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Rational effect of CuSe2phase with octadecyl amine modified reduced graphene composite for dual-mode sensing of environmental hazardous anthelminthic drug in aquatic and biological samples

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Journal of Environmental Chemical engineering 2023年第1期11卷

作者： Hwa, Kuo-Yuan Ganguly, Anindita Santhan, Aravindan Department of Molecular Science and Engineering National Taipei University of Technology Taipei Taiwan International Graduate Program in Energy and Optoelectronic Materials National Taipei University of Technology Taipei Taiwan

The increasing usage of antihelminthic drug mebendazole (MEB) in humans and livestock poses serious threat and is considered a significant environmental pollutant. Hence, monitoring the MEB residues in environmental samples, and human fluids is essential to decrease the ecological risk and improve the health of humans. In this work, copper selenide (CuSe2) nano/microspheres were hydrothermally synthesized and ultrasonically treated with rGO surface modified with ODA alkyl amine (rGO-ODA). The optical, structural, morphological, and functional analysis were performed which revealed the CuSe2 in marcasite phase, orthorhombic pattern with Pnnm space group, and substantial composite formation. The morphological studies revealed sphere structure of the CuSe2 and wrinkled sheets of rGO-ODA. A sensor that detects MEB using the cyclic voltammetry (CV), differential pulse voltammetry (DPV) and UV-Vis absorbance techniques was developed. For DPV analysis, the sensor exhibited a very low value for limit of detection 13.55 nM and a sensitivity of 9.4871 μA M-1cm-2. For UV-Vis, the sensor demonstrated a very low limit of detection 22.3 nM. The use of this sensor was validated in real-time analysis with aquatic and biological real samples. The results suggested > 90% of analyte recovery and enhanced efficiency for MEB detection with a potential for commercialization in future. © 2022 Elsevier Ltd.

关键词： Copper compounds

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Two-dimensional perovskites with maximum symmetry enable exciton diffusion length exceeding 2 micrometers

arXiv

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arXiv 2025年

作者： Hou, Jin Fletcher, Jared Hall, Siedah J. Zhang, Hao Zacharias, Marios Volonakis, George Welton, Claire Mandani, Faiz Metcalf, Isaac Sun, Shuo Zhang, Bo Guo, Yinsheng Reddy, G.N. Manjunatha Katan, Claudine Even, Jacky Sfeir, Matthew Y. Kanatzidis, Mercouri G. Mohite, Aditya D. Department of Materials Science and NanoEngineering Rice University HoustonTX77005 United States Department of Chemistry Department of Materials Science and Engineering Northwestern University EvanstonIL60208 United States Photonics Initiative Advanced Science Research Center City University of New York New York10031 United States Department of Physics The Graduate Center City University of New York New York10016 United States Department of Chemical and Biomolecular Engineering Rice University HoustonTX77005 United States Applied Physics Graduate Program Smalley‐Curl Institute Rice University HoustonTX77005 United States Univ Rennes INSA Rennes CNRS Institut FOTON UMR 6082 Rennes35708 France UMR 6226 RennesF-35000 France University of Lille CNRS Centrale Lille Institute Univ. Artois UMR 8181−UCCS− Unité de Catalyse et Chimie du Solide LilleF-59000 France Department of Chemistry University of Nebraska-Lincoln LincolnNE68588 United States

