4.7 Article

Ferroelastic Zr2P2XY (X/Y = I, Br, Cl or F; X =?Y) monolayers with tunable in-plane electronic anisotropy and remarkable out-of-plane piezoelectricity

相关参考文献

注意:仅列出部分参考文献,下载原文获取全部文献信息。
Article Chemistry, Physical

A multiferroic vanadium phosphide monolayer with ferromagnetic half-metallicity and topological Dirac states

Xiaoyu Xuan et al.

Summary: This study reports the first-principles prediction of a dynamically and thermally stable tetragonal vanadium phosphide (t-VP) monolayer with desirable properties such as ferroelasticity, ferromagnetism, half-metallicity, and topological Dirac states. The research also predicts a multiferroic t-CrN monolayer with high Curie temperature but weak coupling to in-plane ferroelasticity. The results suggest that a tetragonal 2D lattice can serve as a robust atomic-scale scaffold for creating fascinating electronic and magnetic properties through a suitable combination of chemical elements.

NANOSCALE HORIZONS (2022)

Article Physics, Applied

Large out-of-plane piezoelectric response in ferromagnetic monolayer NiClI

San-Dong Guo et al.

Summary: In this study, a two-dimensional piezoelectric ferromagnetic material NiClI with large magnetic anisotropy energy and piezoelectricity was predicted, showing potential value for device applications.

APPLIED PHYSICS LETTERS (2022)

Article Chemistry, Physical

The flexible Janus X2PAs (X = Si, Ge and Sn) monolayers with in-plane and out-of-plane piezoelectricity

Yang Wu et al.

Summary: This paper presents the demonstration of Janus X2PAs (X = Si, Ge and Sn) monolayers, which possess piezoelectricity in both in-plane and out-of-plane. The investigation shows that these monolayers are stable, flexible, and exhibit excellent piezoelectric effects. Among them, the Sn2PAs monolayer has the largest piezoelectric coefficient, making it a promising candidate for multifunctional sensing and controlling of nanodevices.

APPLIED SURFACE SCIENCE (2022)

Article Chemistry, Physical

Tri-MX: New group-IV monochalcogenide monolayers with excellent piezoelectricity and special optical properties

Xinxin Li et al.

Summary: This study predicts four new two-dimensional monochalcogenides with three atomic sub-layers and investigates their properties. The results show that these compounds exhibit excellent piezoelectricity and special optical properties, making them promising for applications in electronic screens, energy harvesting, and UV protection.

APPLIED SURFACE SCIENCE (2022)

Article Materials Science, Multidisciplinary

Enhanced vertical polarization and ultra-low polarization switching barriers of two-dimensional SnS/SnSSe ferroelectric heterostructures

Yun-Qin Li et al.

Summary: A new stable SnS/SnSSe heterostructure with enhanced ferroelectricity is reported, demonstrating the ability of polarization switching through heterostructure inversion and sliding the top SnS monolayer. The heterostructure shows strong vertical polarization and low switching barriers, making it suitable for applications in nanoelectronics.

JOURNAL OF MATERIALS CHEMISTRY C (2022)

Article Materials Science, Multidisciplinary

Structural, electronic, and transport properties of quintuple atomic Janus monolayers Ga2SX2 (X = O, S, Se, Te): First-principles predictions

Nguyen N. Hieu et al.

Summary: In this study, the structural, electronic, and transport properties of quintuple-layer atomic Janus Ga2SX2 (X = O, S, Se, Te) monolayers were systematically investigated using first-principles calculations. It was found that the vertical intrinsic electric fields in the Janus structures resulted in a vacuum level difference and different electronic properties for different configurations. Strain engineering was found to alter the electronic properties, and the semiconducting Janus monolayers exhibited high electron mobilities, making them suitable for next-generation electronic devices.

PHYSICAL REVIEW B (2022)

Article Physics, Applied

Antiferromagnetic ferroelastic multiferroics in single-layer VOX (X = Cl, Br) predicted from first-principles

Yangyang Feng et al.

Summary: This study reports the identification of 2D antiferromagnetic ferroelastic multiferroics in single-layer transition-metal oxyhalides, revealing their robust antiferromagnetic semiconducting nature and extraordinary ferroelasticity for controlling in-plane magnetic anisotropy. This provides valuable insights for fundamental research in antiferromagnetic multiferroics and potential applications in nanodevices.

APPLIED PHYSICS LETTERS (2021)

Article Chemistry, Physical

Preparation of epitaxial yttria-stabilized zirconia with non-quilibrium t' phase and ferroelastic domain by pulsed laser deposition

Junbao Li et al.

Summary: Stable t' epitaxial YSZ films with multiple domain structure were successfully prepared using substrate clamping and non-equilibrium growth process, with crystal orientation of the YSZ film found to change with oxygen pressure during deposition.

