van der Waals effects in low dimensional systems
FOCUS · Y36 ·
Presentations
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First-principles studies of early-stage CO<sub>2</sub> capture in diamine-appended metal organic frameworks
ORAL
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Presenters
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Jung-Hoon Lee
- Molecular Foundry, Lawrence Berkeley National Laboratory; Department of Physics, University of California, Berkeley
Authors
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Jung-Hoon Lee
- Molecular Foundry, Lawrence Berkeley National Laboratory; Department of Physics, University of California, Berkeley
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Jeffrey Neaton
- Molecular Foundry, Lawrence Berkeley National Laboratory; Department of Physics, University of California, Berkeley; Kavli Energy Nanosciences Institute at Berkeley
- Physics, University of California, Berkeley; Lawrence Berkeley National Laboratory
- Department of Physics, University of California
- Univ of California - Berkeley
- Lawrence Berkeley Natl Lab
- Materials Science Division, Lawrence Berkeley National Laboratory
- Molecular Foundry, Lawrence Berkeley National Lab
- Physics, University of California, Berkeley
- Department of Physics UCB; Molecular Foundry LBNL; Kavli ENSI
- Lawrence Berkeley National Laboratory
- Department of Physics, Univ of California - Berkeley
- Lawrence Berkeley National Lab and University of California - Berkeley
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THz Spectroscopy of 2,4,6-trinitrotoluene Molecular Solids from First Principles
ORAL
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Presenters
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Ido Azuri
- Weizmann Institute of Science
- Materials and Interfaces, Weizmann Institute of Science
Authors
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Ido Azuri
- Weizmann Institute of Science
- Materials and Interfaces, Weizmann Institute of Science
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Anna Hirsch
- Weizmann Institute of Science
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Anthony M. Reilly
- Dublin City University
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Alexandre Tkatchenko
- Université du Luxembourg
- University of Luxembourg
- Physics and Materials Science Research Unit, University of Luxembourg
- Physics and Materials Science Research Unit,, University of Luxembourg
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Shai Kendler
- Institute for Biological Research
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Oded Hod
- Tel Aviv University
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Leeor Kronik
- Weizmann Institute of Science
- Department of Materials and Interfaces, Weizmann Institute of Science
- Dept. of Materials and Interfaces, Weizmann Institute of Science
- Materials and Interfaces, Weizmann Institute of Science
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Importance of van der Waals correction for energetics in transition metal monoxides
ORAL
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Presenters
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Haowei Peng
- Department of Physics, Temple University
- Temple Univ
- Temple University
Authors
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Haowei Peng
- Department of Physics, Temple University
- Temple Univ
- Temple University
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John Perdew
- Department of Physics, Temple University
- Temple Univ
- Temple University
- Physics, Temple Univ
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van der Waals interactions in low-dimensional nanostructures (2D, 1D, 0D) and layered solids
Invited
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Presenters
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John Dobson
- Queensland Micro and Nano Technology Centre, Griffith University
- Griffith Univ
Authors
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John Dobson
- Queensland Micro and Nano Technology Centre, Griffith University
- Griffith Univ
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Layer dependent electronic and optical properties of Silicane, Germanane and Stanane.
ORAL
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Presenters
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Jose Eduardo Padilha
- Campus Avançado Jandaia do Sul, Universidade Federal do Paraná
Authors
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Jose Eduardo Padilha
- Campus Avançado Jandaia do Sul, Universidade Federal do Paraná
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Rosana Rabelo Mançano
- Campus Avançado Jandaia do Sul, Universidade Federal do Paraná
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Luiz Cótica
- Física, Universidade Estadual de Maringá
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Rafael Da Silva
- Física, Universidade Estadual de Maringá
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Roberto Miwa
- Física, Universidade Federal de Uberlância
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Renato Pontes
- Física, Universidade Federal do Goiás
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Effect of Point Defects on Optical Properties of Graphene Fluoride: A First-Principles Study
ORAL
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Presenters
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Xu Zhang
- Physics and Astronomy, Cal State Univ - Northridge
Authors
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Ling-Yi Huang
- Physics and Astronomy, Cal State Univ - Northridge
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Xu Zhang
- Physics and Astronomy, Cal State Univ - Northridge
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Mingliang Zhang
- Physics and Astronomy, Cal State Univ - Northridge
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Gang Lu
- Physics and Astronomy, Cal State Univ - Northridge
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Modeling Non-Reactive Molecule-Surface Systems on Experimentally Relevant Time and Length Scales: Dynamics and Conductance of Polyfluorene on Au(111)
ORAL
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Presenters
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Zhi Li
- Univ of Rochester
Authors
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Zhi Li
- Univ of Rochester
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Alexandre Tkatchenko
- Université du Luxembourg
- University of Luxembourg
- Physics and Materials Science Research Unit, University of Luxembourg
- Physics and Materials Science Research Unit,, University of Luxembourg
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Ignacio Franco
- Univ of Rochester
- University of Rochester
- Chemistry , University of Rochester
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Ab initio study of p-type origin of SnSe and the alloying behavior of SnSe<sub>1-x</sub>S<sub>x</sub>
ORAL
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Presenters
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Jaekwang Lee
- Physics, Pusan National University
- Department of Physics, Pusan National University
Authors
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Jaekwang Lee
- Physics, Pusan National University
- Department of Physics, Pusan National University
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Quantitative agreement between electron-optical phase images of WSe2 and simulations based on electrostatic potentials that include bonding effects
ORAL
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Presenters
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Matthieu Verstraete
- Physics, University of Liege
- Univ de Liege
- ULiege
Authors
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Matthieu Verstraete
- Physics, University of Liege
- Univ de Liege
- ULiege
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Sven Borghardt
- Forschungszentrum Juelich
- Peter Grünberg Institute 9
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Zeila Zanolli
- Forschungszentrum Juelich
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Florian Winkler
- Forschungszentrum Juelich
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juri barthel
- Forschungszentrum Juelich
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Amir Hossein Tavabi
- Forschungszentrum Juelich
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R. E. Dunin-Borkowski
- Forschungszentrum Juelich
- Peter Grünberg Institut, Forschungszentrum Jülich GmbH
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Beata Kardynal
- Forschungszentrum Juelich
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Ab-initio Study of Polymorphic Phase Transitions of Two Dimensional MoS<sub>2</sub>
ORAL
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Presenters
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Sera Jeon
- Physics, Pusan National University
Authors
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Sera Jeon
- Physics, Pusan National University
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Jaekwang Lee
- Physics, Pusan National University
- Department of Physics, Pusan National University
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Stacking Effects on Graphene and Dichalcogenide Hybrid Structures
ORAL
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Presenters
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Abdulrhman Alsharari
- Department of Physics and Astronomy, Ohio University
Authors
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Abdulrhman Alsharari
- Department of Physics and Astronomy, Ohio University
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Mahmoud Asmar
- Department of Physics and Astronomy, Louisiana State Univiersity
- Louisiana State Univ - Baton Rouge
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Sergio Ulloa
- Department of Physics and Astronomy, Ohio University
- Physics and Astronomy, Ohio Univ
- Physics and Astronomy, Ohio University
- Department of Physics, Ohio University
- Ohio University
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