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Surface surgery on TiNb2O7 electrode via N2/Air atmospheric pressure plasma jet for high-rate lithium-ion battery anode

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Applied Surface science 2024年 655卷

作者： Wu, Che-Ya Hsiao, Shih-Nan Kuo, Rui-Tung Chen, Yu-Ching Lin, Tzu-Ying Hori, Masaru Duh, Jenq-Gong Department of Materials Science and Engineering National Tsing Hua University No. 101 Sec. 2 Kuang-Fu Road Hsinchu300 Taiwan Nagoya University Furo-cho Aichi Chikusa Nagoya464–8603 Japan Program in Prospective Functional Materials Industry National Tsing Hua University No. 101 Sec. 2 Kuang-Fu Road Hsinchu300 Taiwan

TiNb2O7 (TNO) is regarded as a potential anode material for its high capacity compared to Li4Ti5O12 and high safety due to its adequate Fermi level in lithium-ion batteries. This work represents a promising method of modifying the electrode, which includes polyvinylidene fluoride (PVDF), conductive carbon, and TiNb2O7, using an atmospheric pressure plasma jet (APPj) treatment. Our results reveal that atmospheric pressure plasma jet improves the electrochemical performance by N-doped decoration on conductive carbon, electrolyte wettability enhancement on polyvinylidene fluoride binder, and defects manufacturing in TiNb2O7 anode materials. Good wettability of surface free energy to 44.6 mJ/m2 in the APPj-treated (APP-10) sample contributes to improved cycling performance. Both N-doped carbon and modified TiNb2O7 promote the high-rate capability. The C-rate performance of APP-10 improves by over 200 % at 10C compared to the non-treated sample (APP-0). APP-10 sample also shows 81.9 % retention after 300 cycles at 1C. The formation of Li3N or LiNxOy after cycling due to the nitro-group in the electrode with atmospheric pressure plasma jet offers good protection and high ionic-conductivity interface. This work demonstrates a potential solution to achieve a roll-to-roll modification without any complex synthesis processes, which is a promising technology for the affordable manufacturing of lithium-ion battery. © 2024 Elsevier B.V.

关键词： Wetting

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Highly Stable Silicon Anodes Enabled by Sub-10 nm Pores and Particles

arXiv

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arXiv 2025年

作者： Ghildiyal, Pankaj Wagner, Brandon Chen, Jianjun Nguyen, Tu Belamkar, Aishwarya Guo, Juchen Mangolini, Lorenzo SiLi-ion Inc. Multidisciplinary Research Building 3401 Watkins Dr RiversideCA92507 United States Materials Science and Engineering Program University of California Riverside RiversideCA92521 United States Department of Chemical and Environmental Engineering University of California Riverside RiversideCA92521 United States Department of Mechanical Engineering University of California Riverside RiversideCA92521 United States

Silicon anodes offer high energy densities for next-generation lithium-ion batteries;however, their application is limited by severe volume expansion during cycling. Making silicon porous or nanostructured mitigates this expansion but often increases lithium inventory losses due to the inherent high surface area of nanomaterials. This study introduces a simple bottom-up process that overcomes this limitation. The approach relies on small silicon particles (-3), all while maintaining good processability. The resulting silicon-dominant anodes achieve remarkable stability in full pouch cells with NMC811 and LFP cathodes, retaining ~80% capacity for more than 400 cycles without pre-lithiation, graphite blending, or pre-cycling. © 2025, CC BY.

关键词： Lithium-ion batteries

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Ultralow Frequency Interlayer Mode from Suppressed Van Der Waals Coupling in Polar Janus SMoSe/SWSe Heterostructure

SSRN

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SSRN 2025年

作者： Ren, Kai Wang, Ke Luo, Yi Sun, Minglei Altalhi, Tariq Yakobson, Boris I. Zhang, Gang School of Mechanical and Electronic Engineering Nanjing Forestry University Jiangsu Nanjing210037 China School of Automation Xi’an University of Posts & Telecommunications Xi’an710121 China School of Mechanical Engineering Jiangsu Key Laboratory of Function Control Technology for Advanced Materials Jiangsu Ocean University Lianyungang222005 China Department of Materials Science and Nanoengineering Rice University HoustonTX77005 United States Chemistry Department Taif University Taif21944 Saudi Arabia Yangtze Delta Region Academy of Beijing Institute of Technology Jiaxing314019 China Jiangsu Ocean University China Southeast University China

