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Molecular Simulation Volume 39, 2013 - Issue 14-15: Monte Carlo Codes, Tools and Algorithms
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Application of the interface potential approach to calculate the wetting properties of a water model system

Vaibhaw KumarDepartment of Chemical and Biological Engineering, University at Buffalo, The State University of New York, Buffalo, NY, USA
&
Jeffrey R. ErringtonDepartment of Chemical and Biological Engineering, University at Buffalo, The State University of New York, Buffalo, NY, USACorrespondence[email protected]
Pages 1143-1152 | Received 05 Apr 2013, Accepted 14 Jun 2013, Published online: 11 Sep 2013

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Martin B. Sweatman. (2013) Preface to the special issue on ‘Monte Carlo Codes, Tools and Algorithms’. Molecular Simulation 39:14-15, pages 1123-1124.
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Articles from other publishers (18)

Johanna Dieplinger, Christina Moser, Gerhard König, Joana T. Pinto & Amrit Paudel. (2023) Investigation of the Impact of Saccharides on the Relative Activity of Trypsin and Catalase after Droplet and Spray Drying. Pharmaceutics 15:10, pages 2504.
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Hanieh Bazyar, Othonas A. Moultos & Rob G. H. Lammertink. (2022) A review on nature-inspired gating membranes: From concept to design and applications. The Journal of Chemical Physics 157:14.
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Yiqi Chen, Andrew J. Schultz & Jeffrey R. Errington. (2021) Coupled Monte Carlo and Molecular Dynamics Simulations on Interfacial Properties of Antifouling Polymer Membranes. The Journal of Physical Chemistry B 125:29, pages 8193-8204.
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J. Roy Choudhuri & P. Nath. (2020) Wetting transition of a nanodrop on switchable hydrophilic-hydrophobic surfaces. Surfaces and Interfaces 21, pages 100628.
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Robert Evans, Maria C. Stewart & Nigel B. Wilding. (2019) A unified description of hydrophilic and superhydrophobic surfaces in terms of the wetting and drying transitions of liquids. Proceedings of the National Academy of Sciences 116:48, pages 23901-23908.
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Wenjing Guo & Jeffrey R. Errington. (2019) Effect of Surface Hydrophilicity on the Interfacial Properties of a Model Octane–Water–Silica System. The Journal of Physical Chemistry C 123:32, pages 19649-19658.
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Karnesh Jain, Andrew J. Schultz & Jeffrey R. Errington. (2019) Construction of the interface potential from a series of canonical ensemble simulations. The Journal of Chemical Physics 151:4.
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Hao Jiang, Suruchi Fialoke, Zachariah Vicars & Amish J. Patel. (2019) Characterizing surface wetting and interfacial properties using enhanced sampling (SWIPES). Soft Matter 15:5, pages 860-869.
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Wenjing Guo & Jeffrey R. Errington. (2018) Monte Carlo Simulation Strategies to Compute the Interfacial Properties of a Model Octane–Water–Silica System. The Journal of Physical Chemistry C 122:30, pages 17309-17318.
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Wenjing Guo, Prannay Bali & Jeffrey R. Errington. (2018) Calculation of the Saturation Properties of a Model Octane–Water System Using Monte Carlo Simulation. The Journal of Physical Chemistry B 122:23, pages 6260-6271.
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Hao Jiang, Florian Müller-Plathe & Athanassios Z. Panagiotopoulos. (2017) Contact angles from Young’s equation in molecular dynamics simulations. The Journal of Chemical Physics 147:8.
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Robert Evans, Maria C. Stewart & Nigel B. Wilding. (2017) Drying and wetting transitions of a Lennard-Jones fluid: Simulations and density functional theory. The Journal of Chemical Physics 147:4.
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Matej Kanduč & Roland R. Netz. (2017) Atomistic simulations of wetting properties and water films on hydrophilic surfaces. The Journal of Chemical Physics 146:16.
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Rong An, Liangliang Huang, Kenneth P. Mineart, Yihui Dong, Richard J. Spontak & Keith E. Gubbins. (2017) Adhesion and friction in polymer films on solid substrates: conformal sites analysis and corresponding surface measurements. Soft Matter 13:19, pages 3492-3505.
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Robert Evans, Maria C. Stewart & Nigel B. Wilding. (2016) Critical Drying of Liquids. Physical Review Letters 117:17.
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Robert Evans & Nigel B. Wilding. (2015) Quantifying Density Fluctuations in Water at a Hydrophobic Surface: Evidence for Critical Drying. Physical Review Letters 115:1.
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Kaustubh S. Rane & Jeffrey R. Errington. (2014) Understanding the influence of Coulomb and dispersion interactions on the wetting behavior of ionic liquids. The Journal of Chemical Physics 141:17, pages 174706.
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Vaibhaw Kumar & Jeffrey R. Errington. (2013) Wetting Behavior of Water near Nonpolar Surfaces. The Journal of Physical Chemistry C 117:44, pages 23017-23026.
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