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Physical Review. E|September 15, 2016
Smoothed dissipative particle dynamics model for mesoscopic multiphase flows in the presence of thermal fluctuationsHuan Lei, Nathan A Baker, Lei Wu, et al.
The Journal of Physical Chemistry Letters|August 18, 2015
The Role of Broken Symmetry in Solvation of a Spherical Cavity in Classical and Quantum Water ModelsRichard C Remsing, Marcel D Baer, Gregory K Schenter, et al.
The Journal of Physical Chemistry. B|June 3, 2020
Resolving Heterogeneous Dynamics of Excess Protons in Aqueous Solution with Rate TheorySantanu Roy, Gregory K Schenter, Joseph A Napoli, et al.
The Journal of Chemical Physics|May 27, 2010
Structure and dynamics of the hydration shells of the Zn(2+) ion from ab initio molecular dynamics and combined ab initio and classical molecular dynamics simulationsEmilie Cauët, Stuart Bogatko, John H Weare, et al.
The Journal of Physical Chemistry. B|April 23, 2008
Pyroelectricity of water iceHanfu Wang, Richard C Bell, Martin J Iedema, et al.
The Journal of Chemical Physics|June 21, 2006
The OH radical-H2O molecular interaction potentialShiyu Du, Joseph S Francisco, Gregory K Schenter, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 30, 2026
Charge Density Mismatch is a Key Characteristic of Highly Concentrated Electrolyte Solutions and Highly Water-Soluble SaltsJacob G Reynolds, Hsiu-Wen Wang, Trent R Graham, et al.
The Journal of Physical Chemistry Letters|August 22, 2015
Near-Quantitative Agreement of Model-Free DFT-MD Predictions with XAFS Observations of the Hydration Structure of Highly Charged Transition-Metal IonsJohn L Fulton, Eric J Bylaska, Stuart Bogatko, et al.
Science (New York, N.Y.)|February 16, 2008
Electron-driven acid-base chemistry: proton transfer from hydrogen chloride to ammoniaSoren N Eustis, Dunja Radisic, Kit H Bowen, et al.
The Journal of Physical Chemistry. B|September 21, 2010
Probing the hydration structure of polarizable halides: a multiedge XAFS and molecular dynamics study of the iodide anionJohn L Fulton, Gregory K Schenter, Marcel D Baer, et al.
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