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- Currently displaying 1 - 20 of 58 publications
A unified machine-learning framework for ab initio multiscale modeling of liquids.
Proceedings of the National Academy of Sciences of the United States of America
(2026)
123
e2610049123
(doi: 10.1073/pnas.2610049123)
Roles of Bulk and Surface Thermodynamics in the Selective Adsorption of a Confined Azeotropic Mixture.
J Phys Chem B
(2026)
130
4455
(doi: 10.1021/acs.jpcb.6c00640)
Elucidating interfacial phenomena in complex liquids with theory, molecular simulation and machine learning
(2026)
(doi: 10.17863/CAM.132611)
A unified machine-learning framework for ab initio multiscale modeling of liquids
(2026)
Dielectrocapillarity for exquisite control of fluids
Nature communications
(2026)
17
2661
(doi: 10.1038/s41467-026-69482-1)
The roles of bulk and surface thermodynamics in the selective adsorption of a confined azeotropic mixture
(2026)
A first-principles approach to electromechanics in liquids
J Phys Condens Matter
(2025)
37
285101
(doi: 10.1088/1361-648X/ade7e7)
Learning Classical Density Functionals for Ionic Fluids.
Physical Review Letters
(2025)
134
148001
Momentum tunnelling between nanoscale liquid flows
Nature Nanotechnology
(2025)
(doi: 10.1038/s41565-024-01842-8)
Revisiting the Green-Kubo relation for friction in nanofluidics
(2024)
(doi: 10.48550/arxiv.2409.07134)
Revisiting the Green-Kubo relation for friction in nanofluidics
Journal of Chemical Physics
(2024)
(doi: 10.1063/5.0238363)
A classical density functional theory for solvation across length scales
(2024)
(doi: 10.48550/arxiv.2402.02873)
A classical density functional theory for solvation across length scales.
The Journal of Chemical Physics
(2024)
161
104103
(doi: 10.1063/5.0223750)
Impedance of nanocapacitors from molecular simulations to understand the dynamics of confined electrolytes
Proceedings of the National Academy of Sciences of the United States of America
(2024)
(doi: 10.1073/pnas.2318157121)
Electrified/charged aqueous interfaces: general discussion.
Faraday Discussions
(2024)
249
381
(doi: 10.1039/d3fd90065g)
Soft matter–water interface: general discussion
Faraday discussions
(2024)
249
485
(doi: 10.1039/d3fd90066e)

