ANTIPEROVSKITE

作品数：21被引量：19H指数：3
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相关领域：理学更多>>
相关作者：聂曼更多>>
相关机构：北京航空航天大学更多>>
相关期刊：《InfoMat》《Chinese Physics B》《Chinese Physics Letters》《Chinese Journal of Structural Chemistry》更多>>
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Enhancement of–OH content on mechanical properties of antiperovskite solid electrolytes
《Nano Research》2024年第7期6139-6146,共8页Zunqiu Xiao Huaying Wang Ningyuan Cai Yutong Li Kejia Xiang Wei Wei Tao Ye Zhongtai Zhang Shitong Wang Zilong Tang 
the National Natural Science Foundation of China(Nos.52172210 and 51772163).
All-solid-state batteries,renowned for their enhanced safety and high energy density,have garnered broad interest.Oxide solid electrolytes are highly anticipated for their balanced performance.However,their high Young...
关键词：mechanical properties -OH content anti-perovskite solid electrolytes Li-ion batteries 
Manipulating non-collinear antiferromagnetic order and thermal expansion behaviors in triangular lattice Mn_(3)Ag_(1-x)Sn(Ge)_(x)N
《Journal of Materiomics》2024年第2期456-462,共7页Dongmei Hu Sihao Deng Ying Sun Kewen Shi Xiuliang Yuan Shihai An Lunhua He Jie Chen Yuanhua Xia Cong Wang 
supported by the financial support of National Key R&D Program of China(2022YFA1402600);National Natural Science Foundation of China(NSFC)(52272264);Sino-German Mobility Programme Project(M-0273);the Guangdong Basic and Applied Basic Research Foundation(2022A1515140117).
Magnetic materials with non-collinear spin orderings provide an outstanding platform to probe spin-tronic phenomena owing to their strong spin-orbit coupling(SOC)and unique Berry phase.It is thus important to obtain a...
关键词：Non-collinear magnet Antiferromagnetic spintronics Nearly zero thermal expansion Neutron powder diffraction ANTIPEROVSKITE 
Density Functional Calculations of the Mechanical, Electronic and Dynamical Properties of Antiperovskite Ca<sub>3</sub>BO (B = Pb, Ge, Sn)
《Open Journal of Microphysics》2024年第1期1-12,共12页Phillip Wilfsen Otieno Nyawere 
An analysis of mechanical, electronic and dynamical properties of antiperovskite Ca3BO (B = Pb, Ge, Sn) in cubic phase space group Pm-3m (221) has been studied using first principle density functional theor...
关键词：ANTIPEROVSKITE Elastic Constants Generalized Gradient Approximation 
Pressure-dependent electronic,optical,and mechanical properties of antiperovskite X_(3)NP(X=Ca,Mg):A first-principles study
《Journal of Semiconductors》2023年第10期52-60,共9页Chunbao Feng Changhe Wu Xin Luo Tao Hu Fanchuan Chen Shichang Li Shengnan Duan Wenjie Hou Dengfeng Li Gang Tang Gang Zhang 
supported by the Science and Technology Research Program of Chongqing Municipal Education Commission (Grant No. KJQN202100626);the Science and Technology Research Program of Chongqing Municipal Education Commission (Grant No. KJQN202200619);supported by Beijing Institute of Technology Research Fund Program for Young Scholars (Grant No. XSQD-202222008);the support from the National Natural Science Foundation of China (Grant No. 12204081);the Natural Science Foundation of Chongqing (Grant No. 2022NSCQ-MSX2540);supported by TianHe Qingsuo Project-spec ial fund project
Hydrostatic pressure provides an efficient way to tune and optimize the properties of solid materials without chang-ing their composition.In this work,we investigate the electronic,optical,and mechanical properties of...
关键词：ANTIPEROVSKITE hydrostatic pressure physical properties first-principles calculations 
Alkali Ionic Conductivity in Inorganic Glassy Electrolytes
《Journal of Materials Science and Chemical Engineering》2023年第7期31-72,共42页Ram Krishna Hona Mandy Guinn Uttam S. Phuyal S’Nya Sanchez Gurjot S. Dhaliwal 
Glassy electrolytes could be a potential candidate for all-solid-state batteries that are considered new-generation energy storage devices. As glasses are one of the potential fast ion-conducting electrolytes, progres...
