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Chemical Short-Range Ordering in Nanoprecipitates Modulates Planar Faults to Enhance Mechanical Properties 纳米沉淀物中的化学短程有序调节平面故障以提高力学性能
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-25 DOI: 10.1021/acs.nanolett.5c01602
Qing Zhang, Yixuan Hu, Tao Yang, Han Chen, Yuto Ito, Daisuke Egusa, Eiji Abe, Qiwei Shi, Gang Ji, Yuchi Cui, Xiaodong Wang, Zhe Chen
{"title":"Chemical Short-Range Ordering in Nanoprecipitates Modulates Planar Faults to Enhance Mechanical Properties","authors":"Qing Zhang, Yixuan Hu, Tao Yang, Han Chen, Yuto Ito, Daisuke Egusa, Eiji Abe, Qiwei Shi, Gang Ji, Yuchi Cui, Xiaodong Wang, Zhe Chen","doi":"10.1021/acs.nanolett.5c01602","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01602","url":null,"abstract":"Nanoprecipitates strengthen metallic materials by impeding dislocation motion, but they often compromise ductility. This study introduces a novel strategy to address this challenge by incorporating atomic-scale chemical heterogeneity within nanoprecipitates. For the first time, pronounced short-range ordering (SRO) within L1<sub>2</sub>-ordered precipitates of the Co<sub>40</sub>Ni<sub>30</sub>Cr<sub>20</sub>Al<sub>5</sub>Ti<sub>4</sub>Ta<sub>1</sub> multi-principal element alloy is observed and confirmed, with its formation mechanism elucidated via density functional theory. Experimental and computational results show that the unique atomic configuration reshapes the energy landscape of planar defects, enhancing the strength and work-hardening capacity. The SRO structure elevates the critical shear stress for dislocation-mediated precipitate shearing while reducing the formation energy of superlattice intrinsic stacking faults, thereby promoting nucleation site formation. This work pioneers a method for modulating atomic-scale heterogeneity within ordered structures, advancing high-performance material design.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"7 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143876379","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Topology-Dependent Enhancement of Pyroelectric Property in Nanoarchitected GaN Metamaterials 纳米结构GaN超材料热释电性能的拓扑依赖性增强
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c01586
Jun Cai, Benyamin Shahryari, Alireza Seyedkanani, Agus P. Sasmito, Abdolhamid Akbarzadeh
{"title":"Topology-Dependent Enhancement of Pyroelectric Property in Nanoarchitected GaN Metamaterials","authors":"Jun Cai, Benyamin Shahryari, Alireza Seyedkanani, Agus P. Sasmito, Abdolhamid Akbarzadeh","doi":"10.1021/acs.nanolett.5c01586","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01586","url":null,"abstract":"Pyroelectric materials exhibit spontaneous polarization in response to temperature fluctuations, a phenomenon known as the <i>pyroelectric effect</i>. This study investigates the pyroelectric properties of nanoarchitected gallium nitride (GaN) metamaterials with distinctive topologies, i.e., body-centered cube, octet truss, gyroid, and spinodoid, using molecular dynamics simulations. Our findings reveal a topology-dependent enhancement in the pyroelectric coefficient, primarily affected by the piezoelectric stress constant and thermal expansion coefficient. We demonstrate that decreasing the relative density further enhances the pyroelectric coefficient due to an increased surface-to-volume ratio that enhances the surface effects. Finally, we compute the pyroelectric figures of merit for thermal energy harvesting application, highlighting the superior pyroelectric performance of nanoarchitected GaN metamaterials compared to bulk GaN and GaN nanowires. These results underscore the potential of nanoscale topology engineering in the field of pyroelectricity for realizing next-generation nanogenerators, thermal imaging devices, and self-powered nanosensors.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"1 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872557","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Gradient Structured Separator Enables Stable Aqueous Zinc Metal Batteries 梯度结构分离器使水锌金属电池稳定
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c01125
Zehua Zhao, Yan Zhang, Huandi Zhang, Xiaowei Shi, Haitao Zhao, Junpeng Liu, Jiamei Liu, Lei Li
