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Journal Articles

Models to predict configurational adiabats of Lennard-Jones fluids and their transport coefficients

D. M. Heyes, D. Dini, S. Pieprzyk, A. C. Brańka, L. Costigliola
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 084502 (2024)
https://doi.org/10.1063/5.0225650
Published: August 2024
View article titled, Models to predict configurational adiabats of Lennard-Jones fluids and their transport coefficients
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Journal Articles

Nanoclustering in non-ideal ethanol/heptane solutions alters solvation dynamics

Vivian F. Crum, Kevin J. Kubarych
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 044507 (2024)
https://doi.org/10.1063/5.0216746
Published: July 2024
View article titled, Nanoclustering in non-ideal ethanol/heptane solutions alters solvation dynamics
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Journal Articles

More considerations about the symmetry of the stress tensor of fluids

Ji Luo
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 044112 (2024)
https://doi.org/10.1063/5.0210717
Published: July 2024
View article titled, More considerations about the symmetry of the stress tensor of fluids
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Journal Articles

Understanding dynamics in coarse-grained models. IV. Connection of fine-grained and coarse-grained dynamics with the Stokes–Einstein and Stokes–Einstein–Debye relations

Jaehyeok Jin, Gregory A. Voth
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 034114 (2024)
https://doi.org/10.1063/5.0212973
Published: July 2024
View article titled, Understanding dynamics in coarse-grained models. IV. Connection of fine-grained and coarse-grained dynamics with the Stokes–Einstein and Stokes–Einstein–Debye relations
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Journal Articles

What is the origin of slow relaxation modes in highly viscous ionic liquids?

Kira L. Eliasen, Jan Gabriel, Thomas Blochowicz, Catalin P. Gainaru, Tage E. Christensen, Kristine Niss
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 034506 (2024)
https://doi.org/10.1063/5.0215661
Published: July 2024
View article titled, What is the origin of slow relaxation modes in highly viscous ionic liquids?
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Journal Articles

Modeling temperature-dependent transport properties in dissipative particle dynamics: A top-down coarse-graining toward realistic dynamics at the mesoscale

N. Lauriello, M. Lísal, G. Boccardo, D. Marchisio, A. Buffo
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 034112 (2024)
https://doi.org/10.1063/5.0207530
Published: July 2024
View article titled, Modeling temperature-dependent transport properties in dissipative particle dynamics: A top-down coarse-graining toward realistic dynamics at the mesoscale
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Journal Articles

Superadiabatic dynamical density functional theory for colloidal suspensions under homogeneous steady-shear

S. M. Tschopp, J. M. Brader
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 214124 (2024)
https://doi.org/10.1063/5.0211198
Published: June 2024
View article titled, Superadiabatic dynamical density functional theory for colloidal suspensions under homogeneous steady-shear
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Journal Articles

Surface viscosity of liquid interfaces from Green–Kubo relations

Pál Jedlovszky, Marcello Sega
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 201101 (2024)
https://doi.org/10.1063/5.0206954
Published: May 2024
View article titled, Surface viscosity of liquid interfaces from Green–Kubo relations
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Journal Articles

Hydrodynamic slip characteristics of shear-driven water flow in nanoscale carbon slits

Abdul Aziz Shuvo, Luis E. Paniagua-Guerra, Xiang Yang, Bladimir Ramos-Alvarado
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 194704 (2024)
https://doi.org/10.1063/5.0197271
Published: May 2024
View article titled, Hydrodynamic slip characteristics of shear-driven water flow in nanoscale carbon slits
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Includes: Supplementary data
Journal Articles

Isotope effect on the anomalies of water: A corresponding states analysis

Frédéric Caupin, Pierre Ragueneau, Bruno Issenmann
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 191102 (2024)
https://doi.org/10.1063/5.0205452
Published: May 2024
View article titled, Isotope effect on the anomalies of water: A corresponding states analysis
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Journal Articles

