摘要：Nonreciprocity of thermal metamaterials has significant application prospects in isolation protection,unidirectional transmission,and energy ***,due to the inherent isotropic diffusion law of heat flow,it is extremely difficult to achieve nonreciprocity of heat *** review presents the recent developments in thermal nonreciprocity and explores the fundamental theories,which underpin the design of nonreciprocal thermal metamaterials,i.e.,the Onsager reciprocity ***,three methods for achieving nonreciprocal metamaterials in the thermal field are elucidated,namely,nonlinearity,spatiotemporal modulation,and angular momentum bias,and the applications of nonreciprocal thermal metamaterials are *** also discuss nonreciprocal thermal ***,the potential applications of nonreciprocity to other Laplacian physical fields are ***,the prospects for advancing nonreciprocal thermal metamaterials are highlighted,including developments in device design and manufacturing techniques and machine learning-assisted material design.

摘要：The effect of W element on the microstructure evolution and mechanical properties of Al_(1.25)CoCrFeNi3 eutectic high-entropy alloy and Al_(1.25)CoCrFeNi_(3-x)W_(x)(x=0,0.05,0.1,0.3,and 0.5;atomic ratio)high-entropy alloys(HEAs)were *** show that the Al_(1.25)CoCrFeNi_(3-x)W_(x) HEAs are composed of face-centered cubic and body-centered cubic(BCC)*** W content increases,the microstructure changes from eutectic to *** addition of W lowers the nucleation barrier of the BCC phase,decreases the valence electron concentration of the HEAs,and replaces Al in the BCC phase,thus facilitating the nucleation of the BCC *** results show that the addition of W greatly improves the mechanical properties,and solid-solution,heterogeneous-interface,and second-phase strengthening are the main strengthening *** yield strength,tensile strength,and elongation of the Al_(1.25)CoCrFeNi2.95W0.05 HEA are 601.44 MPa,1132.26 MPa,and 15.94%,respectively,realizing a balance between strength and *** fracture mode of the Al_(1.25)CoCrFeNi_(3-x)W_(x) HEAs is ductile–brittle mixed fracture,and the crack propagates and initiates in the BCC *** eutectic lamellar structure impedes crack propagation and maintains plasticity.

摘要：由于析氧反应的内在动力学缓慢,开发高效的光催化析氧反应催化剂,以利用太阳能进行光催化分解水产氧,面临着巨大的挑战.本研究设计了一种新型的“主-客体”光催化系统,通过简单的预负载将单位点钌(Ru)分子催化剂引入共价三嗪框架(CTFs)的孔道内.其中,CTFs作为光敏剂和光催化载体,单核钌配合物Ru-bda-Isoq作为分子水氧化催化剂.在可见光照射下,Ru-bda-Isoq@CTF-Bph在5h内平均析氧速率达到2308μmol g^(-1)h^(-1),其性能超过了大多数有机光催化剂.同时,研究还发现多孔光敏剂与分子催化剂之间的结构匹配起着非常关键的作用.该体系具有广泛的适用性,这一策略有助于高效水氧化光催化系统的设计.

摘要：锂金属负极和碳酸酯类电解液之间不稳定的界面是限制高比能锂金属电池循环寿命的关键挑战.本文使用含苯环的双酚A乙氧基化物二甲基丙烯酸酯(BAED)交联剂调节聚(丙烯酸六氟丁酯)(PHFBA),设计了一种弹性人造固体电解质中间相(RASEI)来解决这个问题.刚性BAED分子可以对柔性PHBA基体进行调控,实现从600%伸长率到90%压缩率的卓越回弹性,并具有超过2 MPa的高杨氏模量.RASEI可以适应锂金属较大的体积变化,并确保电池运行过程中锂金属与RASEI之间的紧密接触,促进均匀的锂沉积并减少副反应.因此,经过RASEI修饰的Li‖Li对称电池可以在1 mA cm^(-2)和1 mAh cm^(-2)下实现超过500小时的长期循环.对循环后锂金属进行测试分析表明锂枝晶的生长得到了有效的抑制.此外,搭配20 mg cm^(-2)高阴极负载的NCM811软包电池在1 C下,经过200次循环后容量保持率超过85%.

摘要：高通量计算与材料数据库推动了数据驱动的机器学习方法的发展.机器学习已经成为材料计算研究的重要方法,在分析材料数据、加速材料计算、预测材料性质、推进新材料发现、筛选和设计等方面展现出极大的潜力.众多与材料计算相交叉的机器学习方法、模型以及框架不断涌现.本文综述了近年来光电半导体材料计算设计领域内机器学习方法的最新进展与应用.介绍了机器学习的流程与类型,基于不同材料表示方法的浅层模型、集成模型和深度神经网络,以及相关材料数据库和相关工具.我们还讨论了这些模型在预测材料稳定性与光电性质、材料逆向设计、构建材料构效关系等方面的应用.最后,本文对目前机器学习方法存在的机遇与挑战,即数据数量与质量、材料的表示、材料逆向设计做了进一步总结与讨论.

