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      Piezoelectric 1T Phase MoSe 2 Nanoflowers and Crystallographically Textured Electrodes for Enhanced Low‐Temperature Zinc‐Ion Storage

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          Abstract

          Transition metal dichalcogenides (TMDs) are regarded as promising cathode materials for zinc‐ion storage owing to their large interlayer spacings. However, their capabilities are still limited by sluggish kinetics and inferior conductivities. In this study, a facile one‐pot solvothermal method is exploited to vertically plant piezoelectric 1T MoSe 2 nanoflowers on carbon cloth (CC) to fabricate crystallographically textured electrodes. The self‐built‐in electric field owing to the intrinsic piezoelectricity during the intercalation/deintercalation processes can serve as an additional piezo‐electrochemical coupling accelerator to enhance the migration of Zn 2+. Moreover, the expanded interlayer distance (9–10 Å), overall high hydrophilicity, and conductivity of the 1T phase MoSe 2 also promoted the kinetics. These advantages endow the tailored 1T MoSe 2/CC nanopiezocomposite with feasible Zn 2+ diffusion and desirable electrochemical performances at room and low temperatures. Moreover, 1T MoSe 2/CC‐based quasi‐solid‐state zinc‐ion batteries are constructed to evaluate the potential of the proposed material in low‐temperature flexible energy storage devices. This work expounds the positive effect of intrinsic piezoelectricity of TMDs on Zn 2+ migration and further explores the availabilities of TMDs in low‐temperature wearable energy‐storage devices.

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          Generalized Gradient Approximation Made Simple

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            Semiempirical GGA-type density functional constructed with a long-range dispersion correction.

            A new density functional (DF) of the generalized gradient approximation (GGA) type for general chemistry applications termed B97-D is proposed. It is based on Becke's power-series ansatz from 1997 and is explicitly parameterized by including damped atom-pairwise dispersion corrections of the form C(6) x R(-6). A general computational scheme for the parameters used in this correction has been established and parameters for elements up to xenon and a scaling factor for the dispersion part for several common density functionals (BLYP, PBE, TPSS, B3LYP) are reported. The new functional is tested in comparison with other GGAs and the B3LYP hybrid functional on standard thermochemical benchmark sets, for 40 noncovalently bound complexes, including large stacked aromatic molecules and group II element clusters, and for the computation of molecular geometries. Further cross-validation tests were performed for organometallic reactions and other difficult problems for standard functionals. In summary, it is found that B97-D belongs to one of the most accurate general purpose GGAs, reaching, for example for the G97/2 set of heat of formations, a mean absolute deviation of only 3.8 kcal mol(-1). The performance for noncovalently bound systems including many pure van der Waals complexes is exceptionally good, reaching on the average CCSD(T) accuracy. The basic strategy in the development to restrict the density functional description to shorter electron correlation lengths scales and to describe situations with medium to large interatomic distances by damped C(6) x R(-6) terms seems to be very successful, as demonstrated for some notoriously difficult reactions. As an example, for the isomerization of larger branched to linear alkanes, B97-D is the only DF available that yields the right sign for the energy difference. From a practical point of view, the new functional seems to be quite robust and it is thus suggested as an efficient and accurate quantum chemical method for large systems where dispersion forces are of general importance. Copyright 2006 Wiley Periodicals, Inc.
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              Issues and challenges facing rechargeable lithium batteries.

              Technological improvements in rechargeable solid-state batteries are being driven by an ever-increasing demand for portable electronic devices. Lithium-ion batteries are the systems of choice, offering high energy density, flexible and lightweight design, and longer lifespan than comparable battery technologies. We present a brief historical review of the development of lithium-based rechargeable batteries, highlight ongoing research strategies, and discuss the challenges that remain regarding the synthesis, characterization, electrochemical performance and safety of these systems.
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                Author and article information

                Contributors
                Journal
                Advanced Materials
                Advanced Materials
                Wiley
                0935-9648
                1521-4095
                February 2023
                December 18 2022
                February 2023
                : 35
                : 6
                Affiliations
                [1 ] Volta and DiPole Materials Labs College of Energy Soochow Institute for Energy and Materials InnovationS (SIEMIS) Soochow Innovation Consortium for Intelligent Fibers and Wearable Technologies Key Laboratory of Advanced Carbon Materials and Wearable Energy Technologies of Jiangsu Province Key Laboratory of Core Technology of High Specific Energy Battery and Key Materials for Petroleum and Chemical Industry Soochow University 688 Moye Road Suzhou 215006 P. R. China
                [2 ] High Density Materials Technology Center for Flexible Hybrid Electronics Suzhou Institute of Electronic Functional Materials Technology Suzhou Industrial Technology Research Institute Suzhou 215151 P. R. China
                [3 ] College of Underwater Acoustic Engineering Harbin Engineering University Harbin 150001 P. R. China
                [4 ] School of Materials Science and Engineering Jiangsu University Zhenjiang 212013 P. R. China
                [5 ] School of Textile Garment and Design Changshu Institute of Technology Changshu 215500 P. R. China
                [6 ] Shanghai Synchrotron Radiation Facility Shanghai Advanced Research Institute Shanghai Institute of Applied Physics Chinese Academy of Sciences Shanghai 201204 P. R. China
                [7 ] State Key Laboratory of New Ceramics and Fine Processing School of Materials Science and Engineering Tsinghua University Beijing 100084 P. R. China
                Article
                10.1002/adma.202208615
                5b106dc7-be67-483c-b4b2-d859e408a839
                © 2023

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