关键词：Glass Electrolyte Solid State Ionic Glass Battery Charge ANTIPEROVSKITE Ionic Conductivity 
Neutron diffraction for revealing the structures and ionic transport mechanisms of antiperovskite solid electrolytes
《Chinese Journal of Structural Chemistry》2023年第5期56-64,共9页Lei Gao Jiangyang Pan Longbang Di Jinlong Zhu Liping Wang Song Gao Ruqiang Zou Le Kang Songbai Han Yusheng Zhao 
supported by the open research fund of Songshan Lake Materials Laboratory(2022SLABFK04);the National Natural Science Foundation of China(12275119,52227802,U22A20439);Shenzhen Science and Technology Program(KQTD20200820113047086);Shenzhen Foundation Research Fund granted by the Shenzhen Science and Technology Innovation Committee(JCYJ20220530112812028);Guangdong Grants(2021ZT09C064);Major Science and Technology Infrastructure Project of Material Genome Big science Facilities Platform supported by the Municipal Development and Reform Commission of Shenzhen.
Solid-state electrolytes(SSEs)play the most important role in the development of cutting-edge all-solid-state bat-teries(ASSBs).The lithium(sodium)-rich antiperovskite solid conductors have been considered as the prom...
关键词：Solid-state electrolytes ANTIPEROVSKITE Neutron diffraction STRUCTURE 
反钙钛矿结构氮化铜纳米片实现高效电催化甲醇氧化转化为甲酸盐被引量：1
《Science China Materials》2023年第5期1820-1828,共9页赵磊 孙啟焦 李懋 钟亚霏 沈沛祺 林运祥 徐坤 
supported by the Natural Science Foundation of Anhui Province(2208085Y03);the Start-up Grant from Anhui University。
钙钛矿氧化物具有灵活的组成和电子结构,在电催化水氧化反应中具有很大的应用潜力.然而,钙钛矿氧化物在电催化有机小分子转化中的应用研究较少,这可能是由于其导电性差,表面重构产生活性物种所需的能垒高.在本文中,我们报道了具有典型...
关键词：ANTIPEROVSKITE copper nitride methanol oxidation reaction FORMATE 
Effects of fluorination on crystal structure and electrochemical performance of antiperovskite solid electrolytes被引量：1
《Journal of Energy Chemistry》2023年第2期521-528,I0013,共9页Lei Gao Manrong Song Ruo Zhao Songbai Han Jinlong Zhu Wei Xia Juncao Bian Liping Wang Song Gao Yonggang Wang Ruqiang Zou Yusheng Zhao 
supported by the National Key Research and Development Program of China(2020YFA0210701);the National Natural Science Foundation of China(22005134,12275119,U22A20439);the Shenzhen Science and Technology Program(RCBS20210609103647030);the Guangdong Basic and Applied Basic Research Foundation(2021A1515012403);the Shenzhen Science and Technology Program(KQTD20200820113047086);the Guangdong-Hong Kong-Macao Joint Laboratory for PhotonicThermal-Electrical Energy Materials and Devices(2019B121205001);the open research fund of Songshan Lake Materials Laboratory(2022SLABFK04)。
The development of all-solid-state lithium batteries(ASSLBs)depends on exploiting solid-state electrolytes(SSEs)with high ionic conductivity and electrochemical stability.Fluorination is generally considered to be an ...
关键词：ANTIPEROVSKITE Solid-state electrolyte FLUORINATION Ionic conductivity 
Structure inversion asymmetry enhanced electronic structure and electrical transport in 2D A3SnO(A=Ca,Sr,and Ba)antiperovskite monolayers
《Nano Research》2023年第1期1779-1791,共13页Syed Muhammad Alay-e-Abbas Ghulam Abbas Waqas Zulfiqar Muhammad Sajjad Nirpendra Singh J.Andreas Larsson 
The computations were enabled by resources provided by the Swedish National Infrastructure for Computing(SNIC)at HPC2N and NSC partially funded by the Swedish Research Council through grant agreement no.2018-05973.
Anti-perovskites A3SnO(A=Ca,Sr,and Ba)are an important class of materials due to the emergence of Dirac cones and tiny mass gaps in their band structures originating from an intricate interplay of crystal symmetry,spi...
关键词：electrical transport anti-perovskites low-dimensional materials electronic structure mechanical properties 
Differentiating grain and grain boundary ionic conductivities of Li-ion antiperovskite electrolytes被引量：1
《eScience》2022年第6期639-645,共7页Jingfeng Zheng Jocelyn Elgin Jieren Shao Yiying Wu 
Thiswork was financially supported by The Ohio State University.
Recently,antiperovskites such as Li_(2)OHX(X=Cl,Br)have gained attention as possible solid-state electrolytes for use in all-solid-state batteries.Their low melting point allows for scalable manufacturing,making them ...
关键词：Solid-state electrolyte Antiperovskites Grain and grain boundary Ionic conductivity Li_(2)OHBr Li_(2)OHCl 
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