Structure and Spectroscopy

Presentations

• Quantum Mechanical Study of Lithium Fluoride Clusters

  ORAL

  March 9, 2018, 11:15 AM – March 9, 2018, 11:27 AM

  Presenters

  • Ajit Hira

    • Dept of Math and Physical Sciences, Northern New Mexico College
    • Northern New Mexico College

  Authors

  • Ajit Hira

    • Dept of Math and Physical Sciences, Northern New Mexico College
    • Northern New Mexico College

  • Amanda Trujillo

    • Dept of Math and Physical Sciences, Northern New Mexico College
    • Northern New Mexico College

  • Sadia Ahmad

    • Dept of Math and Physical Sciences, Northern New Mexico College

  • Chloe Robinson

    • Dept of Math and Physical Sciences, Northern New Mexico College

  • Naomi Lehman

    • Dept of Math and Physical Sciences, Northern New Mexico College

  View abstract →

• Magic-number effect on the interfacial transport of hydrated ion clusters

  ORAL

  March 9, 2018, 11:27 AM – March 9, 2018, 11:39 AM

  Presenters

  • Duanyun Cao

    • Peking Univ
    • School of Physics, Peking University

  Authors

  • Duanyun Cao

    • Peking Univ
    • School of Physics, Peking University

  • Jinbo Peng

    • Peking Univ
    • School of Physics, Peking University

  • Zhili He

    • Peking Univ

  • Yiqin Gao

    • Peking Univ

  • Limei Xu

    • Peking Univ
    • Physics, International Center for Quantum Materials, Peking Univ

  • Ying Jiang

    • Peking Univ
    • Collaborative Innovation Center of Quantum Matters
    • School of Physics, Peking University
    • Department of Physics, Peking Univ

  • Enge Wang

    • Peking Univ
    • Collaborative Innovation Center of Quantum Matters

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• Convection-reaction-diffusion study for non-linear reaction systems using Stochastic Rotation Dynamics

  ORAL

  March 9, 2018, 11:39 AM – March 9, 2018, 11:51 AM

  Presenters

  • Aditya Sengar

    • Chemical Engineering and Chemistry, Eindhoven University of Technology

  Authors

  • Aditya Sengar

    • Chemical Engineering and Chemistry, Eindhoven University of Technology

  • Hans Kuipers

    • Chemical Engineering and Chemistry, Eindhoven University of Technology

  • Rutger Santen

    • Institute for Complex Molecular Systems, Eindhoven University of Technology
    • Eindhoven University of Technology

  • Johan Padding

    • Process and Energy Department, Delft University of Technology
    • Delft Univ of Tech
    • TU Delft

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• Angular distributions in negative-ion photodetachment via photoelectron imaging spectroscopy

  ORAL

  March 9, 2018, 11:51 AM – March 9, 2018, 12:03 PM

  Presenters

  • Andrei Sanov

    • Department of Chemistry and Biochemistry, University of Arizona

  Authors

  • Andrei Sanov

    • Department of Chemistry and Biochemistry, University of Arizona

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• Ice-Ih revisited: no proton tunneling observed in a quasielastic neutron scattering experiment

  ORAL

  March 9, 2018, 12:03 PM – March 9, 2018, 12:15 PM

  Presenters

  • Alexander Kolesnikov

    • Neutron Scattering Division, Oak Ridge National Laboratory
    • Oak Ridge National Lab
    • Oak Ridge National Laboratory

  Authors

  • Alexander Kolesnikov

    • Neutron Scattering Division, Oak Ridge National Laboratory
    • Oak Ridge National Lab
    • Oak Ridge National Laboratory

  • G. Ehlers

    • Neutron Technologies Division, Oak Ridge National Laboratory
    • ORNL-Spallation Neutron Source
    • Oak Ridge National Lab
    • QCMD, Oak Ridge National Laboratory

  • Eugene Mamontov

    • Neutron Scattering Division, Oak Ridge National Laboratory
    • Oak Ridge National Lab
    • ORNL-Spallation Neutron Source

  • Andrei Podlesnyak

    • Neutron Scattering Division, Oak Ridge National Laboratory
    • Oak Ridge National Lab
    • Oak Ridge National Laboratory

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• Defects Cause Sub-gap Luminescence in a Crystalline Tetracene Derivative

  ORAL

  March 9, 2018, 12:15 PM – March 9, 2018, 12:27 PM

  Presenters

  • Aaron Rury

    • Wayne State University

  Authors

  • R. Eric McAnally

    • Univ of Southern California

  • Jon Bender

    • University of Texas

  • Laura Estergreen

    • Univ of Southern California

  • Ralf Haiges

    • Univ of Southern California
    • Loker Hydrocarbon Research Institue and Department of Chemistry, University of Southern California

  • Stephen Bradforth

    • Univ of Southern California

  • Jahan Dawlaty

    • Univ of Southern California
    • Chemistry, University of Southern California
    • University of Southern California

