Academic Talk: Layered and 2D materials: electronic properties and structural instabilities from first principles

time:2017-03-13Hits:64设置

Presenter: Prof. Dr. Pablo  Ordejon

  

  


   

Director  ICN2 - www.icn2.cat

Catalan  Insitute of Nanoscience and Nanotechnology

CSIC -  Generalitat de Catalunya - UAB

Edificio  ICN2, Campus de la U.A.B.

08193  Bellaterra, Barcelona (Spain)

  

Topic: Layered and 2D materials: electronic  properties and structural instabilities from first  principles

Time: 04:00 p.m., March 16th  (Thursday)

Location: Conference Room B, BLDG 909-1F


Abstract

I will present recent work on the understanding of the electronic properties of layered  materials and their 2D relatives by means of first principles electronic  structure calculations. In particular, I will focus on the correlation between the crystal structure and the electronic properties, with special emphasis on  the structural instabilities with an electronic origin. This will be done in connection to recent experimental studies that have been able to demonstrate the presence of charge density waves (CDW) in several 2D materials like NbSe2 and TiSe2. I will also discuss the correlation between the electronic structure and the  experimental STM images and STS spectra on some of these systems, which provide crucial insight for the understanding of their CDW and superconducting  instabilities.


Biography

Prof. Pablo Ordejón earned his BSc in Physics (1987) and PhD in Science (1992) at the Universidad Autónoma de Madrid (Spain). He worked as a postdoctoral researcher at the University of Illinois at Urbana-Champaign (USA) from 1992 to 1995, and  as Assistant Professor at the Universidad de Oviedo from 1995 to 1999. In 1999,  he obtained a research staff position at the Institut de Ciència de Materials de Barcelona of the Consejo Superior de Investigaciones Científicas (CSIC). In 2007  he moved to CIN2 (now ICN2), where he is currently CSIC Research Professor. Since July 2012, he has served as Director of ICN2, where he also leads the Theory and Simulation Research Group. He is known for being one of the inventors  of the popular SIESTA software for first-principles calculations. He has published more than 190 scientific articles, which have received nearly 20,000 citations (h = 53).

  

Contact: Prof. Mario  Lanza


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