. The translation was performed according to the recommended guidelines. A total number of 96 questionnaires were valid for statistical analysis. Results: Internal consistency and reliability were good for both sets of questionnaires’ analytic measurements, with Cronbach’s alpha values of 0.848 (test) and 0.802 (retest). The test-retest evaluation proved to be statistically strong for reproducibility and validity with Spearman’s rho = 0.9 (p < 0.01, 95% CI). Conclusions: This study permitted the translation of this score and the validation of psychometric data. Our results showed that the Romanian version of the MSTS is a reliable means of assessment of the functional outcome of patients who received limb-salvage surgery for the upper and lower extremities.
Finite Element Analysis and Experimental Verification of Thermal Fatigue of W-PFM with Stacked Structure
Authors: Qi Chao , Qi Yanfei , Song Hanfeng , Wang Xiao , Xiao Shanqu , Wang Bo
Published: May 2024

As the prime candidate for plasma-facing materials (PFM), the response of tungsten (W) to thermal shock loads is an important research topic for future fusion devices. Under heat loads, the surface of tungsten plasma-facing materials (W-PFM) can experience thermal damage, including brittle cracking and fatigue cracks. Therefore, exploring solutions for thermal damage of W-PFM remains one of the current research focuses. We propose a novel approach to mitigate thermal radiation damage in PFM, namely, the stacked structure W-PFM. The surface thermal stress distribution of the stacked structure W-PFM under heat loads was simulated and analyzed by the finite element method. As the foil thickness decreases, both the peak thermal stresses in the normal direction (ND) and rolling direction (RD) decrease. When the thickness decreases to a certain value, the peak thermal stress in the RD decreases to about 1384 MPa and no longer decreases; while the peak thermal stress in the ND approaches 0 MPa and can be neglected. In the range of approximately 5–100 mm, the accumulated equivalent plastic strain decreases sharply as the thickness decreases; in other thickness ranges, it decreases slowly. Thermal fatigue experiments were conducted on the stacked structure W composed of W foils with different thicknesses and bulk W using an electron beam facility. The samples were applied with a power density of 30 MW/m2 for 10,000 and 20,000 pulses. The cracks on the surface of the stacked structure W extended along the ND direction, while on the surface of bulk W, besides the main crack in the ND direction, a crack network also formed. The experimental results were consistent with finite element simulations. When the pulse number was 10,000, as the thickness of the W foil decreased, the number and width of the cracks on the surface of the stacked structure W decreased. Only four small cracks were present on the surface of stacked structure W (0.05 mm). When the pulse number increased to 20,000, the plastic deformation and number of cracks on the surface of all samples increased. However, the stacked structure W (0.05 mm) only added one small crack and had the smallest surface roughness (Ra = 1.536 μm). Quantitative analysis of the fatigue cracks showed that the stacked structure W-PFM (0.05 mm) exhibited superior thermal fatigue performance.
Influence of Various Processing Routes in Additive Manufacturing on Microstructure and Monotonic Properties of Pure Iron—A Review-like Study
Authors: Torrent Christof J. J. , Sajadifar Seyed Vahid , Gerstein Gregory , Richter Julia , Niendorf Thomas
Published: May 2024

Additive manufacturing processes have attracted broad attention in the last decades since the related freedom of design allows the manufacturing of parts with unique microstructures and unprecedented complexity in shape. Focusing on the properties of additively manufactured parts, major efforts are made to elaborate process-microstructure relationships. For instance, the inevitable thermal cycling within the process plays a significant role in microstructural evolution. Various driving forces contribute to the final grain size, boundary character, residual stress state, etc. In the present study, the properties of commercially pure iron processed on three different routes, i.e., hot rolling as a reference, electron powder bed fusion, and laser powder bed fusion, using different raw materials as well as process conditions, are compared. The manufacturing of the specimens led to five distinct microstructures, which differ significantly in terms of microstructural features and mechanical responses. Using optical and electron microscopy as well as transmission electron microscopy, the built specimens were explored in various states of a tensile test in order to reveal the microstructural evolution in the course of quasistatic loading. The grain size is found to be most influential in enhancing the material’s strength. Furthermore, substructures, i.e., low-angle grain boundaries, within the grains play an important role in terms of the homogeneity of strain distribution. On the contrary, high-angle grain boundaries are found to be regions of strain localization. In summary, a holistic macro-meso-micro-nano investigation is performed to evaluate the behavior of these specific microstructures.
No Differences in Urine Bisphenol A Concentrations between Subjects Categorized with Normal Cognitive Function and Mild Cognitive Impairment Based on Montreal Cognitive Assessment Scores
Authors: Jamka Małgorzata , Kurek Szymon , Makarewicz-Bukowska Aleksandra , Miśkiewicz-Chotnicka Anna , Wasiewicz-Gajdzis Maria , Walkowiak Jarosław
Published: May 2024