APPLIED SURFACE SCIENCE (2021)

Article Chemistry, Physical

Enhanced properties of covalently coupled borophene-graphene layers through fluorination and hydrogenation

A. Kochaev et al.

Summary: A borophene-graphene vertical heterostructure has been successfully grown on argent substrate, showing potential applications through hydrogen and fluorine doping. The strength of interlayer interaction in these materials is determined by the type of doping, with band structure tunable by passivating but only a few of the considered heterostructures are dynamically stable. The potential applications in acousto- and optoelectronics are briefly discussed for stable materials with high piezoelectric constants and absorption coefficients.

APPLIED SURFACE SCIENCE (2021)

Article Chemistry, Physical

Stacking Engineering: A Boosting Strategy for 2D Photocatalysts

Jinfeng Zhao et al.

Summary: The study proposes a method to enhance the separation of photoexcited charge carriers in 2D photocatalysts through stacking engineering, using MoSi2N4 as an example to demonstrate the significant role of stacking-induced electric polarization in altering electronic properties and suppressing recombination rates. Furthermore, it is found that catalytic performance can be further controlled through vertical strain.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2021)

Article Chemistry, Physical

Controllable electric field tuning of anisotropic magnetic response of Ni/PMN-PT heterostructures

Yuanzhi Xiang et al.

Summary: This study investigates the magnetic response of epitaxial Ni films on PMN-PT substrates using electric field tuning, revealing different types of magnetic response curves along different film directions. The observed phenomena are assumed to be related to ferroelectric and ferroelastic domain switching, film strain status, and magnetic anisotropy, demonstrating the feasibility of controlling anisotropic magnetic response via electric field in multiferroic heterostructures.

APPLIED SURFACE SCIENCE (2021)

Article Chemistry, Physical

Piezoelectricity in monolayer MXene for nanogenerators and piezotronics

Dongchen Tan et al.

Summary: This study reports the first experimental investigation of the piezoelectric responses of monolayer Ti(3)C(2)Tx MXene, showing high current output and conversion efficiency in the armchair direction. The theoretical calculations also explain the origin of the piezoelectric properties in MXene, providing a foundation for future applications in nanodevices and stretchable electronics.

NANO ENERGY (2021)

Article Nanoscience & Nanotechnology

Novel Two-Dimensional Janus MoSiGeN4 and WSiGeN4 as Highly Efficient Photocatalysts for Spontaneous Overall Water Splitting

Yadong Yu et al.

Summary: This study explores novel Janus structures based on the two-dimensional material MoSi2N4, which exhibit excellent stability and potential in photocatalytic applications. By constructing Janus structures, the separation of photoexcited electrons and holes is enhanced, altering the band alignment and providing driving force for water redox reactions. Surface N vacancy effectively reduces energy demand, allowing for a self-sustained catalytic process under light conditions.

ACS APPLIED MATERIALS & INTERFACES (2021)

Article Materials Science, Multidisciplinary

Enhanced out-of-plane piezoelectricity of group-III(A) Janus hydrofluoride monolayers

He-Na Zhang et al.

Summary: The research investigates the theoretical simulation of Janus semiconductor nanosheets, with F-B-H demonstrating the highest stability and significant vertical piezoelectric effect. This study provides a new approach to address the challenges faced by 2D piezoelectric materials in practical applications.

PHYSICAL REVIEW B (2021)

Article Materials Science, Multidisciplinary

Prediction of two-dimensional ferroelectric metal Mxenes

Dimuthu Wijethunge et al.

Summary: Metals with spontaneous electric polarization show promising characteristics for enhancing nanoelectronics, with 2D Nb2NF2 being a unique ferroelectric metal with reversible out-of-plane electrical polarization. Among 72 investigated 2D surface functionalized Mxene compositions, only Nb2NF2 showed stability in a novel ground state, suggesting potential for discovering novel 2D ferroelectric Mxenes with different attributes.

JOURNAL OF MATERIALS CHEMISTRY C (2021)

Article Materials Science, Multidisciplinary

Combined piezoelectricity and ferrovalley properties in Janus monolayer VClBr

Yi-Feng Zhao et al.

Summary: The concept of ferrovalley materials has recently been proposed, highlighting the potential of Janus VClBr monolayer with its significant valley polarization and piezoelectricity. These unique properties could pave the way for multifunctional valleytronics and optoelectronics devices.

PHYSICAL REVIEW B (2021)

Article Materials Science, Multidisciplinary

Intrinsic triferroicity in a two-dimensional lattice

Shiying Shen et al.

Summary: In this study, intrinsic triferroicity was demonstrated in a two-dimensional lattice, with single-layer FeO2H shown to exhibit antiferromagnetism, ferroelasticity, ferroelectricity, and in-plane piezoelectric effect. These findings not only expand the scientific and technological impact of triferroics but also open up a wide range of nanodevice applications.

