Prati
Timothy Duignan
Naslov
Citirano
Citirano
Godina
Collins’s Rule, Hofmeister Effects and Ionic Dispersion Interactions
TT Duignan, DF Parsons, BW Ninham
Chemical Physics Letters, 2014
1102014
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
942013
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
892011
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
832013
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
782017
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
762018
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
632017
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
582020
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
572014
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
552017
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
502021
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
502019
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
502015
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
442016
A Continuum Solvent Model of Ion–Ion Interactions in Water
TT Duignan, D Parsons, BW Ninham
Physical Chemistry Chemical Physics, 2014
412014
Rechargeable dual‐carbon batteries: a sustainable battery technology
M Tebyetekerwa, TT Duignan, Z Xu, X Song Zhao
Advanced Energy Materials 12 (44), 2202450, 2022
382022
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
38*2018
Cation effects on haemoglobin aggregation: balance of chemisorption against physisorption of ions
DF Parsons, TT Duignan, A Salis
Interface Focus 7 (4), 20160137, 2017
382017
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
372021
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
362018
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