A link between bisphenol A (BPA) exposure and cognitive disorders has been suggested. However, the differences in BPA concentrations between subjects with and without cognitive impairment have not been analysed. Therefore, this observational study aimed to compare urine BPA levels in subjects with normal cognitive function (NCF) and mild cognitive impairment (MCI). A total of 89 MCI subjects and 89 well-matched NCF individuals were included in this study. Cognitive functions were assessed using the Montreal Cognitive Assessment (MOCA) scale. Urine BPA concentrations were evaluated by gas chromatography–mass spectrometry and adjusted for creatinine levels. Moreover, anthropometric parameters, body composition, sociodemographic factors, and physical activity were also assessed. Creatinine-adjusted urine BPA levels did not differ between the NCF and MCI groups (1.8 (1.4–2.7) vs. 2.2 (1.4–3.6) µg/g creatinine, p = 0.1528). However, there were significant differences in MOCA results between groups when the study population was divided into tertiles according to BPA concentrations (p = 0.0325). Nevertheless, multivariate logistic regression demonstrated that only education levels were independently associated with MCI. In conclusion, urine BPA levels are not significantly different between subjects with MCI and NCF, but these findings need to be confirmed in further studies.
A Review of Transcriptomics and Metabolomics in Plant Quality and Environmental Response: From Bibliometric Analysis to Science Mapping and Future Trends
Authors: Yan Qi , Zhang Guoshuai , Zhang Xinke , Huang Linfang
Published: May 2024

Transcriptomics and metabolomics offer distinct advantages in investigating the differentially expressed genes and cellular entities that have the greatest influence on end-phenotype, making them crucial techniques for studying plant quality and environmental responses. While numerous relevant articles have been published, a comprehensive summary is currently lacking. This review aimed to understand the global and longitudinal research trends of transcriptomics and metabolomics in plant quality and environmental response (TMPQE). Utilizing bibliometric methods, we presented a comprehensive science mapping of the social structure, conceptual framework, and intellectual foundation of TMPQE. We uncovered that TMPQE research has been categorized into three distinct stages since 2020. A citation analysis of the 29 most cited articles, coupled with a content analysis of recent works (2020–2023), highlight five potential research streams in plant quality and environmental responses: (1) biosynthetic pathways, (2) abiotic stress, (3) biotic stress, (4) development and ripening, and (5) methodologies and tools. Current trends and future directions are shaped by technological advancements, species diversity, evolving research themes, and an environmental ecology focus. Overall, this review provides a novel and comprehensive perspective to understand the longitudinal trend on TMPQE.
Recent Advances in Microfluidic-Based Extracellular Vesicle Analysis
Authors: Chen Jiming , Zheng Meiyu , Xiao Qiaoling , Wang Hui , Chi Caixing , Lin Tahui , Wang Yulin , Yi Xue , Zhu Lin
Published: May 2024

Extracellular vesicles (EVs) serve as vital messengers, facilitating communication between cells, and exhibit tremendous potential in the diagnosis and treatment of diseases. However, conventional EV isolation methods are labor-intensive, and they harvest EVs with low purity and compromised recovery. In addition, the drawbacks, such as the limited sensitivity and specificity of traditional EV analysis methods, hinder the application of EVs in clinical use. Therefore, it is urgent to develop effective and standardized methods for isolating and detecting EVs. Microfluidics technology is a powerful and rapidly developing technology that has been introduced as a potential solution for the above bottlenecks. It holds the advantages of high integration, short analysis time, and low consumption of samples and reagents. In this review, we summarize the traditional techniques alongside microfluidic-based methodologies for the isolation and detection of EVs. We emphasize the distinct advantages of microfluidic technology in enhancing the capture efficiency and precise targeting of extracellular vesicles (EVs). We also explore its analytical role in targeted detection. Furthermore, this review highlights the transformative impact of microfluidic technology on EV analysis, with the potential to achieve automated and high-throughput EV detection in clinical samples.
Two Novel Alkaliphilic Species Isolated from Saline-Alkali Soil in China: Halalkalibacter flavus sp. nov., and Halalkalibacter lacteus sp. nov
Authors: Jin Pin-Jiao , Sun Lei , Liu Yong-Hong , Wang Kang-Kang , Narsing Rao Manik Prabhu , Mohamad Osama Abdalla Abdelshafy , Fang Bao-Zhu , Li Li , Gao Lei , Li Wen-Jun , Wang Shuang
Published: May 2024

