Modeling and Simulation of 2D Materials and Devices
ORAL · Z60 · ID: 49856
Presentations
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An ab initio investigation of groups III-V monochalcogenides
ORAL
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Presenters
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Mateus Bazan Peters Querne
- University of Delaware
Authors
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Mateus Bazan Peters Querne
- University of Delaware
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Jean M Bracht
- Federal University of Sao Carlos
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Juarez Lopes Ferreira Da Silva
- University of Sao Paulo
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Anderson Janotti
- University of Delaware
- Department of Materials Science & Engineering, University of Delaware
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Matheus Paes Lima
- Federal University of Sao Carlos
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Stability of layered In<sub>2</sub>Se<sub>3</sub> phases from Diffusion Quantum Monte Carlo calculations
ORAL
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Presenters
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Igor D Evangelista
- University of Delaware
Authors
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Igor D Evangelista
- University of Delaware
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Anderson Janotti
- University of Delaware
- Department of Materials Science & Engineering, University of Delaware
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Anouar Benali
- Computational Science Division, Argonne National Laboratory
- Computational Science Division, Argonne National Laboratory, Argonne, IL, United States
- Argonne National Labratory
- Argonne National Laboratory
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Degenerate excitons in strongly spin-orbit coupled heterolayers
ORAL
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Presenters
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Jiawei Ruan
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
Authors
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Jiawei Ruan
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
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Zhenglu Li
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
- Physics Department, UC Berkeley and Lawrence Berkeley National Lab
- Lawrence Berkeley National Laboratory
- Lawrence Berkeley National Laboratory; University of California at Berkeley
- University of California at Berkeley and Lawrence Berkeley National Laboratory
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Chin Shen Ong
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
- University of California, Berkeley
- Department of Physics and Astronomy, Uppsala University
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Steven G Louie
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
- Physics Department, UC Berkeley and Lawrence Berkeley National Lab
- University of California Berkeley
- University of California, Berkeley
- University of California at Berkeley; Lawrence Berkeley National Laboratory
- University of California at Berkeley and Lawrence Berkeley National Laboratory
- UC berkeley
- University of California at Berkeley and Lawrence Berkeley National Lab
- UC Berkeley & Lawrence Berkeley National Laboratory
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Ab initio calculations of exciton-phonon coupling in semiconducting systems
ORAL
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Presenters
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Jacopo Simoni
- Lawrence Berkeley National Laboratory
Authors
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Jacopo Simoni
- Lawrence Berkeley National Laboratory
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Liang Tan
- Lawrence Berkeley National Laboratory
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Vsevolod M Ivanov
- Lawrence Berkeley National Lab
- Lawrence Berkeley National Laboratory
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BiAs as a novel 2D material
ORAL
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Presenters
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Muhammad Zubair
- University of Delaware
Authors
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Muhammad Zubair
- University of Delaware
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Shaoib Khalid
- University of Delaware
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Anderson Janotti
- University of Delaware
- Department of Materials Science & Engineering, University of Delaware
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First-principles calculation of the non-equilibrium quasi-Fermi levels in defective WSe<sub>2</sub> p-n junctions
ORAL
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Presenters
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Tae Hyung Kim
- Korea Advanced Institute of Science and Technology
- Korea Adv Inst of Sci & Tech
Authors
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Tae Hyung Kim
- Korea Advanced Institute of Science and Technology
- Korea Adv Inst of Sci & Tech
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Juho Lee
- Korea Advanced Institute of Science and Technology
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Yong-Hoon Kim
- Korea Advanced Institute of Science and Technology
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Hydrogen Evolution Reaction on BP Monolayer and MoS<sub>2</sub>/BP van der Waals Heterostructure from First-principles
ORAL
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Presenters
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Arunima Singh
- Indian Institute of Technology Delhi
Authors
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Arunima Singh
- Indian Institute of Technology Delhi
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Saswata Bhattachara
- Indian Institute of Technology Delhi
- Indian Institute of Technology Delhi, New Delhi
- Indian Institute of Techknowlogy, Delhi, India
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Extraordinary thermal conductivity of gold sulfide monolayers
ORAL
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Publication: Armin Taheri, Simone Pisana, and Chandra Veer Singh."Extraordinary thermal conductivity of gold sulfide monolayers ", In preparation, 2021.
