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Timothy Duignan
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Collins’s Rule, Hofmeister Effects and Ionic Dispersion Interactions
TT Duignan, DF Parsons, BW Ninham
Chemical Physics Letters, 2014
1062014
A continuum model of solvation energies including electrostatic, dispersion, and cavity contributions
TT Duignan, DF Parsons, BW Ninham
The Journal of Physical Chemistry B 117 (32), 9421-9429, 2013
912013
Approaches to hydration, old and new: Insights through Hofmeister effects
BW Ninham, TT Duignan, DF Parsons
Current opinion in colloid & interface science 16 (6), 612-617, 2011
852011
A continuum solvent model of the multipolar dispersion solvation energy
TT Duignan, DF Parsons, BW Ninham
The Journal of Physical Chemistry B 117 (32), 9412-9420, 2013
822013
Real single ion solvation free energies with quantum mechanical simulation
TT Duignan, MD Baer, GK Schenter, CJ Mundy
Chemical Science 8 (9), 6131-6140, 2017
742017
Cavitation energies can outperform dispersion interactions
S He, F Biedermann, N Vankova, L Zhechkov, T Heine, RE Hoffman, ...
Nature chemistry 10 (12), 1252-1257, 2018
732018
Mass density fluctuations in quantum and classical descriptions of liquid water
M Galib, TT Duignan, Y Misteli, MD Baer, GK Schenter, J Hutter, ...
The Journal of chemical physics 146 (24), 2017
622017
Ion interactions with the air–water interface using a continuum solvent model
TT Duignan, DF Parsons, BW Ninham
The Journal of Physical Chemistry B 118 (29), 8700-8710, 2014
552014
Quantifying the hydration structure of sodium and potassium ions: taking additional steps on Jacob's Ladder
TT Duignan, GK Schenter, JL Fulton, T Huthwelker, M Balasubramanian, ...
Physical Chemistry Chemical Physics 22 (19), 10641-10652, 2020
522020
Electrostatic solvation free energies of charged hard spheres using molecular dynamics with density functional theory interactions
TT Duignan, MD Baer, GK Schenter, CJ Mundy
The Journal of Chemical Physics 147 (16), 2017
522017
Hydronium and hydroxide at the air–water interface with a continuum solvent model
TT Duignan, DF Parsons, BW Ninham
Chemical Physics Letters 635, 1-12, 2015
492015
From surface tension to molecular distribution: modeling surfactant adsorption at the air–water interface
M Peng, TT Duignan, CV Nguyen, AV Nguyen
Langmuir 37 (7), 2237-2255, 2021
462021
Improvement of hard carbon electrode performance by manipulating SEI formation at high charging rates
Y Rangom, RR Gaddam, TT Duignan, XS Zhao
ACS applied materials & interfaces 11 (38), 34796-34804, 2019
442019
Ions interacting in solution: moving from intrinsic to collective properties
TT Duignan, MD Baer, CJ Mundy
Current Opinion in Colloid & Interface Science 23, 58-65, 2016
422016
A Continuum Solvent Model of Ion–Ion Interactions in Water
TT Duignan, D Parsons, BW Ninham
Physical Chemistry Chemical Physics, 2014
402014
Cation effects on haemoglobin aggregation: balance of chemisorption against physisorption of ions
DF Parsons, TT Duignan, A Salis
Interface Focus 7 (4), 20160137, 2017
392017
Detecting the undetectable: The role of trace surfactant in the Jones-Ray effect
TT Duignan, M Peng, AV Nguyen, XS Zhao, MD Baer, CJ Mundy
The Journal of Chemical Physics 149 (19), 2018
36*2018
Toward a first-principles framework for predicting collective properties of electrolytes
TT Duignan, SM Kathmann, GK Schenter, CJ Mundy
Accounts of Chemical Research 54 (13), 2833-2843, 2021
342021
Water lone pair delocalization in classical and quantum descriptions of the hydration of model ions
RC Remsing, TT Duignan, MD Baer, GK Schenter, CJ Mundy, JD Weeks
The Journal of Physical Chemistry B 122 (13), 3519-3527, 2018
342018
Stable α-MoO3 Electrode with a Widened Electrochemical Potential Window for Aqueous Electrochemical Capacitors
AE Elkholy, TT Duignan, X Sun, XS Zhao
ACS Applied Energy Materials 4 (4), 3210-3220, 2021
322021
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Articles 1–20