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Journal Articles
Polarization of ethanol under thermal fields
Open Access
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 163, 024501 (2025)
Published: July 2025
Journal Articles
Journal Articles
Static and dynamic theory of polarization under internal and directing electric fields: Fixed-charge and fixed-potential conditions
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 214105 (2025)
Published: June 2025
Journal Articles
Mitigation of the confinement-induced dielectric constant reduction via binary mixing strategy for energy storage applications
Available to Purchase
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 194706 (2025)
Published: May 2025
Journal Articles
Explicitly accounting for background charges in a fast multipole method to simulate periodically replicated non neutral microscopic systems
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 194102 (2025)
Published: May 2025
Journal Articles
Thermodynamic insights into polyelectrolyte complexation: A theoretical framework
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 164904 (2025)
Published: April 2025
Journal Articles
Tuning partial charges of alkyl alcohols to improve simulated fluid properties
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 154504 (2025)
Published: April 2025
Journal Articles
Journal Articles
Journal Articles
Cavity correlations and the onset of charge ordering at charged interfaces: A modified Poisson–Fermi approach
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 034110 (2025)
Published: January 2025
Journal Articles
Journal Articles
Frequency-dependent conductivity of concentrated electrolytes: A stochastic density functional theory
Open Access
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 244501 (2024)
Published: December 2024
Journal Articles
Efficient method for simulating ionic fluids between polarizable metal electrodes
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 214102 (2024)
Published: December 2024
Journal Articles
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 184112 (2024)
Published: November 2024
Includes: Supplementary data
Journal Articles
Cooperative lattice theory for CO2 adsorption in diamine-appended metal-organic framework at humid direct air capture conditions
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 184703 (2024)
Published: November 2024
Journal Articles
Theoretically grounded approaches to account for polarization effects in fixed-charge force fields
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 180901 (2024)
Published: November 2024
Journal Articles
Inferring the existence of hydrogen bonds directly from statistical analysis of molecular dynamics trajectories
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 174116 (2024)
Published: November 2024
Journal Articles
Coarse-grained polarizable soft solvent models, with applications in dissipative particle dynamics
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 174115 (2024)
Published: November 2024
Journal Articles
Path-integral calculation of the third dielectric virial coefficient of helium based on ab initio three-body polarizability and dipole surfaces
Giovanni Garberoglio, Allan H. Harvey, Jakub Lang, Michał Przybytek, Michał Lesiuk, Bogumił Jeziorski
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 144111 (2024)
Published: October 2024
Journal Articles
Javier Carmona-Espíndola, Valeria García-Melgarejo, Edgar Núñez-Rojas, Samantha Mendoza, Abraham García, José L. Gázquez, José Alejandre
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 144103 (2024)
Published: October 2024
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