摘要：电化学二氧化碳还原(ECO_(2)R)是一种将碳和可再生能源的能量储存在多碳产品(C_(2+))的化学键中的有效途径.然而,反应涉及的复杂步骤为CO_(2)直接转化为C_(2+)设置了巨大的障碍.一种利用CO作为“中转站”,通过串联ECO_(2)R和电化学CO还原(ECOR)以提高生产C_(2+)的选择性和反应速率的策略引起了人们的广泛关注.本文总结了铜基电催化剂在ECOR中催化特定C_(2+)生成的设计策略.其次,从各个方面总结了催化剂工程的代表性设计策略,并介绍了电解反应器改进方面的最新进展.最后,阐述了该研究领域面临的主要挑战和未来前景.这些见解和观点将为铜基电催化剂的设计提供有益指导.

摘要：p-d轨道之间的相互作用是一种提升电催化性能的有效方法.然而,其对主族金属的电催化CO_(2)还原(eCO_(2)RR)的增强机制尚不清晰.因此,我们向金属Bi纳米片中引入了一系列过渡金属氧化物(TMO:Fe_(2)O_(3)、Co_(3)O_(4)、NiO),并以此研究引入TMO对Bi物种eCO_(2)RR性能的影响.根据原位傅里叶变换红外光谱(FTIR)和CO_(2)-程序升温脱附(TPD)的结果,Bi/TMO中的TMO可以增强CO_(2)的吸附和活化能力.密度泛函理论(DFT)计算结果表明,Bi活性位点^(*)OCHO吸附能及p轨道的优化可以降低CO_(2)到^(*)OCHO过程和^(*)OCHO到HCOOH过程的理论过电位.同时,由于Bi与TMO之间因复合而发生的电子重排也促进了催化剂与反应物之间的电子传输.因此,在热力学和动力学的双重作用下,Bi/TMO中的Bi活性位点表现出最佳的催化能力,在更宽的电位区间内实现了更高的催化活性和甲酸选择性.其中,Bi/Fe_(2)O_(3)的增强效果最为显著.在500 mV的宽电位区间内达到较高的甲酸的法拉第效率(>90%),在-0.8 VRHE时,甲酸的法拉第效率达到最大值99.7%(Bi的1.11倍),甲酸局部电流密度达到12.65 mA cm^(-2)(Bi的1.86倍).这一研究不仅建立了eCO_(2)RR性能增强与引入TMO之间的关系,也为理性设计高性能电催化剂提供了一条实用的、可扩展的途径.

摘要：Tunneling heterostructures are emerging as a versatile architecture for photodetection due to their advanced optical sensitivity,tailorable detection band,and wellbalanced photoelectric ***,the existing tunneling heterostructures are mainly operated in the visible wavelengths and have been rarely investigated for the nearinfrared ***,we report the design and realization of a novel broken-gap tunneling heterostructure by combining WSe2 and Bi2Se3,which is able to realize the simultaneous visible and near-infrared detection because of the complementary bandgaps of WSe2 and Bi2Se3(1.46 and 0.3 e V respectively).Thanks to the realigned band structure,the heterostructure shows an ultralow dark current below picoampere and a high tunneling-dominated *** photodetector based on our tunneling heterostructure exhibits a superior specific detectivity of 7.9×1012Jones for a visible incident of 532 nm and 2.2×1010Jones for a 1456 nm nearinfrared *** study demonstrates a new band structure engineering avenue for the construction of van der Waals tunneling heterostructures for high-performance wide band photodetection.

摘要：Owing to the abundance and low price of sodium,researches on sodium-ion batteries(SIBs)as a lithiumion battery(LIB)alternative are emerging as a *** is crucial to develop electrode materials suitable for sodium *** recent years,two-dimensional(2 D)layered transition metal disulfide compounds(TMDs)have trigered interest in the realm of energy and environmental *** particular,MoSeis thought to be a suitable material for SIBs due to its wide original layer spacing and high ***,N-doped dual carbon-coated MoSewith multichannel paths(MoSe/multichannel carbon nanofibers(MCFs)@NC)is fabricated via electrospinning,followed by a selenation and carbonization *** existence of a 3 D conductive network,abundant void spaces,and sufficient electron transportation pathways are conducive to rapid and fast charge transfer kinetics under volume expansion *** applied in SIBs,the MoSe/MCFs@NC shows a high capability(319 mA hg^(-1)at 10 A g^(-1)),as well as good cycling stability(303 mA h g^(-1)after 1100 cycles at 10 A g^(-1)).Furthermore,coupled with the Na_(3)V_(2)(PO_(4))_(2)O_(2)F cathode,the full cell also exhibits excellent *** theoretical calculation of the MoSe_(2)/MCFs@NC confirms that the superiority of its SIB performance is owing to the strong interaction between the double-doped carbon and *** scheme provides a wide space for preparing high-performance electrode materials for SIBs.

摘要：Lithium-sulfur(Li-S)batteries are regarded as one of the most promising next-generation energy storage systems due to their high theoretical energy density and low material ***,the conventional ether-based electrolytes of Li-S batteries are extremely flammable and have high solubility of lithium polysulfides(LiPS),resulting in a high safety risk and a poor life ***,we report an ether/carbonate co-solvent fluorinated electrolyte with a special solvation sheath of Li^(+),which can prevent the formation of dissoluble long-chain LiPS of the sulfur cathode,restrict Li dendrite growth at the anode side,and show fire resistance in combustion *** a result,the proposed Li-S batteries with 70 wt%sulfur content in its cathode deliver stable life cycle,low self-discharge ratio,and intrinsic ***,the unique passivation characteristics of the designed fluorinated electrolyte break several critical limitations of the traditional“liquid phase”-based Li-S batteries,offering a facile and promising way to develop long-life and high-safety Li-S batteries.