Computational Design and Discovery of Novel Materials: Graphene and 2D Materials
FOCUS · R56 · ID: 381723
Presentations
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Predicting Effective Solvents for Graphene Stabilization in Nonaqueous Dispersions
Invited
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Presenters
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Nuala Caffrey
School of Physics, University College Dublin
Authors
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Nuala Caffrey
School of Physics, University College Dublin
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First-principles study of doped graphene with single and double vacancies
ORAL
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Presenters
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Xiangyue Liu
Fritz-Haber Institute
Authors
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Xiangyue Liu
Fritz-Haber Institute
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Weiqi Wang
Fritz-Haber Institute
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Jesús Pérez-Ríos
Molecular Physics, Fritz Haber Institute of the Max Planck Society, Fritz-Haber Institute, Molecular Physics, Fritz Haber Institute
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Two-dimensional magnetic order in Cr-based transition metal chalcogenides
ORAL
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Presenters
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Jan Phillips
University of Santiago de Compostela
Authors
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Jan Phillips
University of Santiago de Compostela
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Victor Pardo
University of Santiago de Compostela, Applied Phisics, Universidade de Santiago de Compostela
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Machine Learning-Enabled Design of Point Defects in 2D Materials
ORAL
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Presenters
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Nathan C Frey
University of Pennsylvania
Authors
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Nathan C Frey
University of Pennsylvania
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Deji Akinwande
University of Texas at Austin, Microelectronics Research Center, The University of Texas
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Deep M Jariwala
University of Pennsylvania
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Vivek b Shenoy
University of Pennsylvania
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Stability, Electronic, Magnetic and Piezoelectric Properties of Two Dimensional Transition Metal Silicates
ORAL
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Presenters
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Kayahan Saritas
Yale University, Department of Applied Physics, Yale University, Applied Physics, Yale University
Authors
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Kayahan Saritas
Yale University, Department of Applied Physics, Yale University, Applied Physics, Yale University
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Nassar Doudin
Yale University
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Eric I. Altman
Yale University
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Sohrab Ismail-Beigi
Department of Mechanical Engineering & Materials Science, Yale University, Yale University
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Piecewise Hamiltonian construction of a metal (NbS<sub>2</sub>)/semiconductor(WSe<sub>2</sub>) two-dimensional (2D) hybrid heterojunction.
ORAL
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Presenters
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Poonam Kumari
CNR-ICCOM, Consiglio Nazionale delle Ricerche, via G. Moruzzi 1, 56124, Pisa, S N Bose National Center for Basic Science
Authors
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Poonam Kumari
CNR-ICCOM, Consiglio Nazionale delle Ricerche, via G. Moruzzi 1, 56124, Pisa, S N Bose National Center for Basic Science
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Luca Sementa
IPCF, Consiglio Nazionale delle Ricerche, via G. Moruzzi 1, 56124, Pisa
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Alessandro Fortunelli
CNR-ICCOM, Consiglio Nazionale delle Ricerche, via G. Moruzzi 1, 56124, Pisa
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Resonant tunneling and the transmission over a non-square barrier in α-T<sub>3</sub> lattice
ORAL
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Presenters
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Nicholas Weekes
Physics and Computer Science, Medgar Evers college, CUNY
Authors
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Nicholas Weekes
Physics and Computer Science, Medgar Evers college, CUNY
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Andrii Iurov
Medgar Evers College, Physics and Computer Science, Medgar Evers college, CUNY, Physics and Astronomy, Medgars Evers college,City University of New York, Department of Physics and Computer Science, Medgar Evers College of City University of New York, Physics and Computer Science, Medgar Evers College
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Liubov Zhemchuzhna
Medgar Evers College, Physics and Computer Science, Medgar Evers college, CUNY, Department of Physics and Astronomy, Hunter College of the City University of New York
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Godfrey Anthony Gumbs
Hunter College, Physics and Astronomy, Hunter College, Physics and Astronomy, Hunter college, CUNY, Physics, Hunter College of CUNY, Physics and Astronomy, Hunter college, City University of New York, Department of Physics and Astronomy, Hunter College of the City University of New York
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Danhong Huang