Realizing semiconductors with high symmetry of their crystallographic structures has been a virtue of inorganic materials and has resulted in novel physical behaviors. In contrast, hybrid (organic and inorganic) crystals such as two-dimensional metal halide perovskites exhibit much lower crystal symmetry due to in-plane or out-of-plane octahedral distortions. Despite their amazing ability for photoinduced light emission at room temperature, the Achilles' heel of this attractive class of 2D materials for optoelectronics remains the poor control and lack of performance for charge carrier transport. Inspired by the tremendous charge carrier properties of the 3D cubic perovskite phase (α) of FAPbI3 and combining the use of the appropriate cage cation, the spacer molecule and the temperature and rate of crystallization, we report a new series of FA-based layered two-dimensional perovskites that exhibits the highest theoretically predicted symmetry with a tetragonal P4/mmm space group, resulting in no octahedral distortion in both in-plane and out-of-plane directions. These 2D perovskites present the shortest interlayer distances (4 Å), which results in systematically lower bandgaps (1.7 to 1.8 eV). Finally, the absence of octahedral distortions, results in an exciton diffusion length of 2.5 µm, and a diffusivity of 4.4 cm2s-1, both of which are an order of magnitude larger compared to previously reported 2D perovskites and on par with monolayer transition metal dichalcogenides. © 2025, CC BY.

关键词： Charge carriers

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Model for biological communication in a nanofabricated cell-mimic driven by stochastic resonance

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Nano Communication Networks 2011年第1期2卷 39-49页

作者： Karig, David K. Siuti, Piro Dar, Roy D. Retterer, Scott T. Doktycz, Mitchel J. Simpson, Michael L. Center for Nanophase Materials Sciences Oak Ridge National Laboratory Bethel Valley Road Oak Ridge TN 37831 United States Biosciences Division Oak Ridge National Laboratory Oak Ridge TN 37831 United States Graduate Program in Genome Science and Technology University of Tennessee Knoxville TN 37996 United States Department of Physics and Astronomy University of Tennessee Knoxville TN 37996-2010 United States Department of Materials Science and Engineering University of Tennessee Knoxville TN 37996-2010 United States Center for Environmental Biotechnology University of Tennessee Knoxville TN 37996-2010 United States

Cells offer natural examples of highly efficient networks of nanomachines. Accordingly, both intracellular and intercellular communication mechanisms in nature are looked to as a source of inspiration and instruction for engineered nanocommunication. Harnessing biological functionality in this manner requires an interdisciplinary approach that integrates systems biology, synthetic biology, and nanofabrication. Here, we present a model system that exemplifies the synergism between these realms of research. We propose a synthetic gene network for operation in a nanofabricated cell mimic array that propagates a biomolecular signal over long distances using the phenomenon of stochastic resonance. Our system consists of a bacterial quorum sensing signal molecule, a bistable genetic switch triggered by this signal, and an array of nanofabricated cell mimic wells that contain the genetic system. An optimal level of noise in the system helps to propagate a time-varying AHL signal over long distances through the array of mimics. This noise level is determined both by the system volume and by the parameters of the genetic network. Our proposed genetically driven stochastic resonance system serves as a testbed for exploring the potential harnessing of gene expression noise to aid in the transmission of a time-varying molecular signal. © 2011.

关键词： Gene expression

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Unravelling the strong interplay for interfacial magnetic switching in metal-organic-based spintronics

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Journal of materials Chemistry C 2024年第11期12卷 3931-3942页

作者： Chen, Wan-Ting Yu, Li-Chung Lin, Jiu-Hua Cheng, Su Ling Shiu, Hung Wei Lai, Yu-Ling Chu, Ying-Hao Chin, Yi-Ying Wang, Jeng-Han Hsu, Yao-Jane National Synchrotron Radiation Research Center Hsinchu30076 Taiwan Graduate Program for Science and Technology of Accelerator Light Sources National Yang Ming Chiao Tung University Hsinchu30076 Taiwan Department of Materials Science and Engineering National Tsing Hua University Hsinchu30013 Taiwan Department of Chemistry National Taiwan Normal University Taipei11677 Taiwan Department of Photonics National Cheng Kung University Tainan70101 Taiwan Department of Physics National Chung Cheng University Chiayi62102 Taiwan