The degradation of farmland in China underscores the need for developing and utilizing saline-alkali soil. Soil health relies on microbial activity, which aids in the restoration of the land’s ecosystem, and hence it is important to understand microbial diversity. In the present study, two Gram-stain-positive strains HR 1-10T and J-A-003T were isolated from saline-alkali soil. Preliminary analysis suggested that these strains could be a novel species. Therefore, the taxonomic positions of these strains were evaluated using polyphasic analysis. Phylogenetic and 16S rRNA gene sequence analysis indicated that these strains should be assigned to the genus Halalkalibacter. Cell wall contained meso-2,6-diaminopimelic acid. The polar lipids present in both strains were diphosphatidyl-glycerol, phosphatidylglycerol, and an unidentified phospholipid. The major fatty acids (>10%) were anteiso-C15:0, C16:0 and iso-C15:0. Average nucleotide identity and digital DNA#x2013;DNA hybridization values were below the threshold values (95% and 70%, respectively) for species delineation. Based on the above results, the strains represent two novel species of the genus Halalkalibacter, for which the names Halalkalibacter flavus sp. nov., and Halalkalibacter lacteus sp. nov., are proposed. The type strains are HR 1-10T (=GDMCC 1.2946T = MCCC 1K08312T = JCM 36285T), and J-A-003T (=GDMCC 1.2949T = MCCC 1K08417T = JCM 36286T).
Geology and Geochronology of Magmatic–Hydrothermal Breccia Pipes in the Yixingzhai Gold Deposit: Implications for Ore Genesis and Regional Exploration
Authors: Zhang Li-Zhong , Gao Wen-Sheng , Deng Xiao-Dong
Published: May 2024

Magmatic–hydrothermal breccia pipes are widespread in numerous major porphyry and epithermal gold deposits globally, representing significant repositories of metal resources and serving as potential indicators for exploration targeting. More than ten breccia pipes occur in the Central Taihangshan District (CTD) of the North China Craton. Some of these breccia pipes host gold mineralization and are proposed to be related to the adjacent lode gold mineralization. However, the lack of detailed geological constraints make this hypothesis ambiguous. To address this, the present study conducted comprehensive field observations, drill core logging, an in situ sulfur isotope analysis of pyrite, and the 40Ar/39Ar dating of adularia along a 1400 m section of the Tietangdong breccia pipe at Yixingzhai. Three distinct breccia facies were identified at Tietangdong, exhibiting variable proportions across the entire section, including a massive skarn breccia; polymictic, skarn matrix-supported breccia; and polymictic, intrusive rock cement chaotic breccia. Furthermore, adularia 40Ar/39Ar dating indicates a syn-/post-gold mineralization age of 136 ± 1.5 Ma, coinciding with the age of post-breccia felsite dike. The deepest sampled pyrite displays δ34S values of ~2.7‰, strongly indicating a magmatic–hydrothermal signature. These results, when combined with the geological, geochronological, and isotopic studies on the adjacent lode gold mineralization, further suggest a close genetic relationship between the breccia pipes and the lode Au mineralization, paving the way for their utilization as effective indicators for gold targeting within the CTD.
Controls on Soft Tissue and Cellular Preservation in Late Eocene and Oligocene Vertebrate Fossils from the White River and Arikaree Groups of Nebraska, South Dakota, and Wyoming
Authors: Gallucci John , Woolslayer Grace , Barker Kelsey , Kibelstis Brian , Tumarkin-Deratzian Allison , Ullmann Paul , Grandstaff David , Terry Dennis
Published: May 2024

