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Journal Articles

Entropy-based methods for formulating bottom-up ultra-coarse-grained models

Editor’s Pick
Patrick G. Sahrmann, Gregory A. Voth
Journal: The Journal of Chemical Physics
J. Chem. Phys. 162, 044102 (2025)
https://doi.org/10.1063/5.0244427
Published: January 2025
View article titled, Entropy-based methods for formulating bottom-up ultra-coarse-grained models
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Journal Articles

Molecular anatomy of the pressure anisotropy in the interface of one and two component fluids: Local thermodynamic description of the interfacial tension

Takeshi Omori, Yasutaka Yamaguchi
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 204704 (2024)
https://doi.org/10.1063/5.0235858
Published: November 2024
View article titled, Molecular anatomy of the pressure anisotropy in the interface of one and two component fluids: Local thermodynamic description of the interfacial tension
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Journal Articles

Predictions of the interfacial free energy along the coexistence line from single-state calculations

Ignacio Sanchez-Burgos, Pablo Montero de Hijes, Eduardo Sanz, Carlos Vega, Jorge R. Espinosa
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 204701 (2024)
https://doi.org/10.1063/5.0233420
Published: November 2024
View article titled, Predictions of the interfacial free energy along the coexistence line from single-state calculations
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Journal Articles

A classical density functional theory for solvation across length scales

Anna T. Bui, Stephen J. Cox
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 104103 (2024)
https://doi.org/10.1063/5.0223750
Published: September 2024
View article titled, A classical density functional theory for solvation across length scales
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Journal Articles

Deposition patterns formed by the evaporation of linear diblock copolymer solution nanodroplets on solid surfaces

Han-Wen Pei, Jun Zhang, Zhao-Yan Sun
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 014711 (2024)
https://doi.org/10.1063/5.0216966
Published: July 2024
View article titled, Deposition patterns formed by the evaporation of linear diblock copolymer solution nanodroplets on solid surfaces
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Journal Articles

Structure of liquid–vapor interfaces: Perspectives from liquid state theory, large-scale simulations, and potential grazing-incidence x-ray diffraction

F. Höfling, S. Dietrich
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 104107 (2024)
https://doi.org/10.1063/5.0186955
Published: March 2024
View article titled, Structure of liquid–vapor interfaces: Perspectives from liquid state theory, large-scale simulations, and potential grazing-incidence x-ray diffraction
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Includes: Supplementary data
Journal Articles

Response to “Comment on ‘Sum-frequency vibrational spectroscopy of centrosymmetric molecule at interfaces’” [J. Chem. Phys. 160, 107101 (2024)]

Ren-Hui Zheng, Wen-Mei Wei, Shuo-Cang Zhang
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 107102 (2024)
https://doi.org/10.1063/5.0177277
Published: March 2024
View article titled, Response to “Comment on ‘Sum-frequency vibrational spectroscopy of centrosymmetric molecule at interfaces’” [J. Chem. Phys. 160, 107101 (2024)]
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Journal Articles

Effect of the nature of the solid substrate on spatially heterogeneous activated dynamics in glass forming supported films

Anh D. Phan, Kenneth S. Schweizer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 074902 (2024)
https://doi.org/10.1063/5.0188016
Published: February 2024
View article titled, Effect of the nature of the solid substrate on spatially heterogeneous activated dynamics in glass forming supported films
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Journal Articles

Stability of nanoparticle laden aerosol liquid droplets

A. J. Archer, B. D. Goddard, R. Roth
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 194503 (2023)
https://doi.org/10.1063/5.0172137
Published: November 2023
View article titled, Stability of nanoparticle laden aerosol liquid droplets
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Journal Articles

Nonequilibrium interfacial properties of chemically driven fluids

Yongick Cho, William M. Jacobs
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 154101 (2023)
https://doi.org/10.1063/5.0166824
Published: October 2023
View article titled, Nonequilibrium interfacial properties of chemically driven fluids
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Journal Articles

