Focus Session: Solvation, Dynamics, and Reactivity in Complex Environments I

Presentations

• Dynamic response in electric field-induced nanowetting in salt solution

  ORAL

  March 5, 2014, 8:00 AM – March 5, 2014, 8:12 AM

  Authors

  • Dusan Bratko

    • Virginia Commonwealth University

  • Davide Vanzo

    • Virginia Commonwealth University

  • Alenka Luzar

    • Virginia Commonwealth University

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• First-principles investigation of boron incorporation into CRUD under Pressurized Water Reactor conditions

  ORAL

  March 5, 2014, 8:12 AM – March 5, 2014, 8:24 AM

  Authors

  • Zs. Rak

    • Department of Materials Science and Engineering, North Carolina State University

  • C.J. O'Brien

    • Department of Materials Science and Engineering, North Carolina State University

  • Donald Brenner

    • Department of Materials Science and Engineering, North Carolina State University
    • Department of Materials Science and Engineering North Carolina State University, Raleigh, NC

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• Atomistic Models for High-throughput Prediction of Hydration Free Energies

  ORAL

  March 5, 2014, 8:24 AM – March 5, 2014, 8:36 AM

  Authors

  • Jianzhong Wu

    • University of California, Riverside, CA 92521

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• Collisions of Sodium Atoms with Liquid Glycerol: Insights into Na Atom Solvation and Ionization and the Reactions of Near-Interfacial Electrons

  COFFEE_KLATCH · Invited

  March 5, 2014, 8:36 AM – March 5, 2014, 9:12 AM

  Authors

  • Gilbert Nathanson

    • University of Wisconsin-Madison
    • Univ of Wisconsin, Madison

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• Measurement of Ultraslow Rotational Dynamics of Probes in Imidazolium-Based Ionic Liquids Near and Below the Glass Transition Temperature: Studying the Role of Structural Heterogeneity on Dynamic Heterogeneity

  ORAL

  March 5, 2014, 9:12 AM – March 5, 2014, 9:24 AM

  Authors

  • Kayla Mendoza

    • Department of Chemistry and Biochemistry, Texas Tech University, Lubbock, TX 79409

  • Rakhitha Udugama-Arachchilage

    • Department of Chemistry and Biochemistry, Texas Tech University, Lubbock, TX 79409

  • Fehmi Bardak

    • Department of Chemistry \& Biochemistry, Texas Tech University, Lubbock, TX 79409
    • Department of Chemistry and Biochemistry, Texas Tech University, Lubbock, TX 79409

  • George Tamas

    • Texas Tech Univ
    • Department of Chemistry \& Biochemistry, Texas Tech University, Lubbock, TX 79409
    • Department of Chemistry \& Biochemistry, Texas Tech University. Lubbock, TX 79409
    • Department of Chemistry and Biochemistry, Texas Tech University, Lubbock, TX 79409
    • Department of Chemistry Biochemistry, Texas Tech University, Lubbock, TX 79409

  • Edward Quitevis

    • Texas Tech Univ
    • Department of Chemistry \& Biochemistry, Texas Tech University, Lubbock, TX 79409
    • Department of Chemistry \& Biochemistry, Texas Tech University. Lubbock, TX 79409
    • Department of Chemistry and Biochemistry, Texas Tech University, Lubbock, TX 79409
    • Department of Chemistry Biochemistry, Texas Tech University, Lubbock, TX 79409

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• CO2 capture in amine solutions from ab initio molecular dynamics

  ORAL

  March 5, 2014, 9:24 AM – March 5, 2014, 9:36 AM

  Authors

  • Changru Ma

    • Swiss Federal Institute of Technology Lausanne, Switzerland

  • Fabio Pietrucci

    • Swiss Federal Institute of Technology Lausanne, Switzerland

  • Wanda Andreoni

    • Swiss Federal Institute of Technology Lausanne, Switzerland

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• \textit{Ab initio} Molecular Dynamics Study of Carbon Dioxide Adsorption on the Ni Catalyst Surface

  ORAL

  March 5, 2014, 9:36 AM – March 5, 2014, 9:48 AM

  Authors

  • Ji Il Choi

    • Korea Advanced Institute of Science and Technology

  • Yong-Hoon Kim

    • Korea Advanced Institute of Science and Technology
    • Graduate School of EEWS, KAIST

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• Probing Intermolecular Interactions in Polycyclic Aromatic Hydrocarbons with 2D IR Spectroscopy

  COFFEE_KLATCH · Invited

  March 5, 2014, 9:48 AM – March 5, 2014, 10:24 AM

  Authors

  • Amber Krummel

    • Colorado State University

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• Freezing and Melting of Salt Hydrates Next to Solid Surfaces Probed by Infrared-Visible Sum Frequency Generation Spectroscopy

  ORAL

  March 5, 2014, 10:24 AM – March 5, 2014, 10:36 AM

  Authors

  • Emmanuel Anim-Danso

    • The University of Akron

  • Yu Zhang

    • The University of Akron

  • Ali Dhinojwala

    • The University of Akron
    • Department of Polymer Science, The University of Akron
    • Univ of Akron
    • University of Akron

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• Effects of Aqueous Solvation on the Photochemistry of Pyruvic Acid

  ORAL

  March 5, 2014, 10:36 AM – March 5, 2014, 10:48 AM

  Authors

  • Allison Reed-Harris

    • University of Colorado at Boulder

  • Barbara Ervens

    • Cooperative Institute for Research in Environmental Sciences (CIRES) / National Oceanic \& Atmospheric Administration (NOAA)

  • Richard Shoemaker

    • University of Colorado at Boulder

  • Rebecca Rapf

    • University of Colorado at Boulder

  • Jay Kroll

    • University of Colorado at Boulder

  • Elizabeth Griffith

    • University of Colorado at Boulder

  • Anne Monod

    • Aix Marseille Universite

  • Veronica Vaida

    • University of Colorado at Boulder

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• Collisions and Reactions of HNO$_{3}$ and N$_{2}$O$_{5}$ with Sea Spray Mimics

  ORAL

  March 5, 2014, 10:48 AM – March 5, 2014, 11:00 AM

  Authors

  • Michael Shaloski

    • Univ of Wisconsin, Madison

  • Timothy Bertram

    • Univ of California, San Diego

  • Gilbert Nathanson

    • University of Wisconsin-Madison
    • Univ of Wisconsin, Madison

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