Orbitronics with Uniform and Non-Uniform Magnetic Structures
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Workshop on Computational Physics and Materials Science
Workshop on Computational Physics and Materials Science: Total Energy and Force Methods 2020 Donostia-San Sebastián, Spain January 8-10, 2020 Institutional support and funding Preface This workshop is organized within the well-established “Total Energy and Force” conference series, which is held at ICTP in Trieste every odd year, and at a different place in the world every even year. The previous most recent workshops of this series outside Trieste took place in Barcelona (2012), Lausanne (2014), Luxembourg (2016) and Cambridge (2018). The main objective of this event is to identify new developments and topics in the field of electronic-structure methods from the first-principles perspective, their diverse applications, and its mathematical foundations. As such, it provides a great opportunity to assemble a wide range of leading scientists working on different aspects of computational material science. The workshop aims to cover the following topics: • Electron-phonon • Dielectrics • 2D materials • Correlation effects • Superconductivity • Topological materials • Transport properties • Excitations Organizing committee • Aran Garcia-Lekue, DIPC • Ivo Souza, UPV/EHU • Ion Errea, UPV/EHU Scientific advisory board • O. Akin-Ojo, University of Ibadan • E. Artacho, University of Cambridge & Nanogune • W. Andreoni, Ecole Polytechnique Fédérale de Lausanne • S. Biermann, Ecole Polytechnique, Palaiseau • R. Car, Princeton University • C. Filippi, University of Twente • M. Finnis, Imperial College • R. Gebauer, International Centre for Theoretical Physics • X.-G. Gong, Fudan University • J. Ihm, Seoul National University • E. Koch, Forschungszentrum Jülich • G. Kresse, University of Vienna • R. M. Martin, Stanford University • F. Mauri, University “La Sapienza” • A. Mostofi, Imperial College London • S. Narasimhan, JNCASR Bangalore • J. B. -
Graphene and 2DM Online Conference (GO2020): Fundamental Research Insights
Fundamental Research Insights JULY 07, 2020 Aachen Graphene & 2D-Materials Center From basic research to innovation Digital Hardware ■ Electronics for neuromorphic computing ■ Sensor technology for autonomous driving and IoT ■ Optoelectronics for high speed data communication ■ Electronics for wearables and implantables AMO AMO GmbH Otto-Blumenthal-Straße 25 ■ D-52074 Aachen ■ Germany Phone +49 241 88 67-125 ■ Fax +49 241 88 67-571 [email protected] ■ www.amo.de F OREWORD On behalf of the Organising Committee we take great pleasure in welcoming you for the 1st edition of the Graphene and 2DM Online Conference (GO2020): Fundamental Research Insights. Graphene and 2D Materials have a huge potential to impact established industrial sectors, building new emerging industries and niche segments and creating economic value. The one-day Graphene and 2DM Online conference (GO2020) will present the most recent advances in fundamental research in electronics, energy storage, biohealth, composites, coatings or sensors. 11 high profile talks from worldwide most influential academia experts in the Graphene and 2DM sector will present speeches in this international event on how advanced materials will change the future of technology and impact positively our daily life. GO2020 will be a one-day online event that means to gather the key players of the Graphene and 2DM Community and related sectors. This event is launched following the success of previous Grapheneconf editions and considering that all major scientific and technological conferences are being cancelled or postponed worldwide until the end of 2020. We are indebted to the following Company for their help and financial support: AMO GmbH (Germany) We also would like to thank all the speakers and participants that join us this year. -
Flat Band Moirés
European Physical Society Condensed Matter Division Flat Band Moirés Leni Bascones1, Dmitri Efetov2, Johannes Lischner3 1 Instituto de Ciencia de Materiales de Madrid, ICMM-CSIC 2 Institute of Photonic Sciences ICFO 3 Imperial College London Wednesday, September, 2nd 9:30-10:10 Correlated, insulating and superconducting States in twisted bilayer graphene Below the Magic Angle. Jeanie Lau (invited). 10:10-10:30 Flat band superconductivity in twisted bilayer graphene. Tero Heikkilä, T. Peltonen, A. Julku, R. Ojajärvi, L. Long, P. Törmä. 10:30-10:50 Band structure and insulating states driven by the Coulomb interactions in twisted bilayer graphene. Tommaso Cea, F. Guinea. 10:50-11:10 Interactions in magic-angle twisted bilayer graphene. María José Calderón, E. Bascones. 