Organic semiconductors are promising building blocks for multifunctional spintronics. The spinterface plays a key role in affecting the magnetic properties of the performance of spin-based devices. Herein, we reveal the strong interfacial interplay affecting the magnetic switching at the interface of the synthetic paramagnetic tris(8-hydroxyquinoline)iron(iii) (Feq3) layer on the ferromagnetic surface. In combination with synchrotron-based analysis and density functional theory (DFT) calculations, we observed that the robust magnetic interactions of the Co/Feq3 system were strongly influenced by the interfacial reaction between Co and Feq3. As the charge transferred from the contacted Co to Feq3, the central iron was reduced from Fe(iii) to Fe(ii) and hybridized with the 8-hydroxyquinoline, causing spin polarization at the interface. The reduced central Fe(ii) exhibited apparent ferromagnetic ordering after contact with the ferromagnetic Co substrate. With increasing the Feq3 layer thickness, the central Fe reverted to its original Fe(iii) state, resulting in the disappearance of ferromagnetic ordering. The thickness dependence of the Feq3 layer on the magnetic response could be used to tune the spinterface properties and thus the interfacial magnetic interplay. These findings reveal the effect of the strong interfacial redox on the spinterface and open up a promising approach for the use of metal-organic materials in oragnic spintronic devices. © 2024 The Royal Society of Chemistry.

关键词： Organometallics

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Influence of MIG/MAG Welding Process on Mechanical and Pitting Corrosion Behaviors on the Super-Duplex Stainless Steel SAF 2507 Welded Joints

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materials sciences and Applications 2018年第2期9卷 228-245页

作者： Bruno Leonardy S. Lopes Samuel F. Rodrigues Eden S. Silva Gedeon S. Reis Waldemir dos P. Martins Juvenilson Costa Damascena Valdemar S. Leal Graduate Program in Materials Engineering Federal Institute of Education Science and Technology of Maranh&atilde o—IFMA S&atilde o Luís MA Brazil Engineering Coordination Universidade UNICEUMA S&atilde o Luís MA Brazil

The main objective of this research is to better understand the correlation between the constituent phases presented in the super-duplex steel SAF 2507 when it is under welding process by arc shielding gas MIG-MAG (Metal Inert Gas-Metal Active Gas). Conventional short circuit transfer and derivative STT (Surface Tension Transfer) using the 2594 welding wire as a filler metal and the effects on welding power in hardness, toughness and pitting corrosion are considered here. The results showed that the welding energy (Ew) changed the α/γ-phase’s balance and occasionally formed σ-phase in ferrite grain boundaries which led to changes in hardness, toughness and pitting corrosion resistance in molten zone (MZ), heat activated zone (HAZ) and metal base regions (MB). Furthermore, the increased amount of γ-phase improved the pitting corrosion resistance index (PRENγ) mainly in the MZ. This is due to decrease of α-phase fraction and formation of coarser grains, for higher welding energy. The toughness in the MZ decreased with less formation of γ-phase, coalescence of ferritic grains and localized formation of σ-phase, raising the hardness in the HAZ when the welding energy was lower.

关键词： Super-Duplex Steels Welding Toughness Pitting Corrosion Microhardness

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Infrared Spectra Prediction for Diazo Groups Utilizing a Machine Learning Approach with Structural Attention Mechanism

arXiv

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arXiv 2024年

作者： Liu, Chengchun Mo, Fanyang School of Materials Science and Engineering Peking University Beijing100871 China -Preferred Program Peking University Shenzhen Graduate School Shenzhen518055 China

Infrared (IR) spectroscopy is a pivotal technique in chemical research for elucidating molecular structures and dynamics through vibrational and rotational transitions. However, the intricate molecular fingerprints characterized by unique vibrational and rotational patterns present substantial analytical challenges. Here, we present a machine learning approach employing a Structural Attention Mechanism tailored to enhance the prediction and interpretation of infrared spectra, particularly for diazo compounds. Our model distinguishes itself by honing in on chemical information proximal to functional groups, thereby significantly bolstering the accuracy, robustness, and interpretability of spectral predictions. This method not only demystifies the correlations between infrared spectral features and molecular structures but also offers a scalable and efficient paradigm for dissecting complex molecular interactions. Copyright © 2024, The Authors. All rights reserved.

