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The Voth Group

The Voth Group

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  • Greg Voth
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    • Theory of Coarse-Graining and Multiscale Phenomena
    • Charge Transport
    • Renewable Energy Materials
    • Simulations of Biomolecular Systems
    • Software: OpenMSCG
    • Software: RAPTOR
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Publications

Author Title [ Type(Asc)] Year
Filters: Author is Calio, PB  [Clear All Filters]
Journal Article
Calio PB, Li C, Voth GA. Understanding the Essential Nature of the Hydrated Excess Proton Through Simulation and Interpretation of Recent Spectroscopic Experiments. J. Am. Chem. Soc. Submitted .
Calio PB, Li C, Voth GA. Molecular Origins of the Barriers to Proton Transport in Acidic Aqueous Solutions. J. Phys. Chem. B. 2020 ;124(40):8868–8876.
  • PubMed
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Calio PB, Hocky GM, Voth GA. A Minimal Experimental Bias on the Hydrogen Bond Greatly Improves Ab Initio Molecular Dynamics Simulations of Water. J. Chem. Theory. Comp. 2020 ;16(9):5675–5684 .
  • PubMed
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Arntsen C, Chen C, Calio PB, Li C, Voth GA. The Hopping Mechanism of the Hydrated Excess Proton and Its Contribution to Proton Diffusion in Water. J. Chem. Phys. Submitted .
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The University of Chicago  |  Searle Chemistry Laboratory

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