11:10-11:30 Evidence of weakly dispersive bands in twisted bilayer graphene from nano-ARPES. Simone Lisi, X. Lu, T. Benschop, T. A. de Jong, P. Stepanov, J. R. Duran, Fl. Margot, I. Cucchi, E. Cappelli, A. Hunter, A. Tamai, V. Kandyba, A. Giampietri, A. Barinov, Johannes Jobst, Vincent Stalman, M. Leeuwenhoek, K. Watanabe, T. Taniguchi, L. Rademaker, S. J. van der Molen, M. Allan, D. K. Efetov, F. Baumberger. 11:30-11:50 Marginal Fermi liquid in twisted bilayer graphene José González, T. Stauber. 11:50-12:10 Inconmensurability induced sub-ballistic states in twisted bilayer graphene. Miguel de Jesús Mestre Gonçalves, H. Z. Olyaei1, B. Amorim, R. Mondaini, P. Ribeiro, E. V. Castro. 12:10-12:30 Strain induced excitonic instability in twisted bilayer graphene. Héctor Ochoa. Thursday, September 3rd 9:30-10:10 Moiré physics and symmetry breaking in magnetically encapsulated van der Waals structures. -
Call for Papers | 2022 MRS Spring Meeting
Symposium CH01: Frontiers of In Situ Materials Characterization—From New Instrumentation and Method to Imaging Aided Materials Design Advancement in synchrotron X-ray techniques, microscopy and spectroscopy has extended the characterization capability to study the structure, phonon, spin, and electromagnetic field of materials with improved temporal and spatial resolution. This symposium will cover recent advances of in situ imaging techniques and highlight progress in materials design, synthesis, and engineering in catalysts and devices aided by insights gained from the state-of-the-art real-time materials characterization. This program will bring together works with an emphasis on developing and applying new methods in X-ray or electron diffraction, scanning probe microscopy, and other techniques to in situ studies of the dynamics in materials, such as the structural and chemical evolution of energy materials and catalysts, and the electronic structure of semiconductor and functional oxides. Additionally, this symposium will focus on works in designing, synthesizing new materials and optimizing materials properties by utilizing the insights on mechanisms of materials processes at different length or time scales revealed by in situ techniques. Emerging big data analysis approaches and method development presenting opportunities to aid materials design are welcomed. Discussion on experimental strategies, data analysis, and conceptual works showcasing how new in situ tools can probe exotic and critical processes in materials, such as charge and heat transfer, bonding, transport of molecule and ions, are encouraged. The symposium will identify new directions of in situ research, facilitate the application of new techniques to in situ liquid and gas phase microscopy and spectroscopy, and bridge mechanistic study with practical synthesis and engineering for materials with a broad range of applications. -
Simulating Twistronics in Acoustic Metamaterials
Simulating twistronics in acoustic metamaterials S. Minhal Gardezi,1 Harris Pirie,2 Stephen Carr,3 William Dorrell,2 and Jennifer E. Hoffman1, 2, ∗ 1School of Engineering and Applied Sciences, Harvard University, Cambridge, MA, 02138, USA 2Department of Physics, Harvard University, Cambridge, MA, 02138, USA 3Brown Theoretical Physics Center and Department of Physics, Brown University, Providence, RI, 02912-1843, USA (Dated: March 24, 2021) Twisted van der Waals (vdW) heterostructures have recently emerged as a tunable platform for studying correlated electrons. However, these materials require laborious and expensive effort for both theoretical and experimental exploration. Here we numerically simulate twistronic behavior in acoustic metamaterials composed of interconnected air cavities in two stacked steel plates. Our classical analog of twisted bilayer graphene perfectly replicates the band structures of its quantum counterpart, including mode localization at a magic angle of 1:12◦. By tuning the thickness of the interlayer membrane, we reach a regime of strong interlayer tunneling where the acoustic magic angle appears as high as 6:01◦, equivalent to applying 130 GPa to twisted bilayer graphene. In this regime, the localized modes are over five times closer together than at 1:12◦, increasing the strength of any emergent non-linear acoustic couplings. INTRODUCTION cate, acoustic metamaterials have straightforward gov- erning equations, continuously tunable properties, fast 1 Van der Waals (vdW) heterostructures host a di- build times, and inexpensive characterization tools, mak- verse set of useful emergent properties that can be cus- ing them attractive testbeds to rapidly explore their tomized by varying the stacking configuration of sheets quantum counterparts. Sound waves in an acoustic meta- of two-dimensional (2D) materials, such as graphene, material can be reshaped to mimic the collective mo- other xenes, or transition-metal dichalcogenides [1{4]. -
