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Journal Articles

Aging affects the mechanical interaction between microplastics and lipid bilayers

Jean-Baptiste Fleury, Vladimir A. Baulin
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 144902 (2024)
https://doi.org/10.1063/5.0232678
Published: October 2024
View article titled, Aging affects the mechanical interaction between microplastics and lipid bilayers
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Journal Articles

Investigation of the double layer structure of 1-butyl-3-methylimidazolium thiocyanate at the air–water interface using sum-frequency generation vibrational spectroscopy

Baihui Wang, Yiyi Duan, Yimin Bai, Weiting Zhang, Jiahui Peng, Hongtao Bian
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 134703 (2024)
https://doi.org/10.1063/5.0230508
Published: October 2024
View article titled, Investigation of the double layer structure of 1-butyl-3-methylimidazolium thiocyanate at the air–water interface using sum-frequency generation vibrational spectroscopy
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Journal Articles

Microscopic derivation of the thin film equation using the Mori–Zwanzig formalism

Michael te Vrugt, Leon Topp, Raphael Wittkowski, Andreas Heuer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 094904 (2024)
https://doi.org/10.1063/5.0217535
Published: September 2024
View article titled, Microscopic derivation of the thin film equation using the Mori–Zwanzig formalism
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Journal Articles

Interactions of clathrate hydrate promoters sodium dodecyl sulfate and tetrahydrofuran investigated using 1H diffusion nuclear magnetic resonance at hydrate-forming conditions

Zoe Adkins, Yuan Yang, Ryan L. Hartman, Carolyn A. Koh
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 094502 (2024)
https://doi.org/10.1063/5.0221008
Published: September 2024
View article titled, Interactions of clathrate hydrate promoters sodium dodecyl sulfate and tetrahydrofuran investigated using <sup>1</sup>H diffusion nuclear magnetic resonance at hydrate-forming conditions
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Journal Articles

The wetting of H2O by CO2

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Samuel G. H. Brookes, Venkat Kapil, Christoph Schran, Angelos Michaelides
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 084711 (2024)
https://doi.org/10.1063/5.0224230
Published: August 2024
View article titled, The wetting of H<sub>2</sub>O by CO<sub>2</sub>
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Journal Articles

The surface tension of Martini 3 water mixtures

Lorenzo Iannetti, Sonia Cambiaso, Fabio Rasera, Alberto Giacomello, Giulia Rossi, Davide Bochicchio, Antonio Tinti
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 084707 (2024)
https://doi.org/10.1063/5.0221199
Published: August 2024
View article titled, The surface tension of Martini 3 water mixtures
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Journal Articles

Dissociation line and driving force for nucleation of the nitrogen hydrate from computer simulation. II. Effect of multiple occupancy

Miguel J. Torrejón, Jesús Algaba, Felipe J. Blas
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 054712 (2024)
https://doi.org/10.1063/5.0220098
Published: August 2024
View article titled, Dissociation line and driving force for nucleation of the nitrogen hydrate from computer simulation. II. Effect of multiple occupancy
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Journal Articles

Electric-field induced phase separation and dielectric breakdown in leaky dielectric mixtures: Thermodynamics and kinetics

Haodong Zhang, Fei Wang, Britta Nestler
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 044704 (2024)
https://doi.org/10.1063/5.0203527
Published: July 2024
View article titled, Electric-field induced phase separation and dielectric breakdown in <em>leaky</em> dielectric mixtures: Thermodynamics and kinetics
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Journal Articles

Measuring line tension: Thermodynamic integration during detachment of a molecular dynamics droplet

Minori Shintaku, Haruki Oga, Hiroki Kusudo, Edward R. Smith, Takeshi Omori, Yasutaka Yamaguchi
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 224502 (2024)
https://doi.org/10.1063/5.0201973
Published: June 2024
View article titled, Measuring line tension: Thermodynamic integration during detachment of a molecular dynamics droplet
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Journal Articles

Particle size effect on surface/interfacial tension and Tolman length of nanomaterials: A simple experimental method combining with theoretical

Shengjiang Zhang, Yujia Xin, Yanan Sun, Ziheng Xi, Gan Wei, Meng Han, Bing Liang, Panpan Ou, Kangzhen Xu, Jiangyuan Qiu, Zaiyin Huang
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 194708 (2024)
https://doi.org/10.1063/5.0204848
Published: May 2024
View article titled, Particle size effect on surface/interfacial tension and Tolman length of nanomaterials: A simple experimental method combining with theoretical
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Includes: Supplementary data
Journal Articles

