First-principles Modeling of Excited-state Phenomena in Materials VII: 2D Materials and Surfaces
FOCUS · K20
Presentations
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Ab initio time-dependent optical spectroscopy applied to spin and valley dynamics in monolayer transition metal dichalcogenides
Invited
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Presenters
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Alejandro Molina-Sanchez
Institute of Materials Science, University of Valencia, Institute of Materials Science (ICMUV), University of Valencia, University of Valencia
Authors
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Alejandro Molina-Sanchez
Institute of Materials Science, University of Valencia, Institute of Materials Science (ICMUV), University of Valencia, University of Valencia
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The origin of single photon emission in 2D WSe<sub>2</sub>
ORAL
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Presenters
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Yifeng Chen
Centre for Advanced 2D Materials, National University of Singapore
Authors
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Yu Jie Zheng
Department of Physics, National University of Singapore
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Yifeng Chen
Centre for Advanced 2D Materials, National University of Singapore
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Yu Li Huang
Institute of Materials Research & Engineering (IMRE), A*STAR (Agency for Science, Technology and Research)
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Pranjal Kumar Gogoi
Department of Physics, National University of Singapore
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Ming-Yang Li
Physical Sciences and Engineering, King Abdullah University of Science and Technology, Corporate Research and Chief Technology Office, Taiwan Semiconductor Manufacturing Company (TSMC)
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Lain-Jong Li
Physical Sciences and Engineering, King Abdullah University of Science and Technology, Physical Sciences and Engineering Division, King Abdullah University of Science and Technology
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Paolo E Trevisanutto
Centre for Advanced 2D Materials, National University of Singapore
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Qixing Wang
Department of Physics, National University of Singapore
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Stephen J Pennycook
Department of Materials Science & Engineering, National University of Singapore
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Andrew Thye Shen Wee
Department of Physics, National University of Singapore
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Su Ying Quek
National University of Singapore, Centre for Advanced 2D Materials, National University of Singapore
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Moiré Patterns of Excitons in Twisted Bilayer Transition-Metal Dichalcogenides Heterostructure
ORAL
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Presenters
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Xiaobo Lu
Physics, Washington University, St. Louis
Authors
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Xiaobo Lu
Physics, Washington University, St. Louis
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Shiyuan Gao
Physics, Washington University, St. Louis
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Xiaoqin (Elaine) Li
University of Texas at Austin, University of Texas-Austin, The University of Texas at Austin, Department of Physics and Center for Complex Quantum Systems, Univ of Texas, Austin, Department of Physics, University of Texas at Austin, TX 78712, United States, Univ of Texas, Austin, Department of Physics, The University of Texas at Austin, Department of Physics, The University of Texas at Austin, USA
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Li Yang
Physics, Washington University in St. Louis, Physics, Washington University, St. Louis
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Dimensionality Dependence of Radiative Recombination in Black Phosphorus from First-principles
ORAL
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Presenters
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Feng Wu
University of California, Santa Cruz, Department of Chemistry and Biochemistry, University of California Santa Cruz
Authors
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Feng Wu
University of California, Santa Cruz, Department of Chemistry and Biochemistry, University of California Santa Cruz
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Dario Rocca
University of Lorraine and CNRS, Nancy (France), Université de Lorraine and CNRS, Nancy (France)
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Yuan Ping
University of California, Santa Cruz, Department of Chemistry and Biochemistry, University of California Santa Cruz, Chemistry and Biochemistry, University of California, Santa Cruz
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Electronic screening of quasiparticle excitations by atomically thin substrates
ORAL
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Presenters
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Su Ying Quek
National University of Singapore
Authors
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Keian Noori
National University of Singapore
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Nicholas Cheng
National University of Singapore
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Fengyuan Xuan
National University of Singapore
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Su Ying Quek
National University of Singapore
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Impact of defects on the opto-electronic properties of monolayer GeSe; a many-body perturbation theory perspective
ORAL
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Presenters
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Kirk Lewis
Department of Electrical and Computer Engineering, Boston University
Authors
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Kirk Lewis
Department of Electrical and Computer Engineering, Boston University
