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We investigate the electronic band structure of graphene on a series of two-dimensional magnetic transition-metal phosphorus trichalcogenide monolayers, MPX$_3$ with M={Mn,Fe,Ni,Co} and X={S,Se}, with first-principles calculations. A…

Mesoscale and Nanoscale Physics · Physics 2022-07-22 Klaus Zollner , Jaroslav Fabian

The density of electron-hole pairs produced in a graphene sample immersed in a homogeneous time-dependent electrical field is evaluated. Because low energy charge carriers in graphene are described by relativistic quantum mechanics, the…

Mesoscale and Nanoscale Physics · Physics 2017-04-24 F. Fillion-Gourdeau , P. Blain , D. Gagnon , C. Lefebvre , S. MacLean

We study the distribution of vacuum polarization charge induced by a Coulomb impurity in massive graphene. By analytically computing the polarization function, we show that the charge density is distributed in space in a non-trivial…

Mesoscale and Nanoscale Physics · Physics 2008-08-22 Valeri N. Kotov , Vitor M. Pereira , Bruno Uchoa

We investigate the energy spectrum, wave functions, and local density of states of an electrical dipole placed on a sheet of gapped graphene as function of the charge strength Z{\alpha} for different sizes of the dipole and for different…

Mesoscale and Nanoscale Physics · Physics 2018-10-22 R. Van Pottelberge , B. Van Duppen , F. M. Peeters

The status of different extensions of the Random Phase Approximation (RPA) is reviewed. The general framework is given within the Equation of Motion Method and the equivalent Green's function approach for the so-called Self-Consistent RPA…

Nuclear Theory · Physics 2021-08-25 P. Schuck , D. S. Delion , J. Dukelsky , M. Jemai , E. Litvinova , G. Roepke , M. Tohyama

We obtain the quasiparticle band structure of ABA and ABC-stacked graphene trilayers through ab initio density functional theory (DFT) and many-body quasiparticle calculations within the GW approximation. To interpret our results, we fit…

Mesoscale and Nanoscale Physics · Physics 2014-02-10 Marcos G. Menezes , Rodrigo B. Capaz , Steven G. Louie

We study the interaction of graphene with ultrashort few femtosecond long optical pulse. For such a short pulse, the electron dynamics is coherent and is described within the tight-binding model of graphene. The interaction of optical pulse…

Mesoscale and Nanoscale Physics · Physics 2014-01-23 Hamed Koochaki Kelardeh , Vadym Apalkov , Mark I. Stockman

We present a multi-scale density functional theory (DFT) informed molecular dynamics and tight-binding (TB) approach to capture the interdependent atomic and electronic structures of twisted bilayer graphene. We calibrate the flat band…

Mesoscale and Nanoscale Physics · Physics 2022-03-17 Nicolas Leconte , Srivani Javvaji , Jiaqi An , Appalakondaiah Samudrala , Jeil Jung

We investigate the evolution of the Raman spectrum of defected graphene as a function of doping. Polymer electrolyte gating allows us to move the Fermi level up to 0.7eV, as monitored by \textit{in-situ} Hall-effect measurements. For a…

Materials Science · Physics 2014-10-14 M. Bruna , A. K. Ott , M. Ijas , D. Yoon , U. Sassi , A. C. Ferrari

We study the dielectric properties of graphene in the presence of Rashba and intrinsic spin-orbit interactions in their most general form, i.e., for arbitrary frequency, wave vector, doping, and spin-orbit coupling (SOC) parameters. The…

Mesoscale and Nanoscale Physics · Physics 2012-11-26 Andreas Scholz , Tobias Stauber , John Schliemann

We report on the existence of water-gated charge doping of graphene deposited on atomically flat mica substrates. Molecular films of water in units of ~0.4 nm-thick bilayers were found to be present in regions of the interface of…

Materials Science · Physics 2021-07-16 Jihye Shim , Chun Hung Lui , Taeg Yeoung Ko , Young-Jun Yu , Philip Kim , Tony F. Heinz , Sunmin Ryu

We characterize the carrier density profile of the ground state of graphene in the presence of particle-particle interaction and random charged impurity for zero gate voltage. We provide detailed analysis on the resulting spatially…

Mesoscale and Nanoscale Physics · Physics 2017-03-15 M. N. Najafi , M. Ghasemi Nezhadhaghighi

We study the spatial properties of the Casimir friction phenomenon for an atom moving at a non-relativistic constant velocity parallel to a planar graphene sheet. The coupling of the atom to the vacuum electromagnetic (EM) field is…

Quantum Physics · Physics 2023-08-30 Aitor Fernández , César D. Fosco

Electrons in graphene behave like Dirac fermions, permitting phenomena from high energy physics to be studied in a solid state setting. A key question is whether or not these Fermions are critically influenced by Coulomb correlations. We…

Strongly Correlated Electrons · Physics 2015-05-20 James P. Reed , Bruno Uchoa , Young Il Joe , Yu Gan , Diego Casa , Eduardo Fradkin , Peter Abbamonte

The mechanical properties of two-dimensional materials are important for a wide range of applications including composite and van der Waals-materials, flexible electronics and superconductivity. Several aspects are highly debated in the…

Using full-potential density functional theory (DFT) calculations, we found a small asymmetry in the Fermi velocity of electrons and holes in graphene. These Fermi velocity values and their average were found to decrease with increasing…

Mesoscale and Nanoscale Physics · Physics 2013-02-08 Harihar Behera , Gautam Mukhopadhyay

Here, we report on controlling strain in graphene by trapping molecules at the graphene-substrate interface, leveraging molecular dipole moments. Spectroscopic and transport measurements show that strain correlates with the dipole moments…

Mesoscale and Nanoscale Physics · Physics 2025-03-24 Pawan Kumar Srivastava , Vedanki Khandelwal , Ramesh Reddy , Kartick Tarafder , Subhasis Ghosh

We calculate the chemical potential dependence of the renormalized Fermi velocity and static dielectric function for Dirac quasiparticles in graphene nonperturbatively at finite temperature. By reinterpreting the chemical potential as a…

Mesoscale and Nanoscale Physics · Physics 2018-07-04 Christian Fräßdorf , Johannes E. M. Mosig

Graphene plasmons have recently attracted a great deal of attention because of their tunability, long lifetime, and high degree of field confinement in the vertical direction. Nearby metal gates have been shown to modify the graphene…

Mesoscale and Nanoscale Physics · Physics 2018-08-01 Alessandro Principi , Erik van Loon , Marco Polini , Mikhail I. Katsnelson

We develop a novel and powerful method of exactly calculating various transport characteristics of waves in one-dimensional random media with (or without) coherent absorption or amplification. Using the method, we compute the probability…

Disordered Systems and Neural Networks · Physics 2009-10-31 Kihong Kim