Previous studies on microtaphonomy have identified multiple types of organic microstructures in fossil vertebrates from a variety of time periods and past environmental settings. This study investigates potential taphonomic, paleoenvironmental, and paleoclimatic controls on soft tissue and cellular preservation in fossil bone. To this end, fifteen vertebrate fossils were studied: eight fossils collected from the Oligocene Sharps Formation of the Arikaree Group in Badlands National Park, South Dakota, and seven fossils from formations in the underlying White River Group, including the Oligocene Brule Formation of Badlands National Park, and the Eocene Chadron Formation of Flagstaff Rim, Wyoming; Toadstool Geologic Park, Nebraska; and Badlands National Park, South Dakota. A portion of each fossil was demineralized to identify any organic microstructures preserved within the fossils. We investigated several factors which may have influenced cellular/soft tissue decay and/or preservation pathways, including taxonomic identity, paleoclimatic conditions, depositional environment, and general diagenetic history (as interpreted through thin section analysis). Soft tissue microstructures were preserved in all fossil samples, and cellular structures morphologically consistent with osteocytes were recovered from 11 of the 15 fossil specimens. Preservation of these microstructures was found to be independent of taxonomy, paleoclimate regime, apatite crystallinity, depositional environment, and general diagenetic history, indicating that biogeochemical reactions operating within microenvironments within skeletal tissues, such as within individual osteocyte lacunae or Haversian canals, may exert stronger controls on soft tissue and biomolecular decay or stabilization than external environmental (or climatic) conditions.
High-Efficiency Ag-Modified ZnO/g-C3N4 Photocatalyst with 1D-0D-2D Morphology for Methylene Blue Degradation
Authors: Qiu Shuyao , Li Jin
Published: May 2024

Photocatalysts with different molar ratios of Ag-modified ZnO to g-C3N4 were prepared through an electrostatic self-assembly method and characterized through techniques such as X-ray diffraction, Fourier transform infrared spectroscopy, and scanning electron microscopy. The resulting Ag-ZnO/g-C3N4 photocatalysts exhibited a unique 1D-0D-2D morphology and Z-type heterojunction. Moreover, g-C3N4 nanosheets with large layer spacing were prepared using acid treatment and thermal stripping methods. The Z-type heterostructure and localized surface plasmon resonance effect of Ag nanowires enabled high-speed electron transfer between the materials, while retaining large amounts of active substances, and broadened the light response range. Because of these features, the response current of the materials improved, and their impedance and photoluminescence reduced. Among the synthesized photocatalysts, 0.05Ag-ZnO/g-C3N4 (molar ratio of g-C3N4/ZnO: 0.05) exhibited the highest photocatalytic performance under UV–visible light. It degraded 98% of methylene blue in just 30 min, outperforming both g-C3N4 (21% degradation in 30 min) and Ag-ZnO (84% degradation in 30 min). In addition, 0.05Ag-ZnO/g-C3N4 demonstrated high cycling stability.
The Simultaneous Efficient Recovery of Ammonia Nitrogen and Phosphate Resources in the Form of Struvite: Optimization and Potential Applications for the Electrochemical Reduction of NO3−
Authors: Li Liping , Bi Jingtao , Sun Mengmeng , Wang Shizhao , Guo Xiaofu , Li Fei , Liu Jie , Zhao Yingying
Published: May 2024

In response to the need for improvement in the utilization of ammonium-rich solutions after the electrochemical reduction of nitrate (NO3−–RR), this study combined phosphorus-containing wastewater and adopted the electrochemical precipitation method for the preparation of struvite (MAP) to simultaneously recover nitrogen and phosphorus resources. At a current density of 5 mA·cm−2 and an initial solution pH of 7.0, the recovery efficiencies for nitrogen and phosphorus can reach 47.15% and 88.66%, respectively. Under various experimental conditions, the generated struvite (MgNH4PO4·6H2O) exhibits a typical long prismatic structure. In solutions containing nitrate and nitrite, the coexisting ions have no significant effect on the final product, struvite. Finally, the characterization of the precipitate product by X-ray diffraction (XRD) revealed that its main component is struvite, with a high purity reaching 93.24%. Overall, this system can effectively recover ammonium nitrogen from the NO3−–RR solution system after nitrate reduction, with certain application prospects for the recovery of ammonium nitrogen and phosphate.
Optimization of the Extraction Process and Biological Activities of Triterpenoids of Schisandra sphenanthera from Different Medicinal Parts and Growth Stages
Authors: Zhao Qiaozhu , Li Jianhua , Shang Qianqian , Jiang Jiafang , Pu Han , Fang Xilin , Qin Xiaolu , Zhou Jia , Wang Nongxue , Wang Xiaorui , Gu Wei
Published: May 2024