The broken mirror symmetry in Janus SMoSe and SWSe monolayers induces novel properties for photocatalytic, thermoelectric and photocatalytic devices. Interlayer coupling is critical in van der Waals (vdW) heterostructure for quantum transport and polaritonics. We investigate Janus SMoSe/SWSe vdW heterostructures with three stacking interfaces: S-S, S-Se, and Se-Se. The S-Se SMoSe/SWSe vdW heterostructure with lowest symmetry exhibits ultralow frequencies of in-plane shear (1.94 cm−1) and out-of-plane breathing (4.47 cm−1) modes due to weaker interlayer vdW restoring forces and a significant intrinsic vertical dipole moment. The reduced restoring forces are caused by the critical charge transfer across the vdW interface. Thus, the larger interlayer spacing in the S-Se SMoSe/SWSe heterostructure results in the suppressed vdW interlayer coupling for ultralow phonon frequencies. These findings advance understanding of tuning vdW coupling in polar Janus SMoSe/SWSe heterostructures by stacking engineering, providing theoretical insights for designing tunable nanoelectronic devices. © 2025, The Authors. All rights reserved.

关键词： Van der Waals forces

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Chiral metal-organic framework based spin-polarized flexible photodetector with ultrahigh sensitivity

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materials Today Nano 2023年 21卷

作者： Mustaqeem, M. Kamal, S. Ahmad, N. Chou, P.-T. Lin, K.-H. Huang, Y.-C. Guo, G.-Y. Paul Inbaraj, C.R. Li, W.-K. Yao, H.-C. Lu, K.-L. Chen, Y.-F. Department of Chemistry National Taiwan University No. 1 Section 4 Roosevelt Rd Taipei10617 Department of Physics National Taiwan University No. 1 Section 4 Roosevelt Rd Taipei10617 Nano-Science and Technology Program Taiwan International Graduate Program Institute of Physics Academia Sinica Taipei106 Taiwan Institute of Chemistry Academia Sinica Taipei115 Taiwan Department of Materials Science and Engineering National Taiwan University of Science and Technology Taipei10607 Taiwan Institute of Physics Academia Sinica Taipei11529 Taiwan Department of Materials Engineering Ming Chi University of Technology

Spin-optoelectronics plays a key role in developing next-generation technologies with potential applications covering from pharmaceutical synthesis and quantum computing to optical communication. One of the most feasible ways to achieve high-performance spin optoelectronic devices is based on chiral materials. Chiral metal-organic frameworks (CMOFs), an emerging class of chiral hybrid materials, have sparked interest due to their structural variety and flexibility, order nanopores, cost-effectiveness, and unique chirality features. Herein, we have developed CMOF [Sr (9,10-adc) (DMAc)2]n based on achiral building blocks [(9,10-adc)] to detect circularly polarized light (CPL) with ultrahigh sensitivity. Their application in spin-polarized flexible detectors gives a detectivity (D∗) as high as 1.83 × 1012 jones, superior to all reported heterochiral MOF-based detectors. Meanwhile, the anisotropy factor (gIph) is up to 0.38 for CPL detection. The maximum photoresponsivity (Rph) and photogain (η) values of CMOFs reach up to 6.0 × 105 (A/W) and 1.8 × 106, respectively, which are also the record values among reported chiral MOFs. Additionally, the photodetector is mechanically flexible and durable, manifesting an important feature for wearable devices. Therefore, our study shown here is significant and timely to open a route for advancing spin-optoelectronics based on CMOF. © 2023 Elsevier Ltd

关键词： Photodetectors

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Velocity-gauge Real-time Time-dependent Density Functional Tight-binding for Large-scale Condensed Matter Systems

arXiv

引用

arXiv 2023年

作者： Xu, Qiang Del Ben, Mauro Okyay, Mahmut Sait Choi, Min Ibrahim, Khaled Z. Wong, Bryan M. Materials Science & Engineering Program Department of Chemistry Department of Physics & Astronomy University of California-Riverside RiversideCA92521 United States Applied Mathematics & Computational Research Division Lawrence Berkeley National Laboratory BerkeleyCA94720 United States

We present a new velocity-gauge real-time, time-dependent density functional tight-binding (VG-rtTDDFTB) implementation in the open-source DFTB+ software package (https://***) for probing electronic excitations in large, condensed matter systems. Our VG-rtTDDFTB approach enables real-time electron dynamics simulations of large, periodic, condensed matter systems containing thousands of atoms with a favorable computational scaling as a function of system size. We provide computational details and benchmark calculations to demonstrate its accuracy and computational parallelizability on a variety of large material systems. As a representative example, we calculate laser-induced electron dynamics in a 512-atom amorphous silicon supercell to highlight the large periodic systems that can be examined with our implementation. Taken together, our VG-rtTDDFTB approach enables new electron dynamics simulations of complex systems that require large periodic supercells, such as crystal defects, complex surfaces, nanowires, and amorphous materials. Copyright © 2023, The Authors. All rights reserved.