关键词： Molecular structure

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Evaluation of Single and Duplex Plasma Treatment Applied to Aisi 409 Stainless Steel

SSRN

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SSRN 2024年

作者： do Monte e Silva, André Felipe Soares de Almeida, Larissa Solano Monteiro, Leandro Rossino, Luciana Sgarbi Nunes, Maelson Sousa Libório, Maxwell Santana de Carvalho Costa, Thércio Henrique Bandeira, Rafael Marinho de Sousa, Rômulo Ribeiro Magalhães Post-Graduate Materials Science and Engineering Program Federal University of Piauí PI Teresina Brazil Post-Graduate Program in Materials Science Federal University of São Carlos São Carlos Brazil Post-Graduate Program in Chemistry Federal University of Piauí PI Teresina Brazil School of Science and Technology Federal University of Rio Grande do Norte RN Natal Brazil Brazil Department of Mechanical Engineering Federal University of Piauí PI Teresina Brazil Brazil

The industrial landscape has witnessed a growing demand for components exhibiting superior performance and extended lifespan, especially in parts made of stainless steels like AISI 409 steel, widely used in automotive exhaust systems, heat exchangers, and lightweight structural components. This study investigates the enhancement of surface properties of AISI 409 stainless steel through cathodic cage plasma nitriding (CCPN) and cathodic cage plasma deposition (CCPD) processes, focusing on the novel implementation of duplex treatments. The research aims to improve the mechanical strength, wear resistance, and corrosion resistance of the steel by forming nitrides and vanadium nitride films on its surface. The duplex treatments, specifically N400D450 and N450D450, were found to significantly enhance the hardness of AISI 409 stainless steel, with the N450D450 sample achieving a maximum hardness of 1100 HV—a 461.22% increase compared to the untreated steel. This enhancement is attributed to the formation of a thick, uniform nitrided layer followed by a vanadium nitride film. The critical role of processing order was highlighted, with the sequence of nitriding followed by deposition proving more effective than the reverse. Corrosion resistance was markedly improved in the duplex-treated samples. The N450D450 sample exhibited an Ecorr of -198 mV and reduced jcorr values, indicating superior resistance to corrosive environments. These results underscore the synergistic effect of combining nitriding and vanadium deposition, which optimizes the formation of protective surface layers. Overall, this study demonstrates that duplex treatments significantly enhance the surface properties of AISI 409 stainless steel, offering the potential for extended component lifespan and reduced maintenance in industrial applications. The findings suggest that careful control of process parameters and treatment sequence is essential for achieving optimal results. © 2024, The Authors. All rights

关键词： Tribology

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In-plane Wilson loop for measurement of quantized non-Abelian Berry flux

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Physical Review B 2024年第19期109卷 195149-195149页

作者： Alexander C. Tyner Shouvik Sur Qunfei Zhou Danilo Puggioni Pierre Darancet James M. Rondinelli Pallab Goswami Graduate Program in Applied Physics Northwestern University Evanston Illinois 60208 USA Department of Physics and Astronomy Northwestern University Evanston Illinois 60208 USA Materials Research Science and Engineering Center Northwestern University Evanston Illinois 60208 USA Center for Nanoscale Materials Argonne National Laboratory Argonne Illinois 60439 USA Department of Materials Science and Engineering Northwestern University Evanston Illinois 60208 USA Northwestern Argonne Institute for Science and Engineering Evanston Illinois 60208 USA

