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Currently displaying 21 - 40 of 53 publications

Remembering the Work of Phillip L. Geissler: A Coda to His Scientific Trajectory

GR Bowman, SJ Cox, C Dellago, KH DuBay, JD Eaves, DA Fletcher, LB Frechette, M Grünwald, K Klymko, J Ku, AK Omar, E Rabani, DR Reichman, JR Rogers, AM Rosnik, GM Rotskoff, AR Schneider, N Schwierz, DA Sivak, S Vaikuntanathan, S Whitelam, A Widmer-Cooper

– Annual Review of Physical Chemistry

(2023)

74,

(doi: 10.1146/annurev-physchem-101422-030127)

Classical Quantum Friction at Water-Carbon Interfaces.

AT Bui, FL Thiemann, A Michaelides, SJ Cox

– Nano letters

(2023)

23,

580

(doi: 10.1021/acs.nanolett.2c04187)

Crumbling Crystals: On the Dissolution Mechanism of NaCl in Water

N O'Neill, C Schran, SJ Cox, A Michaelides

(2022)

(link to publication)

Classical quantum friction at water-carbon interfaces

AT Bui, FL Thiemann, A Michaelides, SJ Cox

(2022)

(doi: 10.48550/arxiv.2210.14040)

(link to publication)

A theory for the stabilization of polar crystal surfaces by a liquid environment.

SJ Cox

– Journal of Chemical Physics

(2022)

157,

094701

(doi: 10.1063/5.0097531)

Trade-Off between Redox Potential and the Strength of Electrochemical CO2 Capture in Quinones.

AT Bui, NA Hartley, AJW Thom, AC Forse

– Journal of Physical Chemistry C

(2022)

126,

14163

(doi: 10.1021/acs.jpcc.2c03752)

Dielectric response of thin water films: a thermodynamic perspective.

SJ Cox, PL Geissler

– Chemical Science

(2022)

13,

9102

(doi: 10.1039/d2sc01243j)

Understanding crystal nucleation mechanisms: Where do we stand? General discussion

MW Anderson, M Bennett, R Cedeno, H Cölfen, SJ Cox, AJ Cruz-Cabeza, JJ De Yoreo, R Drummond-Brydson, MK Dudek, KA Fichthorn, AR Finney, I Ford, JM Galloway, D Gebauer, R Grossier, JH Harding, A Hare, D Horváth, L Hunter, J Kim, Y Kimura, CEA Kirschhock, AA Kiselev, W Kras, C Kuttner, AY Lee, Z Liao, L Maini, SO Nilsson Lill, N Pellens, SL Price, IB Rietveld, JD Rimer, KJ Roberts, J Rogal, M Salvalaglio, I Sandei, G Schuszter, J Sefcik, W Sun, JH Ter Horst, M Ukrainczyk, AES Van Driessche, S Veesler, PG Vekilov, V Verma, T Whale, HP Wheatcroft, J Zeglinski

– Faraday Discuss

(2022)

235,

219

(doi: 10.1039/d2fd90021a)

Can molecular simulations reliably compare homogeneous and heterogeneous ice nucleation?

D Atherton, A Michaelides, SJ Cox

– J Chem Phys

(2022)

156,

164501

(doi: 10.1063/5.0085750)

How do interfaces alter the dynamics of supercooled water?

P Gasparotto, M Fitzner, SJ Cox, GC Sosso, A Michaelides

– Nanoscale

(2022)

14,

4254

(doi: 10.1039/d2nr00387b)

Quadrupole-mediated dielectric response and the charge-asymmetric solvation of ions in water.

SJ Cox, KK Mandadapu, PL Geissler

– The Journal of Chemical Physics

(2021)

154,

244502

(doi: 10.1063/5.0051399)

Microscopic Kinetics Pathway of Salt Crystallization in Graphene Nanocapillaries

L Wang, J Chen, SJ Cox, L Liu, GC Sosso, N Li, P Gao, A Michaelides, E Wang, X Bai

– Physical Review Letters

(2021)

126,

136001

(doi: 10.1103/physrevlett.126.136001)

Macroscopic surface charges from microscopic simulations

T Sayer, SJ Cox

– Journal of Chemical Physics

(2020)

153,

164709

(doi: 10.1063/5.0022596)

Assessing long-range contributions to the charge asymmetry of ion adsorption at the air–water interface

SJ Cox, DG Thorpe, PR Shaffer, PL Geissler

– Chem Sci

(2020)

11,

11791

(doi: 10.1039/d0sc01947j)

Computing Surface Acidity Constants of Proton Hopping Groups from Density Functional Theory-Based Molecular Dynamics: Application to the SnO₂(110)/H₂O Interface

M Jia, C Zhang, SJ Cox, M Sprik, J Cheng

– Journal of Chemical Theory and Computation

(2020)

16,

6520

(doi: 10.1021/acs.jctc.0c00021)

Dielectric response with short-ranged electrostatics.

SJ Cox

– Proc Natl Acad Sci U S A

(2020)

117,

19746