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We have studied the mechanical properties and phonon dispersions of fully hydrogenated borophene (borophane) under strains by first principles calculations. Uniaxial tensile strains along the a- and b-direction, respectively, and biaxial…

材料科学 · 物理学 2016-11-28 Zhiqiang Wang , Tie-Yu Lü , Hui-Qiong Wang , Yuan-Ping Feng , Jin-Cheng Zheng

We study the mechanical properties of two-dimensional (2D) boron, borophenes, by first-principles calculations. The recently synthesized borophene with 1/6 concentration of hollow hexagons (HH) is shown to have in-plane modulus C up to 210…

材料科学 · 物理学 2017-01-12 Zhuhua Zhang , Yang Yang , Evgeni S. Penev , Boris I. Yakobson

Recent experimental advances for the fabrication of various borophene sheets introduced new structures with a wide prospect of applications. Borophene is the boron atoms analogue of graphene. Borophene exhibits various structural polymorphs…

材料科学 · 物理学 2017-04-17 B Mortazavi , O Rahaman , A Dianat , T Rabczuk

A new two-dimensional (2D) material, borophene (2D boron sheet), has been grown successfully recently on single crystal Ag substrates by two parallel experiments [Mannix \textit{et al., Science}, 2015, \textbf{350}, 1513] [Feng \textit{et…

材料科学 · 物理学 2017-03-22 Bo Peng , Hao Zhang , Hezhu Shao , Zeyu Ning , Yuanfeng Xu , Hongliang Lu , David Wei Zhang , Heyuan Zhu

Recent success in synthesizing two-dimensional borophene on silver substrate attracts strong interest in exploring its possible extraordinary physical properties. By using the density functional theory calculations, we show that borophene…

材料科学 · 物理学 2016-02-18 Zhenqian Pang , Xin Qian , Ronggui Yang , Yujie Wei

The most recent experimental advances could provide ways for the fabrication of several atomic thick and planar forms of boron atoms. For the first time, we explore the mechanical properties of five types of boron films with various vacancy…

材料科学 · 物理学 2017-04-17 Minh-Quy Le , Bohayra Mortazavi , Timon Rabczuk

Recently fabricated two dimensional (2D) phosphorene crystal structures have demonstrated great potential in applications of electronics. Mechanical strain was demonstrated to be able to significantly modify the electronic properties of…

材料科学 · 物理学 2014-07-02 Qun Wei , Xihong Peng

Two-dimensional boron sheets (borophenes) have been successfully synthesized in experiments and are expected to exhibit intriguing transport properties such as the emergence of superconductivity and Dirac Fermions. However, quantitative…

计算物理 · 物理学 2020-07-28 Jin Zhang , Jia Zhang , Cai Cheng , Jian Liu , Johannes Lischner , Feliciano Giustino , Sheng Meng

Based on first-principles calculations, we study systematically the ideal tensile stress-strain relations of three monoatomic group-V monolayer two dimensional (2D) materials with buckled honeycomb lattices: blue phosphorene, arsenene, and…

计算物理 · 物理学 2019-05-02 Gang Liu , Zhibin Gao , Jian Zhou

Borophene (two-dimensional boron sheet) is a new type of two-dimensional material, which was recently grown successfully on single crystal Ag substrates. In this paper, we investigate the electronic structure and bonding characteristics of…

介观与纳米尺度物理 · 物理学 2016-06-23 Bo Peng , Hao Zhang , Hezhu Shao , Yuanfeng Xu , Rongjun Zhang , Heyuan Zhu

Recently, two-dimensional monolayer MoSi2N4 with hexagonal structure was successfully synthesized in experiment (Hong et al 2020 Science 369, 670). The fabricated monolayer MoSi2N4 is predicted to have excellent mechanical properties.…

介观与纳米尺度物理 · 物理学 2021-04-14 Qingfang Li , Wanxin Zhou , Xiangang Wan , Jian Zhou

Borophene, an atomically thin, corrugated, crystalline two-dimensional boron sheet, has been recently synthesized. We investigate mechanical properties and lattice thermal conductivity of borophene via reactive molecular dynamics…

材料科学 · 物理学 2017-07-05 Bohayra Mortazavi , Minh-Quy Le , Timon Rabczuk , Luiz Felipe C. Pereira

The tribological performance of 2D materials makes them good candidates toward a reduction of friction at the macroscale. Superlubricity has been observed for graphene, MoS\textsubscript{2} and MXenes and hexagonal boron nitride (hBN) is…

Two-dimensional (2D) structures of boron atoms so called borophene, have recently attracted remarkable attention. In a latest exciting experimental study, a hydrogenated borophene structure was realized. Motivated by this success, we…

Two-dimensional boron monolayer (borophene) stands out from the two-dimensional atomic layered materials due to its structural flexibility, tunable electronic and mechanical properties from a large number of allotropic materials. The…

材料科学 · 物理学 2022-05-31 Yuchong Kang , Xiaoyun Ma , Jing Fu , Kun Yang , Zongguo Wang , Haibo Li , Wei Ma , Jin Zhang

Superconductivity in two-dimensional compounds is widely concerned, not only due to its application in constructing nano-superconducting devices, but also for the general scientific interests. Very recently, borophene (two-dimensional boron…

超导电性 · 物理学 2017-01-13 Miao Gao , Qi-Zhi Li , Xun-Wang Yan , Jun Wang

The recent discovery of borophene, a two-dimensional allotrope of boron, raises many questions about its structure and its chemical and physical properties. Boron has a high chemical affinity to oxygen but little is known about the…

材料科学 · 物理学 2020-02-28 Florian M. Arnold , Gotthard Seifert , Jens Kunstmann

Two-dimensional systems have strengthened their position as one of the key materials for novel applications. Very recently, boron joined the distinguished group of elements that are confirmed to possess 2D allotropes, named borophenes. In…

材料科学 · 物理学 2021-09-21 N. Gonzalez Szwacki

Borophene, a monoatomic layer of boron atoms, stands out among two-dimensional (2D) materials, with its versatile properties of polymorphism, metallicity, plasmonics, superconductivity, tantalizing for physics exploration and…

材料科学 · 物理学 2021-11-25 Qiyuan Ruan , Luqing Wang , Ksenia V. Bets , Boris I. Yakobson

The ideal strength is the maximum stress a material can withstand, and it is an important intrinsic property for structural applications. Griffith strength limit ~E/9 is the best known upper bound of this property for a material loaded in…

材料科学 · 物理学 2017-03-17 Zhe Shi , Chandra Veer Singh
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