Computational Materials Design - Novel 2D Materials
ORAL · X12
Presentations
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Data-driven discovery of functional 2D materials utilizing a computational database for electronic structures
ORAL
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Presenters
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Jinbo Pan
Temple Univ, Physics, Temple Univ
Authors
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Jinbo Pan
Temple Univ, Physics, Temple Univ
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Haowei Peng
Department of Physics, Temple University, Temple Univ, Temple University
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Hua Wang
Department of Materials Science and Engineering, Texas A&M University, Materials Science and Engineering
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Jie Yu
Temple Univ, Temple University
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Huta Banjade
Temple Univ, Physics, Temple Univ
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Xiaofeng Qian
Department of Materials Science and Engineering, Texas A&M University, Materials Science and Engineering, Texas A&M Univ
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John Perdew
Department of Physics, Temple University, Temple Univ, Temple University, Physics, Temple Univ
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Qimin Yan
Temple Univ, Physics, Temple University, Physics, Temple Univ
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Honeycomb Boron Allotropes with Dirac Cones: A True Analogue to Graphene
ORAL
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Presenters
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Wencai Yi
California State University, Northridge, Cal State Univ - Northridge
Authors
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Wencai Yi
California State University, Northridge, Cal State Univ - Northridge
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Wei Liu
Cal State Univ - Northridge
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Jorge Botana
Cal State Univ - Northridge
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Zhen Liu
Cal State Univ - Northridge
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Jingyao Liu
Institute of Theoretical Chemistry, Jilin University,, Institute of Theoretical Chemistry, Jilin University
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Maosheng Miao
Chemistry and Biochemistry, California State University Northridge, California State University, Northridge, Cal State Univ - Northridge, Chemistry and Biochemistry, California State University, Northridge, Department of Chemistry and Biochemistry, California State University, Northridge
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Nitrophosphorene: A 2D Semiconductor with Both Large Direct Gap and Superior Mobility
ORAL
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Presenters
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Lei Zhao
California State University, Northridge
Authors
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Lei Zhao
California State University, Northridge
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Wencai Yi
California State University, Northridge, Cal State Univ - Northridge
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Jorge Botana
Beijing Computational Science Research Center, California State University, Northridge, Simulation of Physical Systems Division, Beijing Computational Science Research Center
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Feng Long Gu
South China Normal University
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Maosheng Miao
Chemistry and Biochemistry, California State University Northridge, California State University, Northridge, Cal State Univ - Northridge, Chemistry and Biochemistry, California State University, Northridge, Department of Chemistry and Biochemistry, California State University, Northridge
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2D Materials: A Wonderland of Nonlinear Optical Responses
ORAL
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Presenters
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Xiaofeng Qian
Department of Materials Science and Engineering, Texas A&M University, Materials Science and Engineering, Texas A&M Univ
Authors
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Hua Wang
Department of Materials Science and Engineering, Texas A&M University, Materials Science and Engineering
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Xiaofeng Qian
Department of Materials Science and Engineering, Texas A&M University, Materials Science and Engineering, Texas A&M Univ
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A new class of crystal structure for two-dimensional materials
ORAL
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Presenters
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Kisung Chae
Korea Inst for Advanced Study, Korea Institute for Advanced Study
Authors
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Kisung Chae
Korea Inst for Advanced Study, Korea Institute for Advanced Study
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Young-Woo Son
Korea Institute for Advanced Study, Korea Inst for Advanced Study
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Goniopolarity of Thermal Transport Behavior in Layered 2D Materials
ORAL
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Presenters
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Yaxian Wang
Materials Science and Engineering, The Ohio State University, Department of Materials Science and Engineering, The Ohio State University, Materials Science and Engineering , Ohio State Univ - Columbus
Authors
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Yaxian Wang