关键词： Gages

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Study of doxorubicin release carried out by pH-responsive chitosan-alginate hydrogels

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Journal of Molecular Liquids 2025年 429卷

作者： Oliveira, Thayane Portela da Silva, Jhaemely Gabrielly Vieira Costa, Paloma Maia de Oliveira, Maykol Christian Damasceno Coelho, Ronaldo Cunha Santos Nascimento, Ariane Maria Silva Silva-Filho, Edson Cavalcanti dos Santos, Francisco Eroni Paz Muniz, Edvani Curti Postgraduate Program in Engineering and Materials Science Federal University of Piauí PI Teresina64049550 Brazil Physics Department Federal University of Piauí PI Teresina64049550 Brazil Department of Teacher Training Instituto Federal do Piauí PI Teresina64053-390 Brazil Chemistry Department Federal University of Piauí PI Teresina64049550 Brazil Chemistry Department State University of Maringá PR Maringá87020-900 Brazil

The use of polysaccharides in drug delivery systems has attracted increasing interest due to their functional properties. Among these, alginate (ALG) and chitosan (CH) are promising candidates for sustained drug delivery as they respond to pH, ensuring that the compound is released in a desired area. In this research physical hydrogels based on alginate and chitosan (ALG/CH) were prepared by varying the synthesis parameters (ALG at ALG/CH ratio, pH and speed stirring) and the effects of such parameters on hydrogels’ chemical and physical structure were accessed through several techniques. Also, the effects synthesis parameters on fractional release (Fmax), half time (t1/2) and percentage encapsulation efficiency (EE%), as the evaluated responses, were statically measured using a factorial design. Analysis through Raman and FTIR spectroscopies revealed the modes and bands corresponding to the precursors, confirming the formation of physically cross-linked hydrogels. The porous structure of the materials was confirmed by scanning electron microscopy (SEM). The swelling capacities of the hydrogels were analyzed at different pHs (5.4 and 7.4) and demonstrated that absorption increases in slightly acidic media. TG/DTG and Micro-CT analyzes of the sample with the greatest swelling showed that the degradation of the hydrogel occurs in two endothermic events and that the material possesses several sized and interconnected pores. The doxorubicin (DOX) release study showed that the release rate is higher as the higher proportion of CH relative to ALG. The factorial design analysis indicated the statistically significant factors in the DOX release tests. Thus, the results suggest that ALG/CH hydrogels can be tuned during their preparation to achieve optimal structure for pH-responsive to be applied for DOX releasing system. © 2025 Elsevier B.V.

关键词： Microgels

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Opto-thermoelectric microswimmers

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Light(science & Applications) 2020年第1期9卷 674-685页

作者： Xiaolei Peng Zhihan Chen Pavana Siddhartha Kollipara Yaoran Liu Jie Fang Linhan Lin Yuebing Zheng Materials Science&Engineering Program and Texas Materials Institute The University of Texas at AustinAustinTX 78712USA Walker Department of Mechanical Engineering The University of Texas at AustinAustinTX 78712USA State Key Laboratory of Precision Measurement Technology and Instruments Department of Precision InstrumentTsinghua UniversityBeijing 100084People’s Republic of China

Inspired by the“run-and-tumble”behaviours of Escherichia coli(***)cells,we develop opto-thermoelectric *** microswimmers are based on dielectric-Au Janus particles driven by a self-sustained electrical field that arises from the asymmetric optothermal response of the *** illumination by a defocused laser beam,the Janus particles exhibit an optically generated temperature gradient along the particle surfaces,leading to an opto-thermoelectrical field that propels the *** further discover that the swimming direction is determined by the particle *** enable navigation of the swimmers,we propose a new optomechanical approach to drive the in-plane rotation of Janus particles under a temperature-gradient-induced electrical field using a focused laser *** the rotation laser beam allows us to position the particles at any desired orientation and thus to actively control the swimming direction with high *** incorporating dark-field optical imaging and a feedback control algorithm,we achieve automated propelling and navigation of the *** optothermoelectric microswimmers could find applications in the study of opto-thermoelectrical coupling in dynamic colloidal systems,active matter,biomedical sensing,and targeted drug delivery.