Schisandra sphenanthera Rehd. et Wils., as a traditional Chinese medicine, has important medicinal value. In the market, the availability of the fruit of S. sphenanthera mainly relies on wild picking, but many canes and leaves are discarded during wild collection, resulting in a waste of resources. The canes and leaves of S. sphenanthera contain various bioactive ingredients and can be used as spice, tea, and medicine and so present great utilization opportunities. Therefore, it is helpful to explore the effective components and biological activities of the canes and leaves to utilize S. sphenanthera fully. In this study, the response surface method with ultrasound was used to extract the total triterpenoids from the canes and leaves of S. sphenanthera at different stages. The content of total triterpenoids in the leaves at different stages was higher than that in the canes. The total triterpenoids in the canes and leaves had strong antioxidant and antibacterial abilities. At the same time, the antibacterial activity of the total triterpenoids against Bacillus subtilis and Pseudomonas aeruginosa was stronger than that against Staphylococcus aureus and Escherichia coli. This study provides the foundation for the development and utilization of the canes and leaves that would relieve the shortage of fruit resources of S. sphenanthera.
Systematic Study of Different Types of Interactions in α-, β- and γ-Cyclodextrin: Quantum Chemical Investigation
Authors: Bakó Imre , Jicsinszky László , Pothoczki Szilvia
Published: May 2024

In this work, comprehensive ab initio quantum chemical calculations using the DFT level of theory were performed to characterize the stabilization interactions (H-bonding and hyperconjugation effects) of two stable symmetrical conformations of α-, β-, and γ-cyclodextrins (CDs). For this purpose, we analyzed the electron density using “Atom in molecules” (AIM), “Natural Bond Orbital” (NBO), and energy decomposition method (CECA) in 3D and in Hilbert space. We also calculated the H-bond lengths and OH vibrational frequencies. In every investigated CD, the quantum chemical descriptors characterizing the strength of the interactions between the H-bonds of the primary OH (or hydroxymethyl) and secondary OH groups are examined by comparing the same quantity calculated for ethylene glycol, α-d-glucose (α-d-Glcp) and a water cluster as reference systems. By using these external standards, we can characterize more quantitatively the properties of these bonds (e.g., strength). We have demonstrated that bond critical points (BCP) of intra-unit H-bonds are absent in cyclodextrins, similar to α-d-Glcp and ethylene glycol. In contrast, the CECA analysis showed the existence of an exchange (bond-like) interaction between the interacting O…H atoms. Consequently, the exchange interaction refers to a chemical bond, namely the H-bond between two atoms, unlike BCP, which is not suitable for its detection.
Exciton Delocalization and Polarizability in Perylenetetracarboxylic Diimide Probed Using Electroabsorption and Fluorescence Spectroscopies
Authors: Rahman Md. Bulu , Islam Ahatashamul , Iimori Toshifumi
Published: May 2024

Perylenetetracarboxylic diimide (PTCDI) is an n-type organic semiconductor molecule that has been widely utilized in numerous applications such as photocatalysis and field-effect transistors. Polarizability and dipole moment, which are inherent properties of molecules, are important parameters that determine their responses to external electric and optical fields, physical properties, and reactivity. These parameters are fundamentally important for the design of innovative materials. In this study, the effects of external electric fields on absorption and fluorescence spectra were investigated to obtain the PTCDI parameters. The PTCDI substituted by an octyl group (N,N′-Dioctyl-3,4,9,10-perylenedicarboximide) dispersed in a polymethyl methacrylate (PMMA) matrix was studied in this work. The features of vibronic progression in the absorption spectrum were analogous to those observed in solution. The red shift of the absorption band caused by the Stark effect was mainly observed in the presence of an external electric field. Changes in parameters such as the dipole moment and polarizability between the ground and the Franck–Condon excited states of the PTCDI monomer were determined. The fluorescence spectrum shows a contribution from a broad fluorescence band at wavelengths longer than the monomer fluorescence band. This broad fluorescence is ascribed to the excimer-like fluorescence of PTCDI. The effects of the electric field on the fluorescence spectrum, known as the Stark fluorescence or electrofluorescence spectrum, were measured. Fluorescence quenching is observed in the presence of an external electric field. The change in the polarizability of the monomer fluorescence band is in good agreement with that of the electroabsorption spectrum. A larger change in the polarizability was observed for the excimer-like fluorescence band than that for the monomer band. This result is consistent with exciton delocalization between PTCDI molecules in the excimer-like state.
Removal of Cr(VI) from Wastewater Using Acrylonitrile Grafted Cellulose Extracted from Sugarcane Bagasse
Authors: Khan Idrees , Ali Ashraf , Naz Alia , Baig Zenab Tariq , Shah Wisal , Rahman Zia Ur , Shah Tawaf Ali , Attia Kotb A. , Mohammed Arif Ahmed , Hafez Yaser M.
Published: May 2024