Molecular dynamics simulation study on the mass transfer across vapor–liquid interfaces in azeotropic mixtures

Vilde Bråten, Dominik Schaefer, Simon Stephan, Hans Hasse
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 084503 (2023)
https://doi.org/10.1063/5.0165421
Published: August 2023
View article titled, Molecular dynamics simulation study on the mass transfer across vapor–liquid interfaces in azeotropic mixtures
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Includes: Supplementary data
Journal Articles

Hole-initiated melting process of thin films

Jin Chenyu (金晨羽), Hans Riegler
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 221101 (2023)
https://doi.org/10.1063/5.0151788
Published: June 2023
View article titled, Hole-initiated melting process of thin films
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Journal Articles

Quantifying the effects of dissolved nitrogen and carbon dioxide on drying pressure of hydrophobic nanopores

Hikmat Binyaminov, Janet A. W. Elliott
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 204710 (2023)
https://doi.org/10.1063/5.0146952
Published: May 2023
View article titled, Quantifying the effects of dissolved nitrogen and carbon dioxide on drying pressure of hydrophobic nanopores
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Includes: Supplementary data
Journal Articles

Phase field simulation of liquid filling on grooved surfaces for complete, partial, and pseudo-partial wetting cases

Fandi Oktasendra, Arben Jusufi, Andrew R. Konicek, Mohsen S. Yeganeh, Jack R. Panter, Halim Kusumaatmaja
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 204501 (2023)
https://doi.org/10.1063/5.0144886
Published: May 2023
View article titled, Phase field simulation of liquid filling on grooved surfaces for complete, partial, and pseudo-partial wetting cases
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Includes: Supplementary data
Journal Articles

Dynamic surface stress field of the pure liquid–vapor interface subjected to the cyclic loads

Zhiyong Yu, Songtai Lv, Xin Zhang, Hongtao Liang, Wei Xie, Yang Yang
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 184701 (2023)
https://doi.org/10.1063/5.0147044
Published: May 2023
View article titled, Dynamic surface stress field of the pure liquid–vapor interface subjected to the cyclic loads
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Journal Articles

Wettability gradient-driven droplets with an applied external force

Leon Topp, Lena Haddick, Dominik Mählmann, Andreas Heuer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 174703 (2023)
https://doi.org/10.1063/5.0146910
Published: May 2023
View article titled, Wettability gradient-driven droplets with an applied external force
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Includes: Supplementary data
Journal Articles

Surface viscosity in simple liquids

Paolo Malgaretti, Ubaldo Bafile, Renzo Vallauri, Pál Jedlovszky, Marcello Sega
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 114705 (2023)
https://doi.org/10.1063/5.0141971
Published: March 2023
View article titled, Surface viscosity in simple liquids
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Includes: Supplementary data
Journal Articles

High-density liquid (HDL) adsorption at the supercooled water/vapor interface and its possible relation to the second surface tension inflection point

Alexander Gorfer, Christoph Dellago, Marcello Sega
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 054503 (2023)
https://doi.org/10.1063/5.0132985
Published: February 2023
View article titled, High-density liquid (HDL) adsorption at the supercooled water/vapor interface and its possible relation to the second surface tension inflection point
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Includes: Supplementary data
Journal Articles

Electrokinetic, electrochemical, and electrostatic surface potentials of the pristine water liquid–vapor interface

Featured
Maximilian R. Becker, Philip Loche, Roland R. Netz
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 240902 (2022)
https://doi.org/10.1063/5.0127869
Published: December 2022
View article titled, Electrokinetic, electrochemical, and electrostatic surface potentials of the pristine water liquid–vapor interface
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Includes: Supplementary data
Journal Articles

The influence of cross-interactions between dilute cosolutes upon liquid interfaces

Varun Mandalaparthy, Pho T. Bui, W. G. Noid
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 184706 (2022)
https://doi.org/10.1063/5.0118072
Published: November 2022
View article titled, The influence of cross-interactions between dilute cosolutes upon liquid interfaces
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