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Sahar Sharifzadeh
Boston University, Department of Electrical and Computer Engineering, Boston University
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Molecules at Conducting Surfaces from First-Principles: Dark States and Distance-Dependent Broadening
ORAL
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Presenters
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Alina Umerbekova
Chemistry, Rutgers University-Newark
Authors
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Alina Umerbekova
Chemistry, Rutgers University-Newark
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Michele Pavanello
Chemistry, Rutgers University-Newark
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Multiple Effects of Inhomogeneous Strain Field on Carrier Distribution in Bending 2D Materials
ORAL
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Presenters
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Jiuyu Sun
University of Missouri
Authors
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Jiuyu Sun
University of Missouri
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Jinlong Yang
University of Science & Technology of China, University of Science and Technology of China
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Realizing an excitonic insulator by decoupling exciton binding energy from the minimum band gap
ORAL
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Presenters
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Jiang Zeyu
Physics, Tsinghua University
Authors
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Jiang Zeyu
Physics, Tsinghua University
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Yuanchang Li
Advanced Research Institute of Multidisciplinary Science, Beijing Institute of Technology
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Duan Wenhui
Institute for advanced study, Tsinghua University, Physics, Tsinghua University, Tsinghua University
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Shengbai Zhang
Physics, Rensselaer Polytechnic Institute, Physics, Applied Physics, and Astronomy, Rensselaer Polytechnic Institute, Rensselaer Polytechnic Institute, Department of Physics, Applied Physics, and Astronomy, Rensselaer Polytechnic Institute
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Linear response and nonlocal dielectric function of freestanding and substrate-supported borophene from first-principles
ORAL
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Presenters
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Anubhab Haldar
Department of Electrical and Computer Engineering, Boston University
Authors
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Anubhab Haldar
Department of Electrical and Computer Engineering, Boston University
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Sahar Sharifzadeh
Boston University, Department of Electrical and Computer Engineering, Boston University
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Charge dynamics in proton-irradiated aluminum sheets
ORAL
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Presenters
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Alina Kononov
University of Illinois at Urbana-Champaign
Authors
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Alina Kononov
University of Illinois at Urbana-Champaign
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Aneesh Jonelagadda
University of Illinois at Urbana-Champaign
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Andre Schleife
University of Illinois at Urbana-Champaign, Materials Science and Engineering, University of Illinois at Urbana-Champaign, Department of Materials Science and Engineering, University of Illinois at Urbana-Champaign
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Level Alignment in Large-Scale Hybrid Organic-Inorganic Systems from Hybrid Density Functional Theory
ORAL
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Presenters
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Svenja Janke
Mechanical Engineering and Materials Science, Duke University
Authors
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Svenja Janke
Mechanical Engineering and Materials Science, Duke University
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Mariana Rossi
Fritz-Haber Institute, Theory Department, Fritz Haber Institute of the Max Planck Society, Theory, Fritz Haber Institute of the Max Planck Society
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Sergey V. Levchenko
Skolkovo Institute of Science and Technology
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Matthias Scheffler
Theory Department, Fritz-Haber-Institut der Max-Planck-Gesellschaft, Theory Department, Fritz Haber Institute of the Max Planck Society
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Manoj Kumar Jana
Mechanical Engineering and Materials Science, Duke University
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Chi Liu
Duke University, Mechanical Engineering and Materials Science, Duke University
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David B Mitzi
Duke University, Mechanical Engineering & Materials Science, Duke University, Mechanical Engineering and Materials Science, Duke University
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Volker Blum
Duke University, Mechanical Engineering & Materials Science, Duke University, Mechanical Engineering and Materials Science, Duke University, Department of Mechanical Engineering and Materials Science, Duke University
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Ehrenfest molecular dynamics approach to a light-induced softening of aluminum slab based on time-dependent density functional theory
ORAL
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Presenters
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Hiroki Katow
National Institute of Advanced Industrial Science and Technology
Authors
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Hiroki Katow
National Institute of Advanced Industrial Science and Technology
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Yoshiyuki Miyamoto
National Institute of Advanced Industrial Science and Technology
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