A highly efficient low-cost adsorbent was prepared using raw and chemically modified cellulose isolated from sugarcane bagasse for decontamination of Cr(VI) from wastewater. First, cellulose pulp was isolated from sugarcane bagasse by subjecting it to acid hydrolysis, alkaline hydrolysis and bleaching with sodium chlorate (NaClO3). Then, the bleached cellulose pulp was chemically modified with acrylonitrile monomer in the presence Fenton’s reagent (Fe+2/H2O2) to carry out grafting of acrylonitrile onto cellulose by atom transfer radical polymerization. The developed adsorbent (acrylonitrile grafted cellulose) was analyzed by X-ray diffraction analysis (XRD), scanning electron microscopy (SEM) and Fourier transform infrared spectroscopy (FT-IR). Both raw cellulose and acrylonitrile grafted cellulose were used for chromium removal from wastewater. The effects of metal ion concentration, pH, adsorbent dose and time were studied, and their values were optimized. The optimum conditions for the adsorption of Cr(VI) onto raw and chemically modified cellulose were: metal ion concentration: 50 ppm, adsorbent dose: 1 g, pH: 6, and time: 60 min. The maximum efficiencies of 73% and 94% and adsorption capacities of 125.95 mg/g and 267.93 mg/g were achieved for raw and acrylonitrile grafted cellulose, respectively. High removal efficiency was achieved, owing to high surface area of 79.92 m2/g and functional active binding cites on grafted cellulose. Isotherm and kinetics studies show that the experimental data were fully fitted by the Freundlich isotherm model and pseudo first-order model. The adsorbent (acrylonitrile grafted cellulose) was regenerated using three different types of regenerating reagents and reused thirty times, and there was negligible decrease (19%) in removal efficiency after using it for 30 times. Hence, it is anticipated that acrylonitrile could be utilized as potential candidate material for commercial scale Cr(VI) removal from wastewater.
New Cocrystals of Ligustrazine: Enhancing Hygroscopicity and Stability
Authors: Xie Yifei , Gong Lixiang , Tao Yue , Zhang Baoxi , Zhang Li , Yang Shiying , Yang Dezhi , Lu Yang , Du Guanhua
Published: May 2024

Ligustrazine (TMP) is the main active ingredient extracted from Rhizoma Chuanxiong, which is used in the treatment of cardiovascular and cerebrovascular diseases, with the drawback of being unstable and readily sublimated. Cocrystal technology is an effective method to improve the stability of TMP. Three benzoic acid compounds including P-aminobenzoic acid (PABA), 3-Aminobenzoic acid (MABA), and 3,5-Dinitrobenzoic acid (DNBA) were chosen for co-crystallization with TMP. Three novel cocrystals were obtained, including TMP-PABA (1:2), TMP-MABA (1.5:1), and TMP-DNBA (0.5:1). Hygroscopicity was characterized by the dynamic vapor sorption (DVS) method. Three cocrystals significantly improved the hygroscopicity stability, and the mass change in TMP decreased from 25% to 1.64% (TMP-PABA), 0.12% (TMP-MABA), and 0.03% (TMP-DNBA) at 90% relative humidity. The melting points of the three cocrystals were all higher than TMP, among which the TMP-DNBA cocrystal had the highest melting point and showed the best stability in reducing hygroscopicity. Crystal structure analysis shows that the mesh-like structure formed by the O-H⋯N hydrogen bond in the TMP-DNBA cocrystal was the reason for improving the stability of TMP.
Chromatographic Assessment of Organic Compounds Using Carbon Nanotubes: The Relationship between Affinity and Dispersibility
Authors: Shimizu Taiyo , Kishi Ryoichi , Hirano Atsushi , Kokubo Ken , Hata Kenji
Published: May 2024