Experimental Investigations of Contact Friction and Transport Properties of Monolayer and Bilayer Graphene
Graduate Theses, Dissertations, and Problem Reports 2021 Experimental Investigations of Contact Friction and Transport Properties of Monolayer and Bilayer Graphene Prakash Gajurel [email protected] Follow this and additional works at: https://researchrepository.wvu.edu/etd Part of the Condensed Matter Physics Commons Recommended Citation Gajurel, Prakash, "Experimental Investigations of Contact Friction and Transport Properties of Monolayer and Bilayer Graphene" (2021). Graduate Theses, Dissertations, and Problem Reports. 7994. https://researchrepository.wvu.edu/etd/7994 This Dissertation is protected by copyright and/or related rights. It has been brought to you by the The Research Repository @ WVU with permission from the rights-holder(s). You are free to use this Dissertation in any way that is permitted by the copyright and related rights legislation that applies to your use. For other uses you must obtain permission from the rights-holder(s) directly, unless additional rights are indicated by a Creative Commons license in the record and/ or on the work itself. This Dissertation has been accepted for inclusion in WVU Graduate Theses, Dissertations, and Problem Reports collection by an authorized administrator of The Research Repository @ WVU. For more information, please contact [email protected]. Graduate Theses, Dissertations, and Problem Reports 2021 EXPERIMENTAL INVESTIGATIONS OF CONTACT FRICTION AND TRANSPORT PROPERTIES OF MONOLAYER AND BILAYER GRAPHENE Prakash Gajurel Follow this and additional works at: https://researchrepository.wvu.edu/etd Part of the Condensed Matter Physics Commons EXPERIMENTAL INVESTIGATIONS OF CONTACT FRICTION AND TRANSPORT PROPERTIES OF MONOLAYER AND BILAYER GRAPHENE Prakash Gajurel Dissertation submitted to the Eberly College of Arts and Sciences at West Virginia University in partial fulfillment of the requirements for the degree of Doctor of Philosophy In Physics Mikel Holcomb, Ph.D., Chair Wathiq Abdul -Razzaq, Ph.D. -
Relativistic Theory of Laser-Induced Magnetization Dynamics
Digital Comprehensive Summaries of Uppsala Dissertations from the Faculty of Science and Technology 1558 Relativistic theory of laser-induced magnetization dynamics RITWIK MONDAL ACTA UNIVERSITATIS UPSALIENSIS ISSN 1651-6214 ISBN 978-91-513-0070-2 UPPSALA urn:nbn:se:uu:diva-315247 2017 Dissertation presented at Uppsala University to be publicly examined in Polhemsalen, Lägerhyddsvägen 1, Uppsala, Friday, 27 October 2017 at 13:15 for the degree of Doctor of Philosophy. The examination will be conducted in English. Faculty examiner: Professor Paul- Antoine Hervieux (Université de Strasbourg). Abstract Mondal, R. 2017. Relativistic theory of laser-induced magnetization dynamics. Digital Comprehensive Summaries of Uppsala Dissertations from the Faculty of Science and Technology 1558. 115 pp. Uppsala: Acta Universitatis Upsaliensis. ISBN 978-91-513-0070-2. Ultrafast dynamical processes in magnetic systems have become the subject of intense research during the last two decades, initiated by the pioneering discovery of femtosecond laser-induced demagnetization in nickel. In this thesis, we develop theory for fast and ultrafast magnetization dynamics. In particular, we build relativistic theory to explain the magnetization dynamics observed at short timescales in pump-probe magneto-optical experiments and compute from first-principles the coherent laser-induced magnetization. In the developed relativistic theory, we start from the fundamental Dirac-Kohn-Sham equation that includes all relativistic effects related to spin and orbital magnetism as well as the magnetic exchange interaction and any external electromagnetic field. As it describes both particle and antiparticle, a separation between them is sought because we focus on low-energy excitations within the particle system. Doing so, we derive the extended Pauli Hamiltonian that captures all relativistic contributions in first order; the most significant one is the full spin- orbit interaction (gauge invariant and Hermitian). -
University of Groningen Proximity-Induced Spin-Orbit and Exchange