Materials Science and Engineering, The Ohio State University, Department of Materials Science and Engineering, The Ohio State University, Materials Science and Engineering , Ohio State Univ - Columbus
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Bin He
Department of Mechanical Engineering, The Ohio State University, Mechanical and Aerospace Engineering, Ohio State Univ - Columbus
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Maxx Arguilla
Chemistry, Massachusetts Institute of Technology, Department of Chemistry and Biochemistry, The Ohio State University
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Nicholas Cultrara
Chemistry & Biochemistry, The Ohio State University, Department of Chemistry and Biochemistry, The Ohio State University
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Joshua Goldberger
Chemistry & Biochemistry, The Ohio State University, Department of Chemistry and Biochemistry, The Ohio State University
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Joseph Heremans
Materials Science Division, Argonne National Laboratory, Department of Mechanical Engineering, The Ohio State University
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Wolfgang Windl
Materials Science and Engineering, The Ohio State University, Department of Materials Science and Engineering, The Ohio State University, Physics, Ohio State Univ - Columbus
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Designing New Two-Dimensional Janus Nanomaterials by Anionic Exchange
ORAL
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Presenters
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Woosun Jang
Materials Science and Engineering, Yonsei Univ, Materials Science and Engineering, Yonsei University
Authors
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Woosun Jang
Materials Science and Engineering, Yonsei Univ, Materials Science and Engineering, Yonsei University
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Aloysius Soon
Materials Science and Engineering, Yonsei Univ, Materials Science and Engineering, Yonsei University, Materials Science & Engineering, Yonsei University
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Effects of structural degeneracies on properties of two-dimensional materials
ORAL
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Presenters
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Salvador Barraza-Lopez
Physics, University of Arkansas, PHYSICS, Univ of Arkansas-Fayetteville, Physics, Univ of Arkansas-Fayetteville
Authors
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Salvador Barraza-Lopez
Physics, University of Arkansas, PHYSICS, Univ of Arkansas-Fayetteville, Physics, Univ of Arkansas-Fayetteville
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A materials informatics approach to the study of van der Waals materials
ORAL
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Presenters
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Trevor David Rhone
Department of Physics, Harvard University
Authors
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Trevor David Rhone
Department of Physics, Harvard University
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Shaan Desai
Department of Physics, Harvard University
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Philip Kim
Department of Physics, Harvard University, Physics, Harvard University
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Amir Yacoby
Harvard University, Department of Physics, Harvard University, Physics, Harvard University, Physics, Harvard Univ, Harvard Univ, School of Applied Sciences and Engineering, Harvard University
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Efthimios Kaxiras
Department of Physics, Harvard University, Harvard Univ, Harvard University, Physics, Harvard University, School of Engineering and Applied Science, Harvard University
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Electronic properties of a new family of Group 14-15 2D layered materials from first principles
ORAL
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Presenters
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Muhammad Sufyan Ramzan
Physics and Earth Science, Jacobs University
Authors
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Muhammad Sufyan Ramzan
Physics and Earth Science, Jacobs University
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Agnieszka Kuc
Wilhelm-Ostwald-Institut für Physikalische und Theoretische Chemie, Universität Leipzig
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Thomas Heine
Wilhelm-Ostwald-Institut für Physikalische und Theoretische Chemie, Universität Leipzig
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Integration of high-throughput, provenance and dissemination: the case of novel 2D materials
ORAL
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Presenters
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Giovanni Pizzi
Theory and Simulation of Materials, EPFL
Authors
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Giovanni Pizzi
Theory and Simulation of Materials, EPFL
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Nicolas Mounet
Theory and Simulation of Materials, EPFL
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Nicola Marzari
STI IMX THEOS , École Polytechnique Fédérale de Lausanne, Theory and Simulation of Materials, EPFL
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New two-dimensional anisotropic monolayers of phosphide binary compounds with wide fundamental bandgaps
ORAL
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Presenters
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Congyan Zhang
Univ of Louisville
Authors
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Congyan Zhang
Univ of Louisville
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Ming Yu
Univ of Louisville, Physics and Astronomy, Uniersity of Louisville, Physics and Astronomy, University of Louisville
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