Band topology of anomalous quantum Hall insulators can be precisely addressed by computing the Chern numbers of constituent nondegenerate bands, describing the presence of quantized, Abelian Berry flux through the two-dimensional Brillouin zone. Can Berry flux be captured for the SU(2) Berry connection of two-fold degenerate bands in spinful materials preserving space-inversion (P) and time-reversal (T) symmetries without detailed knowledge of underlying basis? We address this question by investigating the correspondence between a non-Abelian generalization of Stokes' theorem and the manifestly gauge-invariant eigenvalues of Wilson loops computed along in-plane contours which preserve the underlying crystalline symmetry. The importance of this correspondence is elucidated by performing natural number resolved classification of ab initio band structures of three-dimensional, Dirac materials. Our work underscores how identification of quantized Berry flux, both Abelian and non-Abelian, offers a unified framework for addressing first-order and higher-order topology of insulators and semimetals.

关键词： Electronic structure of atoms & molecules First-principles calculations Topological insulators

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Deformation of Porous, Nanostructured Silver at Room Temperature and 150 °C

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MRS Online Proceedings Library 2013年第1期1513卷 1-6页

作者： Noiseau, Guillaume Becker, Michael F. Keto, John W. Kovar, Desiderio Materials Science and Engineering Graduate Program The University of Texas at Austin Austin USA Department of Electrical and Computer Engineering The University of Texas Austin USA Department of Physics The University of Texas Austin USA Department of Mechanical Engineering The University of Texas Austin USA

Porous, nanostructured silver samples were produced using a direct-write method where a nanoparticle aerosol consisting of particles with a mean size of approximately 5 nm were accelerated to speeds of approximately 1000 m/sec and impacted onto a translating substrate [1]. The impacting particles have sufficient energy to stick to the substrate, allowing patterned thick films to be directly written from the aerosol without a mask. Unlike other low temperature processing routes for achieving patterned films, no organics are added that can interfere with postdeposition processing. Typical films are 5- 100 μm thick, up to several centimeters long, and have an as-deposited relative densities as high as 70% of bulk Ag. Compression tests were carried out in steps at room temperature and at 150°C under constant displacement rates. Local strain and densification were measured by optical profilometry between each compression step. The results can be used as a starting point to better understand the mechanisms that govern plasticity, creep, and sintering in nanostructured, porous silver at low processing temperatures.

关键词： Ag densification nanoscale

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Polyetheretherketone (PEEK) Implant Functionalization with Magnetron-Sputtered SrTiO3 for Regenerative Medicine

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Plasma Medicine 2023年第3期13卷 53-67页

作者： Harumningtyas, Anjar Anggraini Ito, Tomoko Ikuta, Masato Kaito, Takashi Hamaguchi, Satoshi International Priority Graduate Program on Applied and Engineering Physics Division of Precision Engineering and Applied Physics Osaka University Osaka Japan Yogyakarta Indonesia Division of Materials and Manufacturing Science Graduate School of Engineering Osaka University Osaka Japan Department of Orthopaedic Surgery Osaka University Graduate School of Medicine Osaka Japan

Polyetheretherketone (PEEK) is a polymer widely used for artificial bone implants but exhibits a low affinity for bone tissue and lacks osteoconductivity and osseointegration. Because strontium (Sr) is known to enhance bone growth, PEEK implants coated with strontium titanate [SrTiO3 (STO)] are expected to improve the bone growth around them. In this study, STO was deposited on model PEEK implants by magnetron sputtering deposition and its ability to release Sr2+ ions to a surrounding phosphate-buffered saline (PBS) solution was examined. It was found that, in the early stage of the deposition process, STO on a PEEK surface exhibits irregular surface structures with many holes. The amount of Sr stored in the STO film increases with the increasing film thickness but the release rate of Sr2+ ions from the STO film to the surrounding PBS also increases with the film thickness, limiting the duration of effectiveness of the STO-coated PEEK films. It was found, however, that a three-layer titanium (Ti)-STO-Ti film deposited on PEEK allows a steady release of Sr2+ ions to the surrounding PBS for an extended period. © 2023 by Begell House, Inc. ***.

关键词： Titanium compounds

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