University of Groningen Proximity-induced spin-orbit and exchange coupling in graphene-based heterostructures Ghiasi, Talieh DOI: 10.33612/diss.177745582 IMPORTANT NOTE: You are advised to consult the publisher's version (publisher's PDF) if you wish to cite from it. Please check the document version below. Document Version Publisher's PDF, also known as Version of record Publication date: 2021 Link to publication in University of Groningen/UMCG research database Citation for published version (APA): Ghiasi, T. (2021). Proximity-induced spin-orbit and exchange coupling in graphene-based heterostructures. University of Groningen. https://doi.org/10.33612/diss.177745582 Copyright Other than for strictly personal use, it is not permitted to download or to forward/distribute the text or part of it without the consent of the author(s) and/or copyright holder(s), unless the work is under an open content license (like Creative Commons). The publication may also be distributed here under the terms of Article 25fa of the Dutch Copyright Act, indicated by the “Taverne” license. More information can be found on the University of Groningen website: https://www.rug.nl/library/open-access/self-archiving-pure/taverne- amendment. Take-down policy If you believe that this document breaches copyright please contact us providing details, and we will remove access to the work immediately and investigate your claim. Downloaded from the University of Groningen/UMCG research database (Pure): http://www.rug.nl/research/portal. For technical reasons the number of authors shown on this cover page is limited to 10 maximum. Download date: 30-09-2021 Chapter 9 Outlook Abstract Van der Waals heterostructures provide us with an open platform to design new materials with unlimited properties and functionalities. -
Quantum Engineering of Transistors Based on 2D Materials Heterostructures
Quantum engineering of transistors based on 2D materials heterostructures Giuseppe Iannaccone1,*, Francesco Bonaccorso2,*, Luigi Colombo3, Gianluca Fiori1 1 Dipartimento di Ingegneria dell’Informazione, Università di Pisa, 56122 Pisa, Italy; 2Istituto Italiano di tecnologia, Graphene Labs, 16163 Genova, Italy; 3University of Texas at Dallas, Richardson, Texas 75080, USA. Abstract Quantum engineering entails atom by atom design and fabrication of electronic devices. This innovative technology that unifies materials science and device engineering has been fostered by the recent progress in the fabrication of vertical and lateral heterostructures of two-dimensional materials and by the assessment of the technology potential via computational nanotechnology. But how close are we to the possibility of practical realisation of the next generation atomically thin transistors? In this perspective we analyse the outlook and the challenges of quantum- engineered transistors using heterostructures of two-dimensional materials against the benchmark of silicon technology and its foreseeable evolution in terms of potential performance and manufacturability. Transistors based on lateral heterostructures emerge as the most promising option from a performance point of view, even if heterostructure formation and control are in the initial technology development stage. Introduction Recently, the so-called “materials-on-demand paradigm” has been proposed [1] thanks to the possibility of forming a “three-dimensional (3D) material” with tailored characteristics by combining layers of two-dimensional (2D) materials, such as graphene [2], and other single/few- atomic-layer semiconductors, insulators, and metals [3][4]. In many ways, this paradigm is a modern and challenging evolution of what in the 1980s was called “band-gap engineering” [5] or “band-structure engineering” [6], i.e., the artificial modification of band edge profiles using heterostructures made possible by epitaxial growth of III-V, II-VI, and IV-IV [7] material systems. -
Geometry and Topology in Condensed Matter Physics
Geometry and Topology in Condensed Matter Physics Raffaele Resta Istituto Officina dei Materiali, CNR, Trieste, Italy Società Italiana di Fisica, 1050 Congresso Nazionale L’Aquila, September 25th, 2019 . Outline 1 Introduction: the polarization dilemma 2 What does it mean “geometrical”? 3 Bloch orbitals & geometry in k space 4 Two paradigmatic observables: P and M 5 Observables defined modulo 2π 6 Observables exempt from 2π ambiguity 7 Geometry in r space vs. k space . Outline 1 Introduction: the polarization dilemma 2 What does it mean “geometrical”? 