Microstructural investigation of morphology and kinetics of methane hydrate in the presence of tetrabutylammonium bromide: Insights for preservation and inhibition

Satoshi Takeya, Sanehiro Muromachi, Michihiro Muraoka, Kiyofumi Suzuki, Norio Tenma, Keiichi Hirano, Kazuyuki Hyodo, Masahide Kawamoto, Akio Yoneyama
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 154704 (2024)
https://doi.org/10.1063/5.0202418
Published: April 2024
View article titled, Microstructural investigation of morphology and kinetics of methane hydrate in the presence of tetrabutylammonium bromide: Insights for preservation and inhibition
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Journal Articles

Finding the differences: Classical nucleation perspective on homogeneous melting and freezing of hard spheres

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Willem Gispen, Marjolein Dijkstra
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 141102 (2024)
https://doi.org/10.1063/5.0201629
Published: April 2024
View article titled, Finding the differences: Classical nucleation perspective on homogeneous melting and freezing of hard spheres
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Includes: Supplementary data
Journal Articles

Interfacial properties of the brine + carbon dioxide + oil + silica system

Yafan Yang, Arun Kumar Narayanan Nair, Denvid Lau, Shuyu Sun
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 114702 (2024)
https://doi.org/10.1063/5.0197087
Published: March 2024
View article titled, Interfacial properties of the brine + carbon dioxide + oil + silica system
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Includes: Supplementary data
Journal Articles

Supersaturation dependent nucleation of methane + propane mixed-gas hydrate

Tsutomu Uchida, Ren Sugibuchi, Masato Hayama, Kenji Yamazaki
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 074502 (2024)
https://doi.org/10.1063/5.0189967
Published: February 2024
View article titled, Supersaturation dependent nucleation of methane + propane mixed-gas hydrate
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Journal Articles

Polymeric surfactants at liquid–liquid interfaces: Dependence of structural and thermodynamic properties on copolymer architecture

Jonathan G. Coldstream, Philip J. Camp, Daniel J. Phillips, Peter J. Dowding
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 054902 (2024)
https://doi.org/10.1063/5.0189156
Published: February 2024
View article titled, Polymeric surfactants at liquid–liquid interfaces: Dependence of structural and thermodynamic properties on copolymer architecture
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Journal Articles

Solute interaction-driven and solvent interaction-driven liquid–liquid phase separation induced by molecular size difference

Editor’s Pick
Yuya Iida, Shotaro Hiraide, Minoru T. Miyahara, Satoshi Watanabe
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 044504 (2024)
https://doi.org/10.1063/5.0190119
Published: January 2024
View article titled, Solute interaction-driven and solvent interaction-driven liquid–liquid phase separation induced by molecular size difference
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Journal Articles

Methane hydrate phase equilibrium considering dissolved methane concentrations and interfacial geometries from molecular simulations

Kehan Li, Bingbing Chen, Mingjun Yang, Yongchen Song, Amadeu K. Sum
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 244505 (2023)
https://doi.org/10.1063/5.0174705
Published: December 2023
View article titled, Methane hydrate phase equilibrium considering dissolved methane concentrations and interfacial geometries from molecular simulations
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Includes: Supplementary data
Journal Articles

Dissociation line and driving force for nucleation of the nitrogen hydrate from computer simulation

Jesús Algaba, Miguel J. Torrejón, Felipe J. Blas
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 224707 (2023)
https://doi.org/10.1063/5.0176120
Published: December 2023
View article titled, Dissociation line and driving force for nucleation of the nitrogen hydrate from computer simulation
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Journal Articles

Effect of amphiphilic polymers on phase separating binary mixtures: A DPD simulation study

Avinash Chauhan, Dorothy Gogoi, Sanjay Puri, Awaneesh Singh
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 204901 (2023)
https://doi.org/10.1063/5.0173817
Published: November 2023
View article titled, Effect of amphiphilic polymers on phase separating binary mixtures: A DPD simulation study
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Journal Articles

Thermodynamics and morphology of linear multiblock copolymers at homopolymer interfaces

Ryan P. Collanton, Christopher J. Ellison, Kevin D. Dorfman
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 194905 (2023)
https://doi.org/10.1063/5.0170650
Published: November 2023
View article titled, Thermodynamics and morphology of linear multiblock copolymers at homopolymer interfaces
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Includes: Supplementary data