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We investigate the occurrence of magnetic and charge density wave instabilities in rhombohedral-stacked multilayer (three to eight layers) graphene by first principles calculations including exact exchange. Neglecting spin-polarization, an…

Materials Science · Physics 2017-03-07 Betül Pamuk , Jacopo Baima , Francesco Mauri , Matteo Calandra

Graphene physisorbed on a metal has its characteristic Dirac cones preserved in the band-structure, but the Fermi level of the system is shifted due to the interaction with the substrate. Based on density functional calculations with van…

Materials Science · Physics 2012-01-26 J. Slawinska , I. Zasada

In this work we study theoretically the electronic properties of a sheet of graphene grown on a periodic heterostructure substrate. We write an effective Dirac equation, which includes a dependence of both the band gap and the Fermi…

Materials Science · Physics 2014-11-12 Jonas R. F. Lima , F. Moraes

The unique property of bilayer graphene to show a band gap tunable by external electrical fields enables a variety of different device concepts with novel functionalities for electronic, optoelectronic and sensor applications. So far the…

Materials Science · Physics 2016-09-21 Bartholomaeus N. Szafranek , Daniel Schall , Martin Otto , Daniel Neumaier , Heinrich Kurz

Thin flakes of black phosphorus (BP) are a two-dimensional (2D) semiconductor whose energy gap is predicted being sensitive to the number of layers and external perturbations. Very recently, it was found that a simple method of potassium…

Materials Science · Physics 2015-12-15 Seung Su Baik , Keun Su Kim , Yeonjin Yi , Hyoung Joon Choi

Bilayer graphene (BLG) is semiconductor whose band gap and properties can be tuned by various methods such as doping or applying gate voltage. Here, we show how to tune electronic properties of BLG by intercalation of transition metal (TM)…

Materials Science · Physics 2018-03-14 Srimanta Pakhira , Kevin P. Lucht , Jose L. Mendoza-Cortes

We have performed a density functional study of graphene adsorbed on Au(111) surface using both a local density approximation and a semiempirical van der Waals approach proposed by Grimme, known as the DFT-D2 method. Graphene physisorbed on…

Materials Science · Physics 2015-05-27 J. Slawinska , P. Dabrowski , I. Zasada

Nitrogen-doped epitaxial graphene grown on SiC(000?1) was prepared by exposing the surface to an atomic nitrogen flux. Using Scanning Tunneling Microscopy (STM) and Spectroscopy (STS), supported by Density Functional Theory (DFT)…

Bilayer graphene has drawn significant attention due to the opening of a band gap in its low energy electronic spectrum, which offers a promising route to electronic applications. The gap can be either tunable through an external electric…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 Gregory M. Rutter , Suyong Jung , Nikolai N. Klimov , David B. Newell , Nikolai B. Zhitenev , Joseph A. Stroscio

Controlling the electronic structure of two-dimensional materials using the combination of twist angle and electrostatic doping is an effective means to induce emergent phenomena. In bilayer graphene with an interlayer twist angle near the…

Recently a paper of Klimovskikh et al. was published presenting experimental and theoretical analysis of the graphene/Pb/Pt(111) system. The authors investigate the crystallographic and electronic structure of this graphene-based system by…

Materials Science · Physics 2019-08-12 Yuriy Dedkov , Elena Voloshina

We demonstrate a fabrication scheme for clean suspended structures using chemical-vapor-deposition-grown graphene and a dry transfer method on lift-off-resist-coated substrates to facilitate suspended graphene nanoelectronic devices for…

Mesoscale and Nanoscale Physics · Physics 2019-05-22 Ying Liu , T. S. Abhilash , Antti Laitinen , Zhenbing Tan , Guan-jun Liu , Pertti Hakonen

It has been shown in a recent study [Nguyen et al., Nanotechnol. \textbf{25}, 165201 (2014)] that unstrained/strained graphene junctions are promising candidates to improve the performance of graphene transistors that is usually hindered by…

Mesoscale and Nanoscale Physics · Physics 2014-10-07 Mai Chung Nguyen , Viet Hung Nguyen , Huy-Viet Nguyen , Philippe Dollfus

Tuning band gaps in two-dimensional (2D) materials is of great interest in the fundamental and practical aspects of contemporary material sciences. Recently, black phosphorus (BP) consisting of stacked layers of phosphorene was…

Materials Science · Physics 2017-09-13 Sun-Woo Kim , Hyun Jung , Hyun-Jung Kim , Jin-Ho Choi , Su-Huai Wei , Jun-Hyung Cho

Gate-tunable spin-dependent properties could be induced in graphene at room temperature through magnetic proximity effect by placing it in contact with a metallic ferromagnet. Because strong chemical bonding with the metallic substrate…

Mesoscale and Nanoscale Physics · Physics 2020-11-17 Mihovil Bosnar , Ivor Lončarić , P. Lazić , K. D. Belashchenko , Igor Žutić

Graphene provides a unique platform for hosting high quality 2D electron systems. Encapsulating graphene with hexagonal boron nitride (hBN) to shield it from noisy environments offers the potential to achieve ultrahigh performance…

Mesoscale and Nanoscale Physics · Physics 2024-07-22 Won Beom Choi , Youngoh Son , Hangyeol Park , Yungi Jeong , Junhyeok Oh , K. Watanabe , T. Taniguchi , Joonho Jang

Opening a sizable band gap in the zero-gap germanene without heavy loss of carrier mobility is a key issue for its application in nanoelectronic devices such as high-performance field effect transistors (FETs) operating at room temperature.…

Mesoscale and Nanoscale Physics · Physics 2015-06-18 Meng Ye , Ruge Quhe , Jiaxin Zheng , Zeyuan Ni , Yangyang Wang , Yakun Yuan , Geoffrey Tse , Junjie Shi , Zhengxiang Gao , Jing Lu

Using density functional theory, we present a comparative study of the electronic properties of BN-doped graphene monolayer, bilayer, trilayer, and multilayer systems. In addition, we address a superlattice of pristine and BN-doped…

Mesoscale and Nanoscale Physics · Physics 2014-02-25 T. P. Kaloni , R. P. Joshi , N. P. Adhikari , U. Schwingenschlögl

Graphene has attracted increasing interests due to its remarkable properties, however, the zero band gap of monolayer graphene might limit its further electronic and optoelectronic applications. Herein, we have successfully synthesized…

Bandgap engineering by substituting C with B and N atoms in graphene has been shown to be a promising way to improve semiconducting properties of graphene. Such hybridized monolayers consisting of hexagonal BN phases in graphene (h-BNC)…

Materials Science · Physics 2015-05-28 Qing Peng , Amir Zamiri , Suvranu De