And Jesse G McDaniel (Jesse G McDaniel)

ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 17

Top Venues

The journal of physical chemistry. B

The journal of physical chemistry letters

The Journal of chemical physics

International journal of molecular sciences

Georgia Institute of Technology

University of Wisconsin Madison (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Georgia Institute of Technology Aug 01 2017

United States

Assistant Professor :: Chemistry

Education History

University of Wisconsin Madison Aug 01 2009 - Nov 10 2014

United States

PHD :: Chemistry

Washington University in Saint Louis Aug 01 2004 - May 31 2008

United States

BSC :: Chemistry

Publications

John P Stoppelman, And Jesse G McDaniel
N -Heterocyclic Carbene Formation in the Ionic Liquid [EMIM + ][OAc - ]: Elucidating Solvation Effects with Reactive Molecular Dynamics Simulations. The journal of physical chemistry. B (2023)
John P Pederson, And Jesse G McDaniel
DFT-based QM/MM with particle-mesh Ewald for direct, long-range electrostatic embedding. The Journal of chemical physics 156 (17) (2022)
John P Stoppelman, And Jesse G McDaniel
Physics-based, neural network force fields for reactive molecular dynamics: Investigation of carbene formation from [EMIM+][OAc-]. The Journal of chemical physics 155 (10) (2021)
Kyeong-Jun Jeong, And Jesse G McDaniel, Arun Yethiraj
Deep Eutectic Solvents: Molecular Simulations with a First-Principles Polarizable Force Field. The journal of physical chemistry. B 125 (26) (2021)
Archana Verma, John P Stoppelman, And Jesse G McDaniel
Tuning Water Networks via Ionic Liquid/Water Mixtures. International journal of molecular sciences 21 (2) (2020)
John P Stoppelman, And Jesse G McDaniel
Proton Transport in [BMIM+][BF4-]/Water Mixtures Near the Percolation Threshold. The journal of physical chemistry. B 124 (28) (2020)
Kyeong-Jun Jeong, And Jesse G McDaniel, Arun Yethiraj
A Transferable Polarizable Force Field for Urea Crystals and Aqueous Solutions. The journal of physical chemistry. B 124 (34) (2020)
And Jesse G McDaniel, Arun Yethiraj
Understanding the Properties of Ionic Liquids: Electrostatics, Structure Factors, and Their Sum Rules. The journal of physical chemistry. B 123 (16) (2019)
And Jesse G McDaniel, Archana Verma
On the Miscibility and Immiscibility of Ionic Liquids and Water. The journal of physical chemistry. B 123 (25) (2019)
Chang Yun Son, And Jesse G McDaniel, Qiang Cui, Arun Yethiraj
Proper Thermal Equilibration of Simulations with Drude Polarizable Models: Temperature-Grouped Dual-Nosé-Hoover Thermostat. The journal of physical chemistry letters 10 (23) (2019)
And Jesse G McDaniel, Arun Yethiraj
Influence of Electronic Polarization on the Structure of Ionic Liquids. The journal of physical chemistry letters 9 (16) (2018)
And Jesse G McDaniel
Polarization Effects in Binary [BMIM+][BF4-]/1,2-Dichloroethane, Acetone, Acetonitrile, and Water Electrolytes. The journal of physical chemistry. B 122 (15) (2018)
And Jesse G McDaniel, Chang Yun Son, Arun Yethiraj
Ab Initio Force Fields for Organic Anions: Properties of [BMIM][TFSI], [BMIM][FSI], and [BMIM][OTf] Ionic Liquids. The journal of physical chemistry. B 122 (14) (2018)
And Jesse G McDaniel, Arun Yethiraj
Correction to "Influence of Electronic Polarization on the Structure of Ionic Liquids". The journal of physical chemistry letters 9 (23) (2018)
And Jesse G McDaniel, Chang Yun Son
Ion Correlation and Collective Dynamics in BMIM/BF4-Based Organic Electrolytes: From Dilute Solutions to the Ionic Liquid Limit. The journal of physical chemistry. B 122 (28) (2018)
And Jesse G McDaniel, Arun Yethiraj
Grotthuss Transport of Iodide in EMIM/I3 Ionic Crystal. The journal of physical chemistry. B 122 (1) (2017)
And Jesse G McDaniel, Arun Yethiraj
Proton Diffusion through Bilayer Pores. The journal of physical chemistry. B 121 (39) (2017)

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Publication Activity (10 Years)

Top Topics

Top Venues

And Jesse G McDaniel (Jesse G McDaniel)