The affinity between carbon nanotubes (CNTs) and organic compounds is of substantial importance since it strongly relates to the dispersibility of CNTs in those compounds. Several affinity evaluation methods have been developed so far, and the concept of the Hansen solubility parameter is a representative method widely used in the field of nanocarbon materials. Here, we demonstrate that CNT-loaded silica columns can effectively assess the affinity of organic compounds for CNT surface by exploiting the chromatographic retention time as a criterion. Obtained trends of the affinity of organic compounds for CNT were compared to those based on Hansen solubility parameter distance values. Most organic compounds showed similar trends, but one exceptional compound was observed. Simple CNT dispersion tests were conducted with these organic compounds to demonstrate the advantage of the chromatographic assessment. Further, we conducted comparison experiments using a pyrene-functionalized column and other CNT-loaded columns to elucidate the characteristics of each CNT column. The chromatographic approaches using CNT columns would be beneficial for realizing CNT suspensions with improved CNT dispersibility.
Magnetic Material in Triboelectric Nanogenerators: A Review
Authors: Sun Enqi , Zhu Qiliang , Rehman Hafeez Ur , Wu Tong , Cao Xia , Wang Ning
Published: May 2024

Nowadays, magnetic materials are also drawing considerable attention in the development of innovative energy converters such as triboelectric nanogenerators (TENGs), where the introduction of magnetic materials at the triboelectric interface not only significantly enhances the energy harvesting efficiency but also promotes TENG entry into the era of intelligence and multifunction. In this review, we begin from the basic operating principle of TENGs and then summarize the recent progress in applications of magnetic materials in the design of TENG magnetic materials by categorizing them into soft ferrites and amorphous and nanocrystalline alloys. While highlighting key role of magnetic materials in and future opportunities for improving their performance in energy conversion, we also discuss the most promising choices available today and describe emerging approaches to create even better magnetic TENGs and TENG-based sensors as far as intelligence and multifunctionality are concerned. In addition, the paper also discusses the integration of magnetic TENGs as a power source for third-party sensors and briefly explains the self-powered applications in a wide range of related fields. Finally, the paper discusses the challenges and prospects of magnetic TENGs.
In Vivo Administration of Phosphatidic Acid, a Direct Alcohol Target Rescues Fetal Growth Restriction and Maternal Uterine Artery Dysfunction in Rat FASD Model
Authors: Janeski Joseph D. , Naik Vishal D. , Carabulea Alexander L. , Jiang Hong , Ramadoss Jayanth
Published: May 2024

Fetal growth restriction is a hallmark of Fetal Alcohol Syndrome (FAS) and is accompanied by maternal uterine circulatory maladaptation. FAS is the most severe form of Fetal Alcohol Spectrum Disorder (FASD), a term for the range of conditions that can develop in a fetus when their pregnant mother consumes alcohol. Alcohol exerts specific direct effects on lipids that control fundamental developmental processes. We previously demonstrated that direct in vitro application of phosphatidic acid (PA, the simplest phospholipid and a direct target of alcohol exposure) to excised uterine arteries from alcohol-exposed rats improved vascular function, but it is unknown if PA can rescue end organ phenotypes in our FASD animal model. Pregnant Sprague-Dawley rats (n = 40 total dams) were gavaged daily from gestational day (GD) 5 to GD 19 with alcohol or maltose dextrin, with and without PA supplementation, for a total of four unique groups. To translate and assess the beneficial effects of PA, we hypothesized that in vivo administration of PA concomitant with chronic binge alcohol would reverse uterine artery dysfunction and fetal growth deficits in our FASD model. Mean fetal weights and placental efficiency were significantly lower in the binge alcohol group compared with those in the control (p < 0.05). However, these differences between the alcohol and the control groups were completely abolished by auxiliary in vivo PA administration with alcohol, indicating a reversal of the classic FAS growth restriction phenotype. Acetylcholine (ACh)-induced uterine artery relaxation was significantly impaired in the uterine arteries of chronic in vivo binge alcohol-administered rats compared to the controls (p < 0.05). Supplementation of PA in vivo throughout pregnancy reversed the alcohol-induced vasodilatory deficit; no differences were detected following in vivo PA administration between the pair-fed control and PA alcohol groups. Maximal ACh-induced vasodilation was significantly lower in the alcohol group compared to all the other treatments, including control, control PA, and alcohol PA groups (p < 0.05). When analyzing excitatory vasodilatory p1177-eNOS, alcohol-induced downregulation of p1177-eNOS was completely reversed following in vivo PA supplementation. In summary, these novel data utilize a specific alcohol target pathway (PA) to demonstrate a lipid-based preventive strategy and provide critical insights important for the development of translatable interventions.
Bioavailability of Lutein from Marigold Flowers (Free vs. Ester Forms): A Randomised Cross-Over Study to Assess Serum Response and Visual Contrast Threshold in Adults
Authors: Olmedilla-Alonso Begoña , Granado-Lorencio Fernando , Castro-Feito Julio , Herrero-Barbudo Carmen , Blanco-Navarro Inmaculada , Estévez-Santiago Rocío
Published: May 2024

