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Related papers: Switchable Atomically Thin 2D Electrides from Firs…

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2D materials with nontrivial energy bands are highly desirable for exploring various topological phases of matter, as low dimensionality opens unprecedented opportunities for manipulating the quantum states. Here, it is reported that…

Mesoscale and Nanoscale Physics · Physics 2020-01-17 Chenqiang Hua , Si Li , Zhu-An Xu , Yi Zheng , Shengyuan A. Yang , Yunhao Lu

Electrides, with their excess electrons distributed in crystal cavities playing the role of anions, exhibit a variety of unique electronic and magnetic properties. In this work, we employ the first-principles crystal structure prediction to…

Materials Science · Physics 2019-03-06 Sheng-cai Zhu , Lei Wang , Jing-yu Qu , Jun-jie Wang , Timofey Frolov , Xing-Qiu Chen , Qiang Zhu

The development of multifunctional devices calls for the discovery of new layered materials with novel electronic properties. f-electron systems naturally host a rich set of competing and intertwining phases owning to the presence of strong…

Materials Science · Physics 2024-11-27 Lin Hou , Ying Wai Li , Christopher Lane

Recently, two-dimensional layered electrides have emerged as a new class of materials which possess anionic electron layers in the interstitial spaces between cationic layers. Here, based on first-principles calculations, we discover a…

Materials Science · Physics 2020-11-04 Shuyuan Liu , Chongze Wang , Liangliang Liu , Jin-Ho Choi , Hyun-Jung Kim , Yu Jia , Chul Hong Park , Jun-Hyung Cho

Thanks to their unique properties single-layer 2-D materials appear as excellent candidates to extend Moore's scaling law beyond the currently manufactured silicon FinFETs. However, the known 2-D semiconducting components, essentially…

Mesoscale and Nanoscale Physics · Physics 2020-06-30 Cedric Klinkert , Áron Szabó , Christian Stieger , Davide Campi , Nicola Marzari , Mathieu Luisier

Metal carbides, nitrides, or carbonitrides of early transition metals, better known as MXenes, possess notable structural, electrical, and magnetic properties. Analyzing electronic structures by calculating structural stability, band…

Two-dimensional (2D) semiconducting transition metal dichalcogenides (TMDs) are good candidates for high-performance flexible electronics. However, most demonstrations of such flexible field-effect transistors (FETs) to date have been on…

The discovery of two-dimensional (2D) materials possessing switchable spontaneous polarization with atomic thickness opens up exciting opportunities to realize ultrathin, high-density electronic devices with potential applications ranging…

Materials Science · Physics 2020-11-04 Jiawei Huang , Sang-Hoon Lee , Andrew Supka , Young-Woo Son , Shi Liu

A high-throughput screening based on first-principles calculations was performed to search for new ternary inorganic electrides. From the available materials database, we identified three new thermodynamically stable materials…

Materials Science · Physics 2019-02-13 Junjie Wang , Qiang Zhu , Zhenhai Wang , Hideo Hosono

Materials in which electrons occupy interstitial sites as anions are called electrides and exhibit unusual dimensionality-dependent electronic behavior. These properties make electrides attractive for catalysis, transparent conductors, and…

Materials Science · Physics 2026-01-01 Lee A. Burton

Two-dimensional (2D) ferroelectric (FE) materials are promising compounds for next-generation nonvolatile memories, due to their low energy consumption and high endurance. Among them, {\alpha}-In$_{2}$Se$_{3}$ has drawn particular attention…

In conventional electrides, excess electrons are localized in crystal voids to serve as anions. Most of these electrides are metallic and the metal cations are primarily from the s-block, d-block, or rare-earth elements. Here, we report a…

Materials Science · Physics 2025-03-05 Jiaqi Dai , Feng Yang , Cong Wang , Fei Pang , Zhihai Cheng , Wei Ji

Recent technological advances in controlling materials have developed methods to produce idealized two-dimensional (2D) electron systems such as heterogeneous interfaces, molecular-beam-epitaxy (MBE) grown atomic layers, exfoliated thin…

Superconductivity · Physics 2017-03-13 Yu Saito , Tsutomu Nojima , Yoshihiro Iwasa

N-graphdiyne monolayers, a set of carbon-nitride nanosheets, have been synthesized recently through the polymerization of triazine- and pyrazine-based monomers. Since the two-dimensional nano-structures are mainly composed of light-weight…

Computational Physics · Physics 2018-12-27 Meysam Makaremi , Bohayra Mortazavi , Timon Rabczuk , Geoffrey A. Ozin , Chandra Veer Singh

Surfaces are at the frontier of every known solid. They provide versatile supports for functional nanostructures and mediate essential physicochemical processes. Being intimately related with 2D materials, interfaces and atomically thin…

We report intrinsic ferromagnetism in monolayer electrides or electrenes, in which excess electrons act as anions. Our first-principles calculations demonstrate that magnetism in such electron-rich two-dimensional (2D) materials originates…

Computational Physics · Physics 2020-11-25 Jun Zhou , Yuan Ping Feng , Lei Shen

Two-dimensional (2D) transition metal nitrides have a wide prospect of applications in the fields of physics, chemistry, materials, etc. However, 2D transition metal nitrides with strong magnetism, especially high N$\rm \acute{e}$el…

Materials Science · Physics 2025-03-18 Lujia Tian , Lihui Han , Yuanfang Yue , Huazhen Li , Z. Y. Xie , Xun-Wang Yan

Based on first-principles calculations, we discover a two-dimensional layered antiferromagnetic (AFM) electride Gd$_2$O, where anionic excess electrons exist in the interstitial spaces between positively charged cationic layers. It is…

Materials Science · Physics 2022-01-26 Shuyuan Liu , Chongze Wang , Hyunsoo Jeon , Jeehoon Kim , Jun-Hyung Cho

Experiments show that at even denominator fractions (EDFs) ($\nu=1/2, 3/4, 3/2$,...) the two-dimensional electron gas in a strong magnetic field becomes compressible, has no energy gap, and demonstrates the presence of an ostensible Fermi…

Mesoscale and Nanoscale Physics · Physics 2009-10-28 D. V. Khveshchenko

With advances in exfoliation and synthetic techniques, atomically thin films of semiconducting transition metal dichalcogenides have recently been isolated and characterized. Their two-dimensional structure, coupled with a direct band gap…

Mesoscale and Nanoscale Physics · Physics 2014-02-04 Deep Jariwala , Vinod K. Sangwan , Lincoln J. Lauhon , Tobin J. Marks , Mark C. Hersam