{"title":"Gradient Structured Separator Enables Stable Aqueous Zinc Metal Batteries","authors":"Zehua Zhao, Yan Zhang, Huandi Zhang, Xiaowei Shi, Haitao Zhao, Junpeng Liu, Jiamei Liu, Lei Li","doi":"10.1021/acs.nanolett.5c01125","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01125","url":null,"abstract":"Developing a functional separator is an important strategy to improve the electrochemical performance of the Zn anode by suppressing the Zn dendrite growth and parasitic side reactions, thus advancing the aqueous zinc-ion batteries. Herein, we experimentally realize functional separator with gradient-structure based on CeF<sub>3</sub> nanoparticles functionalized glass fibers. The experimental and theoretical results confirmed that the functional separator can tailor the Zn<sup>2+</sup> flux and restrain SO<sub>4</sub><sup>2–</sup> transport, promoting dense Zn deposition. The strong interaction between CeF<sub>3</sub> nanoparticles and H<sub>2</sub>O separates Zn<sup>2+</sup> and H<sub>2</sub>O at the electrolyte/Zn anode interface, suppressing side reactions. Consequently, the Zn||Zn with this separator achieves excellent cycling stability of 2500 h at 1 mA cm<sup>–2</sup> and 1 mAh cm<sup>–2</sup> and 1000 h at 5 mA cm<sup>–2</sup> and 5 mAh cm<sup>–2</sup>. This design of a functionalized separator provides a distinctive solution for the development of aqueous zinc-ion batteries.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"33 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872556","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
In Situ Multiscale Study of Iron Oxidation at High Temperatures 高温下铁氧化的原位多尺度研究
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c00025
Wei Tu, Zhen Zeng, Yongjian Zhao, Zhenghao Jia, Caixia Meng, Wei Liu, Xianhu Sun, Jianyu Huang
{"title":"In Situ Multiscale Study of Iron Oxidation at High Temperatures","authors":"Wei Tu, Zhen Zeng, Yongjian Zhao, Zhenghao Jia, Caixia Meng, Wei Liu, Xianhu Sun, Jianyu Huang","doi":"10.1021/acs.nanolett.5c00025","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c00025","url":null,"abstract":"Although high-temperature oxidation of metals results in significant failure of structure materials, in situ understanding of these processes and developing improved strategies are still very limited. Herein, using environmental scanning electron microscopy (ESEM), environmental transmission electron microscopy (ETEM), and X-ray photoelectron spectroscopy (XPS), we report the in situ dynamic high-temperature oxidation behaviors of iron in O<sub>2</sub>, H<sub>2</sub>O, and O<sub>2</sub> + H<sub>2</sub>O atmospheres, respectively. The results demonstrate that an oxygen-rich environment (1.6 mbar) leads to transient formation of polycrystalline Fe<sub>3</sub>O<sub>4</sub> without passivation effects on further oxidation, while sparse oxygen environments (10<sup>–3</sup> mbar) promote formation of a uniform thin passivation layer of Fe<sub>3</sub>O<sub>4</sub>, protecting itself from further oxidation in ambient air. In contrast to O<sub>2</sub>, the H<sub>2</sub>O vapor accelerates oxidation, and the products consist of Fe<sub>3</sub>O<sub>4</sub> and FeOOH. These in situ results give insights into designing technically universal antioxidation strategies.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"26 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143867253","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Highly Sensitive Wearable Chromic Force Sensor Utilizing In-Plane Anisotropy in Polydiacetylene Mechanochromism 利用聚二乙炔机械变色的面内各向异性的高灵敏度可穿戴色力传感器
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c00085
Jianlu Zheng, Jiali Chen, Massimiliano Galluzzi, Yuge Hou, Kaori Sugihara
{"title":"Highly Sensitive Wearable Chromic Force Sensor Utilizing In-Plane Anisotropy in Polydiacetylene Mechanochromism","authors":"Jianlu Zheng, Jiali Chen, Massimiliano Galluzzi, Yuge Hou, Kaori Sugihara","doi":"10.1021/acs.nanolett.5c00085","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c00085","url":null,"abstract":"Force sensitivity is a crucial parameter in mechanochromic materials, determining their application range and practical success. In this study, we reveal an unexplored degree of freedom─in-plane anisotropy─for significantly enhancing the force sensitivity of polydiacetylene. Utilizing our newly developed dual nanofriction force/fluorescence microscopy setup, we discovered that force sensitivity reaches its peak when external forces are applied perpendicular to the polymer backbones in-plane. This phenomenon is explained by a “domino effect”, where point loads propagate along the backbones and affect the polymer structure even hundreds of nanometers from the contact point. Leveraging this finding, we developed a highly sensitive, stretchable force sensor and demonstrated that aligning polydiacetylene crystals perpendicular to the force direction increased the sensor’s sensitivity by up to 14-fold.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"5 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143867256","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Collective Electricity Generation over the Kilovolt Level from Water Droplets 超过千伏水平的水滴集体发电