  • Sean Roberts

    • University of Texas

  • Aaron Rury

    • Wayne State University

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• Neutron Powder Diffraction and Infrared Spectroscopy Study of the Ammonium Sulfate at Low Temperature

  ORAL

  March 9, 2018, 12:27 PM – March 9, 2018, 12:39 PM

  Presenters

  • Amal Al-Wahish

    • University of Missouri Research Reactor, University of Missouri-Columbia

  Authors

  • Amal Al-Wahish

    • University of Missouri Research Reactor, University of Missouri-Columbia

  • Krishna Kharel

    • Department of Chemistry and Biochemistry, Lamar University

  • Ozge Gunaydin-Sen

    • Department of Chemistry and Biochemistry, Lamar University

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• Probing Molecular Crystals by Combined Inelastic Neutrons Scattering (INS) Experiments and First-principle Techniques

  ORAL

  March 9, 2018, 12:39 PM – March 9, 2018, 12:51 PM

  Presenters

  • Anup Pandey

    • Oak Ridge National Laboratory

  Authors

  • Anup Pandey

    • Oak Ridge National Laboratory

  • Ada Sedova

    • Oak Ridge National Laboratory

  • Yongqiang Cheng

    • Oak Ridge National Laboratory
    • Oak Ridge National Lab

  • Daemen Luke

    • Oak Ridge National Laboratory

  • Anibal Ramirez-Cuesta

    • Oak Ridge National Laboratory
    • Oak Ridge National Lab

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• Calculations of vibrational spectra with rectangular collocation: suitability for catalytic systems, tests of PES representations and selection of important regions of space

  ORAL

  March 9, 2018, 12:51 PM – March 9, 2018, 1:03 PM

  Presenters

  • Sergei Manzhos

    • Mechanical Engineering, Natl Univ of Singapore

  Authors

  • Sergei Manzhos

    • Mechanical Engineering, Natl Univ of Singapore

  • Tucker Carrington

    • Chemistry, Queen's University

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• Photophysical properties of the Triplet and the "bound" Triplet-Triplet state in Pentacene Dimers

  ORAL

  March 9, 2018, 1:03 PM – March 9, 2018, 1:15 PM

  Presenters

  • Souratosh Khan

    • Univ of Arizona

  Authors

  • Souratosh Khan

    • Univ of Arizona

  • Sumitendra Mazumdar

    • Physics, Univ of Arizona
    • Univ of Arizona

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• Theory of Transient Excited State Absorptions in Pentacene and Derivatives: The Triplet-Triplet Biexciton Versus Free Triplets^a

  ORAL

  March 9, 2018, 1:15 PM – March 9, 2018, 1:27 PM

  Presenters

  • Sumitendra Mazumdar

    • Physics, Univ of Arizona
    • Univ of Arizona

  Authors

  • Sumitendra Mazumdar

    • Physics, Univ of Arizona
    • Univ of Arizona

  • Souratosh Khan

    • Physics, Univ of Arizona

  View abstract →

• Abstract Withdrawn

  ORAL · Withdrawn

  March 9, 2018, 1:27 PM – March 9, 2018, 1:39 PM

  View abstract →

• Fabrication of an Artificial Aromatic Molecule Constructed from Silicon Dangling Bonds and Measurement of its Molecular Orbitals Using Scanning Tunneling Microscopy and Spectroscopy

  ORAL

  March 9, 2018, 1:39 PM – March 9, 2018, 1:51 PM

  Presenters

  • Jonathan Wyrick

    • National Institute of Standards and Technology
    • NIST -Natl Inst of Stds & Tech

  Authors

  • Jonathan Wyrick

    • National Institute of Standards and Technology
    • NIST -Natl Inst of Stds & Tech

  • Xiqiao Wang

    • NIST -Natl Inst of Stds & Tech
    • University of Maryland

  • Pradeep Namboodiri

    • National Institute of Standards and Technology
    • NIST -Natl Inst of Stds & Tech

  • Scott Schmucker

    • National Institute of Standards and Technology
    • NIST -Natl Inst of Stds & Tech
    • NIST

  • Richard Silver

    • National Institute of Standards and Technology
    • NIST
    • NIST -Natl Inst of Stds & Tech

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• 2D THz-THz-Raman Simulations in Liquid Bromoform

  ORAL

  March 9, 2018, 1:51 PM – March 9, 2018, 2:03 PM

  Presenters

  • Ioan-Bogdan Magdau

    • Caltech

  Authors

  • Ioan-Bogdan Magdau

    • Caltech

  • Griffin Mead

    • Caltech

  • Ralph Welsch

    • CFEL-DESY

  • Ian Finneran

    • University of Colorado Boulder

  • Geoffrey Blake

    • Caltech

  • Thomas Miller

    • Caltech
    • Division of Chemistry and Chemical Engineering, California Institute of Technology
    • Chemistry and Chemical Engineering, Caltech
    • California Institute of Technology
    • Division of Chemistry and Chemical Engineering, Caltech
    • Chemistry & Chemical Engineering, Caltech

  View abstract →