US Air Force Research Lab (AFRL/RVSU), Air force research lab, Space Vehicles Directorate, US Air Force Research Laboratory, Air Force Research Lab - Kirtland, Center for High Technology Materials, University of New Mexico, US Air Force Research Laboratory
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Designing a unique 2D/1D assembly for an efficient detection of the full IR spectrum
ORAL
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Presenters
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Tuhin Maji
S N Bose National Center for Basic Science, S N Bose National Centre for Basic Sciences, Kolkata
Authors
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Tuhin Maji
S N Bose National Center for Basic Science, S N Bose National Centre for Basic Sciences, Kolkata
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Debjani Karmakar
Bhabha Atomic Research Centre
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Air-Stable Monolayer Cu<sub>2</sub>Se Exhibits a Purely Thermal Structural Phase Transition
ORAL
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Presenters
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Yang Song
Institute of Physics, Chinese Academy of Sciences
Authors
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Yang Song
Institute of Physics, Chinese Academy of Sciences
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Kai Qian
Institute of Physics, Chinese Academy of Sciences
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Lei Gao
Institute of Physics, Chinese Academy of Sciences
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Xiya Chen
Institute of Physics, Chinese Academy of Sciences
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Yu-Yang Zhang
Chinese Academy of Sciences,Institute of Physics, University of Chinese Academy of Sciences, Institute of Physics and University of Chinese Academy of Sciences, Chinese Academy of Sciences, Beijing 100190, China, School of physical sciences, Institute of Physics and University of Chinese Academy of Sciences, Institute of Physics, Chinese Academy of Sciences, Institute of Physics & University of Chinese Academy of Sciences, Chinese Academy of Sciences
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Xiao Lin
Institute of Physics, Chinese Academy of Sciences
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Shixuan Du
Chinese Academy of Sciences,Institute of Physics, Institute of Physics and University of Chinese Academy of Sciences, Chinese Academy of Sciences, Beijing 100190, China, School of physical sciences, Institute of Physics and University of Chinese Academy of Sciences, Institute of Physics, Chinese Academy of Sciences, Chinese Academy of Science, Chinese Academy of Sciences, Institute of Physics, Institute of Physics & University of Chinese Academy of Sciences, Chinese Academy of Sciences
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Min Ouyang
Institute of High Energy Physics, Chinese Academy of Sciences, University of Maryland
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Sokrates T Pantelides
Department of Physics and Engineering, Vanderbilt University, Department of Physics and Astronomy, Vanderbilt Univ, Department of Physics and Astronomy, Vanderbilt University, Vanderbilt Univ, Department of Physics and Astronomy, Vanderbilt University, Nashville, TN 37235, USA, Institute of Physics, Chinese Academy of Sciences, Department of Physics and Astronomy & Department of Electrical Engineering and Computer Science, Vanderbilt University, Department of Physics and Astronomy and Department of Electrical Engineering and Computer Science, Vanderbilt University, Nashville, TN, Department of Electrical Engineering and Computer Science, Vanderbilt University, Department of Physics and Astronomy and Department of Electrical Engineering and Computer Science, Vanderbilt University, Vanderbilt University
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Hongjun Gao
Chinese Academy of Sciences,Institute of Physics, Institute of Physics, Chinese Academy of Sciences, Chinese Academy of Sciences, Institute of Physics
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A machine learning approach to predict the magnetic property of metal-doped graphene
ORAL
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Presenters
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Eric Inclan
Department of Aerospace Engineering, Georgia Institute of Technology
Authors
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Eric Inclan
Department of Aerospace Engineering, Georgia Institute of Technology
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Jack Lasseter
Department of Materials Science and Engineering, University of Tennessee
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Lizhi Zhang
Department of Physics and Astronomy, University of Tennessee
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Mina Yoon
Center for Nanophase Materials Sciences, Oak Ridge National Laboratory, Oak Ridge National Laboratory, USA, Oak Ridge National Lab, CNMS, Oak Ridge National Lab
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Computational design and phase prediction of transition metal dichalcogenides using machine learning techniques
ORAL
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Presenters
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Pratibha Dev
Howard University, Physics, Howard University, Physics and Astronomy, Howard University
Authors
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Pankaj Kumar
Howard University
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Vinit Sharma
University of Tennessee, Knoxville, TN, University of Tennessee
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Pratibha Dev
Howard University, Physics, Howard University, Physics and Astronomy, Howard University
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