Lutein (Lut) and zeaxanthin (Zeax) are found in the blood and are deposited in the retina (macular pigment). Both are found in the diet in free form and esterified with fatty acids. A high intake and/or status is associated with a lower risk of chronic diseases, especially eye diseases. There is a large global demand for Lut in the dietary supplement market, with marigold flowers being the main source, mainly as lutein esters. As the bioavailability of Lut from free or ester forms is controversial, our aim was to assess the bioavailability of Lut (free vs. ester) and visual contrast threshold (CT). Twenty-four healthy subjects (twelve women, twelve men), aged 20–35 and 50–65 years, were enrolled in a cross-sectional study to consume 6 mg lutein/day from marigold extract (free vs. ester) for two months. Blood samples were taken at baseline and after 15, 40, and 60 days in each period. Serum Lut and Zeax were analysed using HPLC, and dietary intake was determined with a 7-day food record at the beginning of each period. CT, with and without glare, was at 0 and 60 days at three levels of visual angle. Lut + Zeax intake at baseline was 1.9 mg/day, and serum lutein was 0.36 µmol/L. Serum lutein increased 2.4-fold on day 15 (up to 0.81 and 0.90 µmol/L with free and ester lutein, respectively) and was maintained until the end of the study. Serum Zeax increased 1.7-fold. There were no differences in serum Lut responses to free or ester lutein at any time point. CT responses to lutein supplementation (free vs. ester) were not different at any time point. CT correlated with Lut under glare conditions, and better correlations were obtained at low frequencies in the whole group due to the older group. The highest correlations occurred between CT at high frequency and with glare with serum Lut and Lut + Zeax. Only in the older group were inverse correlations found at baseline at a high frequency with L + Z and with Lut/cholesterol and at a low frequency with Lut/cholesterol. In conclusion, daily supplementation with Lut for 15 days significantly increases serum Lut in normolipemic adults to levels associated with a reduced risk of age-related eye disease regardless of the chemical form of lutein supplied. Longer supplementation, up to two months, does not significantly alter the concentration achieved but may contribute to an increase in macular pigment (a long-term marker of lutein status) and thus improve the effect on visual outcomes.
Adherence to the Mediterranean Diet, Sodium and Potassium Intake in People at a High Risk of Dementia
Authors: Rodrigues Joana , Costa Mariana , Sousa Daniela de , Costa Ana Rute , Lunet Nuno , Cruz Vítor Tedim , Padrão Patrícia
Published: May 2024

Adequate sodium and potassium intake, along with adherence to the Mediterranean diet (MedDiet), are key factors for preventing hypertension and cerebrovascular diseases. However, data on the consumption of these nutrients within the MedDiet are scarce. This cross-sectional study aims to assess the association between MedDiet adherence and sodium/potassium intake in the MIND-Matosinhos randomized controlled trial, targeting Portuguese adults at a high risk of dementia. Good adherence to the MedDiet was defined using the Portuguese Mediterranean Diet Adherence Screener questionnaire (≥10 points), and both sodium/potassium intakes were estimated from 24-hour urine collections. The association between MedDiet adherence and these nutrients’ intake (dichotomized by the median) was quantified by calculating odds ratios (OR) and respective 95% confidence intervals (95% CI) using a logistic regression. A total of 169 individuals (60.9% female; median age: 70 years; range: 36–85 years) were included. Good adherence to the MedDiet was observed among 18.3% of the sample. After adjusting for sex, age, education and using antihypertensive drugs, good MedDiet adherence was associated with higher sodium (OR = 3.11; 95% CI: 1.27–7.65) and potassium intake (OR = 9.74; 95% CI: 3.14–30.26). Increased adherence to the MedDiet may contribute to a higher potassium intake but seems to have limited effects on the adequacy of sodium levels.