3 Bloch orbitals & geometry in k space 4 Two paradigmatic observables: P and M 5 Observables defined modulo 2π 6 Observables exempt from 2π ambiguity 7 Geometry in r space vs. k space . Elementary textbook definition Z d 1 P = = dr r ρ(micro)(r) V V P appears as dominated by surface contributions Phenomenologically P is a bulk property . ?? . ation of solids – p. 24/ . How is polarizationDIELECTRIC retrieved? INSIDE A CAPACITOR silicon polarization density . min max The creative role of computationsto understand the polariz Silicon in a capacitor: induced charge density How is polarization retrieved? DIELECTRIC INSIDE A CAPACITOR silicon polarization density min max min max planar average Silicon (pseudo) charge density, unperturbed planar average. How a series of computationschanged our viewof the polarization of solids – p. 24/61 Silicon (pseudo)charge density, unperturbed . planar average . How a series of computationschanged our viewof the polarization of solids – p. 24/61 Dilemma’s solution Bulk macroscopic polarization P has nothing to do with the charge density in the bulk of the material (contrary to what many texbooks pretend!) Instead, P is a geometric phase (Berry’s phase) of the ground electronic wavefunction Breakthrough due to King-Smith & Vanderbilt, 1993 An early account (in Italian): R. -
TENTATIVE PROGRAM (As of 21/04/2021) Conference Time Zone – Madrid, Spain (GMT+2)
TENTATIVE PROGRAM (as of 21/04/2021) Conference Time Zone – Madrid, Spain (GMT+2) K: Keynote lecture / I: Invited Lecture / O: Oral contribution / FP: FlashPoster contribution Tuesday (20/04/2021) 08:50 – 09:00: Opening - Welcome and Introduction Antonio Correia – President (Phantoms Foundation, Spain) Mario Lanza – (KAUST, Saudi Arabia) 09:00 – 09:30: Paolo Samorì (Université de Strasbourg, France) K Molecular functionalization of 2D materials: high-performance opto-electronic devices 09:30 – 09:40: Cesar Moreno (ICN2, Spain) O Atomically-precise Graphene Nanoarchitectonics 09:40 – 09:50: Andrea Liscio (National Ressearch Council of Italy (CNR), Italy) O Multiscale Charge Transport in van der Waals Thin Films: Reduced Graphene Oxide as a Case Study 09:50 – 10:00: Haldun Sevinçli (Izmir Institute of Technology, Turkey) O Charge Transport in Multilayer Graphene Oxide: Bulk Diffusion versus Device Properties 10:00 – 10:10: Mario Amado (University of Salamanca, Spain) O Valley currents via ballistic edge modes in graphene superlattice near the main Dirac point 10:10 – 10:20: Stephen Power (Trinity College Dublin, Ireland) O Manipulating valley currents in graphene nanostructures 10:20– 10:45: Break Parallel Session I 10:45 – 11:05: Zhenxing Wang (AMO, Germany) I Wafer Scale Integration of Graphene 11:05 – 11:25: Yuanyuan Shi (IMEC, Belgium) I Engineering wafer-scale epitaxial two-dimensional materials for advanced high-performance nanoelectronics 11:25 – 11:45: Sten Vollebregt (TU Delft, The Netherlands) I Wafer-scale graphene: a transfer-free -
Arxiv:2012.08750V3 [Cond-Mat.Mes-Hall] 3 Jan 2021 Evaluated in the Bloch Representation
Adiabatically Induced Orbital Magnetization Cong Xiao, Yafei Ren, and Bangguo Xiong Department of Physics, The University of Texas at Austin, Austin, Texas 78712, USA A semiclassical theory for the orbital magnetization due to adiabatic evolutions of Bloch electronic states is proposed. It renders a unified theory for the periodic-evolution pumped orbital magnetiza- tion and the orbital magnetoelectric response in insulators by revealing that these two phenomena are the only instances where the induced magnetization is gauge invariant. This theory also accounts for the electric-field induced intrinsic orbital magnetization in two-dimensional metals and Chern insulators. We illustrate the orbital magnetization pumped by microscopic local rotations of atoms, which correspond to phonon modes with angular momentum, in toy models based on honeycomb lattice, and the results are comparable to the pumped spin magnetization via strong Rashba spin orbit coupling. We also show the vital role of the orbital magnetoelectricity in validating the Mott relation between the intrinsic nonlinear anomalous Hall and Ettingshausen effects. I. INTRODUCTION current in the second Chern form of Berry curvatures. Noticeably, the orbital magnetoelectric effect and the periodic-evolution pumped orbital magnetization emerge Understanding the orbital magnetization in crystalline as the only instances where the induced magnetization is solids is among the most important objectives of orbi- gauge invariant due to the elimination of its explicit time tronics [1{3]. Unlike its spin companion, the orbital mag- dependence. Our work thus renders a unified theory of netization of Bloch electrons in the absence of external both phenomena in insulators with vanishing Chern num- perturbations is already hard to access quantum mechan- bers.