PHYSICAL REVIEW B (2021)

Article Chemistry, Physical

Two-Dimensional Ferroelastic Semiconductors in Nb2SiTe4 and Nb2GeTe4 with Promising Electronic Properties

Ting Zhang et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2020)

Review Physics, Applied

Quantum properties and applications of 2D Janus crystals and their superlattices

M. Yagmurcukardes et al.

APPLIED PHYSICS REVIEWS (2020)

Article Multidisciplinary Sciences

Chemical vapor deposition of layered two-dimensional MoSi2N4 materials

Yi-Lun Hong et al.

SCIENCE (2020)

Article Materials Science, Multidisciplinary

Stable single layer of Janus MoSO: Strong out-of-plane piezoelectricity

M. Yagmurcukardes et al.

PHYSICAL REVIEW B (2020)

Article Chemistry, Physical

Piezoelectricity and dipolar polarization of group V-IV-III-VI sheets: A first-principles study

Jin-Peng Li et al.

APPLIED SURFACE SCIENCE (2019)

Article Chemistry, Multidisciplinary

Two-Dimensional PC6 with Direct Band Gap and Anisotropic Carrier Mobility

Tong Yu et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2019)

Article Materials Science, Multidisciplinary

Hydrogenated PtP2 monolayer: theoretical predictions on the structure and charge carrier mobility

Chunying Pu et al.

JOURNAL OF MATERIALS CHEMISTRY C (2019)

Article Chemistry, Physical

Two- dimensional Janus PtSSe for photocatalytic water splitting under the visible or infrared light

Rui Peng et al.

JOURNAL OF MATERIALS CHEMISTRY A (2019)

Article Materials Science, Multidisciplinary

Electronic, vibrational, elastic, and piezoelectric properties of monolayer Janus MoSTe phases: A first-principles study

M. Yagmurcukardes et al.

PHYSICAL REVIEW B (2019)

Article Chemistry, Multidisciplinary

Multidirection Piezoelectricity in Mono- and Multilayered Hexagonal α-In2Se3

Fei Xue et al.

ACS NANO (2018)

Article Chemistry, Physical

Piezoelectric and polarized enhancement by hydrofluorination of penta-graphene

Hao-Jun Jia et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2018)

Article Chemistry, Multidisciplinary

Chemically Functionalized Phosphorene: Two-Dimensional Multiferroics with Vertical Polarization and Mobile Magnetism

Qing Yang et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2017)

Article Chemistry, Multidisciplinary

Ferroelectricity, Antiferroelectricity, and Ultrathin 2D Electron/Hole Gas in Multifunctional Monolayer MXene

Anand Chandrasekaran et al.

NANO LETTERS (2017)

Article Chemistry, Multidisciplinary

Large In-Plane and Vertical Piezoelectricity in Janus Transition Metal Dichalchogenides

Liang Dong et al.

ACS NANO (2017)

Article Multidisciplinary Sciences

Ferroelasticity and domain physics in two-dimensional transition metal dichalcogenide monolayers

Wenbin Li et al.

NATURE COMMUNICATIONS (2016)

Article Materials Science, Multidisciplinary

Mechanical properties of monolayer GaS and GaSe crystals

M. Yagmurcukardes et al.

PHYSICAL REVIEW B (2016)

Article Chemistry, Multidisciplinary

Ab Initio Prediction of Piezoelectricity in Two-Dimensional Materials

Michael N. Blonsky et al.

ACS NANO (2015)

Article Chemistry, Physical

Piezoelectricity in two-dimensional group-III monochalcogenides

Wenbin Li et al.

NANO RESEARCH (2015)

Article Chemistry, Physical

Carrier Mobility in Graphyne Should Be Even Larger than That in Graphene: A Theoretical Prediction

Jianming Chen et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)

Article Chemistry, Physical

Intrinsic Piezoelectricity in Two-Dimensional Materials

Karel-Alexander N. Duerloo et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2012)

Article Materials Science, Multidisciplinary

Mechanical properties of graphene and boronitrene

R. C. Andrew et al.

PHYSICAL REVIEW B (2012)

Article Computer Science, Interdisciplinary Applications

PHON: A program to calculate phonons using the small displacement method

Dario Alfe

COMPUTER PHYSICS COMMUNICATIONS (2009)

Article Materials Science, Multidisciplinary

A fast and robust algorithm for Bader decomposition of charge density

Graeme Henkelman et al.

COMPUTATIONAL MATERIALS SCIENCE (2006)

Article Chemistry, Physical

Assessment and validation of a screened Coulomb hybrid density functional

J Heyd et al.

JOURNAL OF CHEMICAL PHYSICS (2004)

Article Multidisciplinary Sciences

Electric field effect in atomically thin carbon films

KS Novoselov et al.

SCIENCE (2004)

Article Chemistry, Physical

A climbing image nudged elastic band method for finding saddle points and minimum energy paths

G Henkelman et al.

JOURNAL OF CHEMICAL PHYSICS (2000)