关键词： rotation illumination beam

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Selective-Area Growth of Gan and Algan Nanowires on N-Polar Gan Templates with 4° Miscut by Plasma-Assisted Molecular Beam Epitaxy

SSRN

引用

SSRN 2022年

作者： Khan, Kamruzzaman Jian, Zhe Li, Jonathan Sun, Kai Ahmadi, Elaheh Department of Materials Science and Engineering University of Michigan Ann Arbor United States Department of Electrical Engineering and Computer Science University of Michigan Ann Arbor United States Applied Physics Program University of Michigan Ann Arbor United States

In this study, selective area growth (SAG)s of AlGaN/GaN nanowires (NWs) on miscut N-polar GaN templates were studied and compared with that grown on Ga-polar templates using plasma-assisted molecular beam epitaxy (MBE). The SAG of N-polar AlGaN/GaN NWs demonstrated higher growth rate and more growth selectivity than that of Ga-polar AlGaN/GaN NWs. Additionally, lateral growth rate of N-polar NWs was significantly lower than Ga-polar NWs. Compared to the pyramidal shaped top surfaces of Ga-polar NWs, the N-polar GaN NWs had flat head top surfaces. The combination of higher growth selectivity, larger growth window, negligible lateral growth, and flat head, makes N-polar (Al,Ga)N NWs attractive for a variety of applications including UV LEDs and detectors as well as quantum sensing. © 2022, The Authors. All rights reserved.

关键词： Aluminum gallium nitride

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Hyperuniformity of maximally random jammed packings of hyperspheres across spatial dimensions

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Physical Review E 2023年第6期108卷 064602-064602页

作者： Charles Emmett Maher Yang Jiao Salvatore Torquato Department of Chemistry Princeton University Princeton New Jersey 08544 USA Materials Science and Engineering Arizona State University Tempe Arizona 85287 USA Department of Physics Arizona State University Tempe Arizona 85287 USA Department of Physics Princeton University Princeton New Jersey 08544 USA Princeton Materials Institute Princeton University Princeton New Jersey 08544 USA Program in Applied and Computational Mathematics Princeton University Princeton New Jersey 08544 USA

The maximally random jammed (MRJ) state is the most random (i.e., disordered) configuration of strictly jammed (mechanically rigid) nonoverlapping objects. MRJ packings are hyperuniform, meaning their long-wavelength density fluctuations are anomalously suppressed compared to typical disordered systems, i.e., their structure factors S(k) tend to zero as the wave number |k| tends to zero. Here we show that generating high-quality strictly jammed states for Euclidean space dimensions d=3,4, and 5 is of paramount importance in ensuring hyperuniformity and extracting precise values of the hyperuniformity exponent α>0 for MRJ states, defined by the power-law behavior of S(k)∼|k|α in the limit |k|→0. Moreover, we show that for fixed d it is more difficult to ensure jamming as the particle number N increases, which results in packings that are nonhyperuniform. Free-volume theory arguments suggest that the ideal MRJ state does not contain rattlers, which act as defects in numerically generated packings. As d increases, we find that the fraction of rattlers decreases substantially. Our analysis of the largest truly jammed packings suggests that the ideal MRJ packings for all dimensions d≥3 are hyperuniform with α=d−2, implying the packings become more hyperuniform as d increases. The differences in α between MRJ packings and the recently proposed Manna-class random close packed (RCP) states, which were reported to have α=0.25 in d=3 and be nonhyperuniform (α=0) for d=4 and d=5, demonstrate the vivid distinctions between the large-scale structure of RCP and MRJ states in these dimensions. Our paper clarifies the importance of the link between true jamming and hyperuniformity and motivates the development of an algorithm to produce rattler-free three-dimensional MRJ packings.

关键词： Granular solids

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Single-phase high-entropy intermetallic compounds(HEICs): bridging high-entropy alloys and ceramics

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science Bulletin 2019年第12期64卷 856-864页

作者： Naixie Zhou Sicong Jiang Timothy Huang Mingde Qin Tao Hu Jian Luo Department of Nanoengineering Program of Materials Science and EngineeringUniversity of CaliforniaSan DiegoCA 92093-0448USA Oerlikon Metco Inc. San DiegoCA 92121USA State Key Laboratory of High Performance and Complex Manufacturing School of Materials Science and EngineeringCentral South UniversityChangsha 410083China

High-entropy intermetallic compounds(HEICs)were fabricated by mechanical alloying and spark plasma sintering to fill a knowledge gap between the traditional high-entropy alloys(HEAs)and emerging highentropy ceramics(HECs).Notably,several four-or five-component equimolar aluminides,such as the B2-phase(Fe1/5 Co1/5 Ni1/5 Mn1/5 Cu1/5)Al,have been made into single-phase HEICs for the first *** modeling and a reversible,temperature-dependent,phase-stability experiment suggest that such B2-phase HEICs are entropy-stabilized *** structure of these HEICs resembles that of HECs with high-entropy mixing of fo ur or five elements of nearly equal fractions in one and only one sublattice,but with significant(10%)anti-site defects(differing from typical HECs).A new phase stability rule for forming single B2-phase HEICs is *** additional HEICs of predominantly D022 phases have also been *** study broadens the families of equimola r,single-phase,high-entropy materials that have been successfully fabricated.

关键词： High-entropy intermetallic compound Aluminide Phase stability High-entropy alloy High-entropy ceramic

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