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MODHET SIGNED

Modelling 2D Transition Metal Dichalcogenide Heterostructures

Total Cost €

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EC-Contrib. €

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Partnership

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 MODHET project word cloud

Explore the words cloud of the MODHET project. It provides you a very rough idea of what is the project "MODHET" about.

expert    possibility    host    indirect    material    be    tmds    plasmonics    physics    types    gw    nanoelectronics    science    although    handle    profound    decade    materials    description    versatile    perturbation    significantly    country    rubio    bound    2d    heterostructures    algorithms    tddft    versus    experimentally    international    band    body    simulations    hosted    layers    guide    salpeter    excitons    synthesizing    spain    decades    kinds    acquired    perform    tmd    progress    existence    transfer    first    energy    direct    charge    theoretical    nature    correlation    impacts    functional    formed    principles    demonstrated    compare    groups    nano    bulk    condensed    angel    charged    bio    exploring    density    excitonic    prof    photoelectronics    experimental    tightly    mostly    self    atomically    standpoint    forms    equation    functionals    unexpected    exchange    accurate    university    size    gap    basque    fellowship    involve    thin    stacking    dependent    experiment    limited    group    theory    codes    dynamical    time   

Project "MODHET" data sheet

The following table provides information about the project.

Coordinator
MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN EV 

Organization address
address: HOFGARTENSTRASSE 8
city: Munich
postcode: 80539
website: www.mpg.de

contact info
title: n.a.
name: n.a.
surname: n.a.
function: n.a.
email: n.a.
telephone: n.a.
fax: n.a.

 Coordinator Country Germany [DE]
 Project website https://www.mpsd.mpg.de/person/52338/166465
 Total cost 171˙460 €
 EC max contribution 171˙460 € (100%)
 Programme 1. H2020-EU.1.3.2. (Nurturing excellence by means of cross-border and cross-sector mobility)
 Code Call H2020-MSCA-IF-2015
 Funding Scheme MSCA-IF-EF-ST
 Starting year 2017
 Duration (year-month-day) from 2017-03-03   to  2019-03-02

 Partnership

Take a look of project's partnership.

# participants  country  role  EC contrib. [€] 
1    MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN EV DE (Munich) coordinator 171˙460.00

Map

 Project objective

Although TMDs have been studied for decades, studies have been mostly limited to bulk materials. The properties of TMDs in atomically thin 2D forms can be significantly different from those in the bulk, such as the size of the band gap, the nature of the band gap (direct versus indirect), the existence of tightly-bound charged excitons. The physics of heterostructures formed by stacking different kinds of TMD layers are even more versatile and unexpected. While recent studies have experimentally demonstrated the possibility of synthesizing such novel 2D materials, the present project aims to study these new types of materials from a theoretical standpoint. We will perform state-of-the-art first-principles simulations using the most advanced exchange-correlation functionals developed in the host group for the accurate description of dynamical and charge transfer process within the time dependent density functional theory (TDDFT) as well as many-body perturbation approaches using the GW self-energy and including excitonic effects at the level of the Bethe Salpeter equation. We will also develop and implement new multi-scale algorithms in the codes needed to handle some of the tasks detailed in the project. This European Fellowship project will be hosted by a leading expert in the field, Prof. Angel Rubio of the University of the Basque Country (Spain). The project will also involve collaboration with top international experiment groups. The theoretical results acquired in this project will be used to guide and compare to experimental results with the goal of developing novel devices for future advances in nanoelectronics, photoelectronics and plasmonics. The progress of this project in exploring and understanding new physics of 2D TMDs and developing novel devices will have profound impacts on condensed matter physics, material science, as well as nano- and bio-science in the next decade.

 Publications

year authors and title journal last update
List of publications.
2018 Georgies Alene Asres, José J. Baldoví, Aron Dombovari, Topias Järvinen, Gabriela Simone Lorite, Melinda Mohl, Andrey Shchukarev, Alejandro Pérez Paz, Lede Xian, Jyri-Pekka Mikkola, Anita Lloyd Spetz, Heli Jantunen, Ángel Rubio, Krisztian Kordás
Ultrasensitive H2S gas sensors based on p-type WS2 hybrid materials
published pages: 4215-4224, ISSN: 1998-0124, DOI: 10.1007/s12274-018-2009-9
Nano Research 11/8 2019-04-18
2018 Alexander Kerelsky, Leo McGilly, Dante M. Kennes, Lede Xian, Matthew Yankowitz, Shaowen Chen, K. Watanabe, T. Taniguchi, James Hone, Cory Dean, Angel Rubio, Abhay N. Pasupathy
Magic Angle Spectroscopy
published pages: , ISSN: , DOI:
2019-04-18
2018 Lede Xian, Dante M. Kennes, Nicolas Tancogne-Dejean, Massimo Altarelli, Angel Rubio
Multi-flat bands and strong correlations in Twisted Bilayer Boron Nitride
published pages: , ISSN: , DOI:
2019-04-18
2018 Junji Yuhara, Yuya Fujii, Kazuki Nishino, Naoki Isobe, Masashi Nakatake, Lede Xian, Angel Rubio, Guy Le Lay
Large area planar stanene epitaxially grown on Ag(1 1 1)
published pages: 25002, ISSN: 2053-1583, DOI: 10.1088/2053-1583/aa9ea0
2D Materials 5/2 2019-04-18
2017 Lede Xian, Alejandro Pérez Paz, Elisabeth Bianco, Pulickel M Ajayan, Angel Rubio
Square selenene and tellurene: novel group VI elemental 2D materials with nontrivial topological properties
published pages: 41003, ISSN: 2053-1583, DOI: 10.1088/2053-1583/aa8418
2D Materials 4/4 2019-04-18

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