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c01064
Wei Deng, Yufeng Zhu, Kelan Zhang, Yuxuan Yuan, Tao Hu, Xiao Wang, Jidong Li, Xuemei Li, Zhuhua Zhang, Wanlin Guo, Jun Yin
{"title":"Collective Electricity Generation over the Kilovolt Level from Water Droplets","authors":"Wei Deng, Yufeng Zhu, Kelan Zhang, Yuxuan Yuan, Tao Hu, Xiao Wang, Jidong Li, Xuemei Li, Zhuhua Zhang, Wanlin Guo, Jun Yin","doi":"10.1021/acs.nanolett.5c01064","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01064","url":null,"abstract":"Collective behavior enables groups of organisms to achieve feats far exceeding individual capability. Inspired by this, we present a novel droplet-based electricity generator that leverages the collective dynamics of multiple water droplets to significantly enhance electrical output, achieving orders of magnitude improvement compared with single-droplet devices. It is revealed that grouped water droplets, although spatially separated, coordinate via charge exchange with a solid surface and external charge transfer. Consequently, the solid surface charge density is significantly enhanced, elevating the charge transfer. This collective effect readily generates peak voltages exceeding one kilovolt, sufficient for air ionization and nitrogen fixation, with potential applications in nutrient production. We anticipate that this collective strategy will significantly advance the design and applications of droplet-based hydrovoltaic devices.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"130 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872555","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Keto-Oxygen on Graphitic Surface with Downshifted p-Band Center Achieves Efficient Metal-Free Transfer Hydrogenation of Nitroarenes 降p带中心石墨表面的酮氧实现了硝基芳烃的高效无金属转移加氢
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c01614
Rongjian Ding, Ting Zhang, Yanling Zhai, Haijie Cao, Zhijun Zhu, Xiaoquan Lu
{"title":"Keto-Oxygen on Graphitic Surface with Downshifted p-Band Center Achieves Efficient Metal-Free Transfer Hydrogenation of Nitroarenes","authors":"Rongjian Ding, Ting Zhang, Yanling Zhai, Haijie Cao, Zhijun Zhu, Xiaoquan Lu","doi":"10.1021/acs.nanolett.5c01614","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01614","url":null,"abstract":"The critical challenge in utilizing carbon-based nanomaterials is identifying the active site. Herein, we demonstrate the keto-oxygen on the graphitic surface as active sites for catalytic transfer hydrogenation (CTH) and present an efficient nanocrystalline diamond (ND)-derived carbon-based catalyst for metal-free CTH of nitroarenes to imine with 99.9% nitrobenzene conversion and exclusive selectivity (99.9%). By selectively deconstructing the graphitic surface or eliminating carbonyl groups, the graphite-conjugated carbonyl group is confirmed as the catalytically active site. Moreover, kinetic studies display the lower activation barrier of benzylalcohol than that of nitrobenzene (88.8 vs 119.1 kJ mol<sup>–1</sup>, respectively), indicating that alcohol dehydrogenation occurs prior to the activation of nitrobenzene. Density functional theory calculations reveal the downshifted <i>p</i>-band center of keto-oxygen on the <i>sp</i><sup>2</sup> hybrid C surface affords moderate adsorption of benzaldehyde intermediates, which accelerates the formation of active H for the following hydrogenation step and is responsible for the high catalytic activity.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"7 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872558","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Interplay of Ultrafast Electron–Phonon and Electron–Electron Scattering in Ti3C2Tx MXenes: Ab Initio Quantum Dynamics Ti3C2Tx MXenes中超快电子-声子和电子-电子散射的相互作用:从头算量子动力学
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c01242
Shiying Shen, Haoran Lu, Shriya Gumber, Oleg V. Prezhdo, Run Long
{"title":"Interplay of Ultrafast Electron–Phonon and Electron–Electron Scattering in Ti3C2Tx MXenes: Ab Initio Quantum Dynamics","authors":"Shiying Shen, Haoran Lu, Shriya Gumber, Oleg V. Prezhdo, Run Long","doi":"10.1021/acs.nanolett.5c01242","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01242","url":null,"abstract":"Nonthermal electrons are vital in solar energy and optoelectronics, yet their relaxation pathways are not fully understood. Ab initio quantum dynamics reveal that in Ti<sub>3</sub>C<sub>2</sub>O<sub>2</sub> electron–phonon (e-ph) relaxation is faster than electron–electron (e-e) scattering due to strong coupling with the A<sub>1g</sub> phonon at 190 cm<sup>–1</sup> and the presence of light C and O atoms. Nuclear quantum effects are minimal; vibrations influence e-e scattering only indirectly, and the A<sub>1g</sub> mode’ zero-point energy is much lower than thermal energy at ambient conditions. Substituting O with heavier S in Ti<sub>3</sub>C<sub>2</sub>OS slows e-ph relaxation and enhances e-e scattering, making it a faster process. However, both channels proceed concurrently, challenging the e-e and e-ph time scale separation often used for metals. These results underscore the need for atomistic-level understanding of nonthermal electron dynamics, especially in light-element systems such as MXenes, and provide guidance for optimizing electronic relaxation in advanced optoelectronic materials and devices.