Diffusion, viscosity, and linear rheology of valence-limited disordered fluids

Editor’s Pick
Samuel S. Gomez, Lorenzo Rovigatti
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 184901 (2024)
https://doi.org/10.1063/5.0209151
Published: May 2024
View article titled, Diffusion, viscosity, and linear rheology of valence-limited disordered fluids
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Journal Articles

Exploration of Stokes hydrodynamic law at molecular length scales

Subhajit Acharya, Biman Bagchi
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 174502 (2024)
https://doi.org/10.1063/5.0203441
Published: May 2024
View article titled, Exploration of Stokes hydrodynamic law at molecular length scales
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Includes: Supplementary data
Journal Articles

Range and sensitivity of 17O nuclear spin-lattice relaxation as a probe of aqueous electrolyte dynamics

Chengtong Zhang, Alexej Jerschow
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 154501 (2024)
https://doi.org/10.1063/5.0196494
Published: April 2024
View article titled, Range and sensitivity of <sup>17</sup>O nuclear spin-lattice relaxation as a probe of aqueous electrolyte dynamics
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Journal Articles

Freezing density scaling of transport coefficients in the Weeks–Chandler–Andersen fluid

S. A. Khrapak, A. G. Khrapak
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 134504 (2024)
https://doi.org/10.1063/5.0199310
Published: April 2024
View article titled, Freezing density scaling of transport coefficients in the Weeks–Chandler–Andersen fluid
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Journal Articles

Influence of repulsion on entropy scaling and density scaling of monatomic fluids

Denis Saric, Ian H. Bell, Gabriela Guevara-Carrion, Jadran Vrabec
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 104503 (2024)
https://doi.org/10.1063/5.0196592
Published: March 2024
View article titled, Influence of repulsion on entropy scaling and density scaling of monatomic fluids
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Includes: Supplementary data
Journal Articles

Structural effects of water clusters on viscosity at high shear rates

Yitian Gao, Jian Wu, Yixuan Feng, Jiale Han, Hongwei Fang
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 104502 (2024)
https://doi.org/10.1063/5.0187906
Published: March 2024
View article titled, Structural effects of water clusters on viscosity at high shear rates
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Includes: Supplementary data
Journal Articles

Effectiveness of inhibitors to prevent asphaltene aggregation: Insights from atomistic and molecular simulations

Featured
Anoop Kishore Vatti, Srikanth Divi, Poulumi Dey
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 090901 (2024)
https://doi.org/10.1063/5.0190779
Published: March 2024
View article titled, Effectiveness of inhibitors to prevent asphaltene aggregation: Insights from atomistic and molecular simulations
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Journal Articles

Shear rheology senses the electrical room-temperature conductivity optimum in highly Li doped dinitrile electrolytes

Sofiane Lansab, Tobias Schwan, Kevin Moch, Roland Böhmer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 084503 (2024)
https://doi.org/10.1063/5.0186008
Published: February 2024
View article titled, Shear rheology senses the electrical room-temperature conductivity optimum in highly Li doped dinitrile electrolytes
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Includes: Supplementary data
Journal Articles

Polymeric liquids in mesoporous photonic structures: From precursor film spreading to imbibition dynamics at the nanoscale

Guido Dittrich, Luisa G. Cencha, Martin Steinhart, Ralf B. Wehrspohn, Claudio L. A. Berli, Raul Urteaga, Patrick Huber
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 064903 (2024)
https://doi.org/10.1063/5.0189633
Published: February 2024
View article titled, Polymeric liquids in mesoporous photonic structures: From precursor film spreading to imbibition dynamics at the nanoscale
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Includes: Supplementary data
Journal Articles

Wettability-modulated behavior of polymers under varying degrees of nano-confinement

Vinay Arya, Abhirup Chaudhuri, Chirodeep Bakli
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 064905 (2024)
https://doi.org/10.1063/5.0185533
Published: February 2024
View article titled, Wettability-modulated behavior of polymers under varying degrees of nano-confinement
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Includes: Supplementary data