Presenters
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Armin Taheri
- Postdoctoral fellow at ECE department of York University
- Postdoctoral Fellow, ECE department, York University
Authors
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Armin Taheri
- Postdoctoral fellow at ECE department of York University
- Postdoctoral Fellow, ECE department, York University
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Simone Pisana
- Associate Professor Department of Electrical Engineering & Computer Science Lassonde School of Engineering York University
- York Univ
- Associate Professor, Department of Electrical Engineering & Computer Science Lassonde School of Engineering York University
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Chandra Veer Singh
- Associate Professor, Associate Chair, Department of Materials Science & Engineering
- Associate Professor, Associate Chair, Department of Materials Science & Engineering, University of Toronto
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Intervalley excitonic hybridization, optical selection rules, and imperfect circular dichroism in monolayer hBN
ORAL
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Presenters
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Fang Zhang
- University of Macau, University of California at Berkeley, Lawrence Berkeley National Laboratory , and Southern University of Science and Technology
Authors
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Fang Zhang
- University of Macau, University of California at Berkeley, Lawrence Berkeley National Laboratory , and Southern University of Science and Technology
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Chin Shen Ong
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
- University of California, Berkeley
- Department of Physics and Astronomy, Uppsala University
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Jiawei Ruan
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
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Meng Wu
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
- University of California, Berkeley
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Xingqiang Shi
- Southern University of Science and Technology
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Zikang Tang
- University of Macau
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Steven G Louie
- University of California at Berkeley, and Lawrence Berkeley National Laboratory
- Physics Department, UC Berkeley and Lawrence Berkeley National Lab
- University of California Berkeley
- University of California, Berkeley
- University of California at Berkeley; Lawrence Berkeley National Laboratory
- University of California at Berkeley and Lawrence Berkeley National Laboratory
- UC berkeley
- University of California at Berkeley and Lawrence Berkeley National Lab
- UC Berkeley & Lawrence Berkeley National Laboratory
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Intercalation of Lithium inside Bilayer Buckled Borophene: A First-Principles Prospective
ORAL
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Presenters
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Sheeza Aslam
- University of Gujrat, Hafiz Hayat Campus
Authors
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Sheeza Aslam
- University of Gujrat, Hafiz Hayat Campus
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A new material for Lithium and Sodium ion batteries: monolayer BPt<sub>2</sub>
ORAL
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Presenters
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Yelda Kadioglu
- Adnan Menderes University
- University of Maryland, Baltimore County - Adnan Menderes University
Authors
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Yelda Kadioglu
- Adnan Menderes University
- University of Maryland, Baltimore County - Adnan Menderes University
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Can Ataca
- University of Maryland, Baltimore County
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Quantum capacitance of vertical tunnel field-effect transistors: A first-principles study
ORAL
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Presenters
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Ryong Gyu Lee
- Korea Advanced Institute of Science and Technology
Authors
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Ryong Gyu Lee
- Korea Advanced Institute of Science and Technology
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Juho Lee
- Korea Advanced Institute of Science and Technology
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Tae Hyung Kim
- Korea Advanced Institute of Science and Technology
- Korea Adv Inst of Sci & Tech
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Yong-Hoon Kim
- Korea Advanced Institute of Science and Technology
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Spatial mapping of disordered 2D systems: the conductance Sudoku
ORAL
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Publication: 1) https://arxiv.org/abs/2108.10114
2) New J. Phys. 23 073035
3) Phys. Rev. B 102, 075409Presenters
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Shardul Mukim
- Trinity College Dublin
Authors
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Shardul Mukim
- Trinity College Dublin
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Mauro S Ferreira
- Trinity College Dublin
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Direct and converse flexoelectricity in two-dimensional materials
ORAL
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Publication: M. Springolo, M. Royo and M. Stengel, Physical Review Letters (in press), https://arxiv.org/abs/2010.08470
Presenters
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Matteo Springolo
- ICMAB-CSIC
Authors
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Massimiliano Stengel
- ICREA-Inst Catalana de Recerca i Estudis
- Autonomous University of Barcelona
- ICMAB-CSIC
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Miquel Royo
- ICMAB-CSIC
- Institut de Ciència de Materials de Barcelona (ICMAB-CSIC), Campus UAB, 08193 Bellaterra, Spain
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Matteo Springolo
- ICMAB-CSIC
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