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"97 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872721","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
2D Materials in Logic Technology: Power Efficiency and Scalability in 2DM-MBC CFET 逻辑技术中的二维材料:2DM-MBC CFET的功率效率和可扩展性
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.5c01061
Seung Heon Shin, Dong-Ho Kang, Hoon Hahn Yoon, Jin Young Park, Minuk Song, Hyeonchang Son, Daewon Ha, Hyeon-Jin Shin
{"title":"2D Materials in Logic Technology: Power Efficiency and Scalability in 2DM-MBC CFET","authors":"Seung Heon Shin, Dong-Ho Kang, Hoon Hahn Yoon, Jin Young Park, Minuk Song, Hyeonchang Son, Daewon Ha, Hyeon-Jin Shin","doi":"10.1021/acs.nanolett.5c01061","DOIUrl":"https://doi.org/10.1021/acs.nanolett.5c01061","url":null,"abstract":"Sustaining digital evolution demands high-performance logic technology with a high density, high speed, and low power consumption to process large data sets efficiently. Power consumption remains a critical issue in miniaturized logic devices, impacting reliability, device lifetime, and circuit scalability. This review explores key parameters in logic FETs to manage power consumption, examining advancements in both unit and array structures. We provide a detailed overview of the development history of logic FETs, highlighting structural innovations and challenges for achieving low power consumption. Furthermore, we investigate the state-of-the-art potential of 2D materials (2DMs) in 3D-stacked structures, such as 2DM-MBC CFETs, emphasizing their benefits for ultralow power devices. Finally, we address the current progress and challenges in developing 2DM NMOS and PMOS for CFET industrialization and present an outlook on advancing 2DM-MBC CFET technology to meet the demands of future logic technology.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"7 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143867257","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Layered Germanium–Selenium Compounds as Phonon–Glass Electron–Crystals: A Pathway to Enhance the Thermoelectric Performance 层状锗硒化合物声子-玻璃电子晶体:提高热电性能的途径
IF 10.8 1区 材料科学
Nano Letters Pub Date : 2025-04-24 DOI: 10.1021/acs.nanolett.4c06620
Zhen Tong, Yatian Zhang, Thomas Frauenheim, Traian Dumitrică
{"title":"Layered Germanium–Selenium Compounds as Phonon–Glass Electron–Crystals: A Pathway to Enhance the Thermoelectric Performance","authors":"Zhen Tong, Yatian Zhang, Thomas Frauenheim, Traian Dumitrică","doi":"10.1021/acs.nanolett.4c06620","DOIUrl":"https://doi.org/10.1021/acs.nanolett.4c06620","url":null,"abstract":"The early concept of a “phonon–glass electron–crystal” for enhancing the thermoelectric figure of merit (<i>ZT</i>) is explored theoretically in layered Ge–Se crystals, where phonon transport exhibits glass-like behavior. <i>Ab initio</i> lattice dynamics and the rigid electronic band method project an ultrahigh <i>ZT</i> = 4.04 at 1000 K along the <i>a</i> axis in the high-temperature GeSe<sub>2</sub> phase at an electron doping concentration of 10<sup>20</sup> cm<sup>–3</sup>. Meanwhile, the low-temperature Ge<sub>4</sub>Se<sub>9</sub> phase achieves a high <i>ZT</i> = 2.19 at 600 K along the <i>a</i> axis with an electron doping concentration of 6 × 10<sup>19</sup> cm<sup>–3</sup>. These maximal values reflect the ultralow lattice thermal conductivity, 0.168 W m<sup>–1</sup> K<sup>–1</sup> (GeSe<sub>2</sub>, 1000 K) and 0.289 W m<sup>–1</sup> K<sup>–1</sup> (Ge<sub>4</sub>Se<sub>9</sub>, 600 K), and high power factor at optimized carrier concentrations along the <i>a</i> axis. Our calculations indicate a promising pathway for approaching the early concept of maximizing <i>ZT</i>, by tailoring carrier doping in layered crystals with glass-like phononic transport.","PeriodicalId":53,"journal":{"name":"Nano Letters","volume":"69 1","pages":""},"PeriodicalIF":10.8,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872553","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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