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Molecular Simulation Volume 45, 2019 - Issue 4-5: Water
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Articles

Contact angle and surface tension of water on a hexagonal boron nitride monolayer: a methodological investigation

Ilham EssafriUniv Rennes, CNRS, IPR (Institut de Physique de Rennes), Rennes, FranceView further author information
,
Jean-Christophe Le bretonUniv Rennes, CNRS, IPR (Institut de Physique de Rennes), Rennes, FranceView further author information
,
Arnaud Saint-JalmesUniv Rennes, CNRS, IPR (Institut de Physique de Rennes), Rennes, FranceView further author information
,
Armand SolderaLaboratory of Physical Chemistry of Matter (LPCM), Department of Chemistry, Université de Sherbrooke, Sherbrooke, Québec, CanadaView further author information
,
Anthony SzymczykUniv Rennes, CNRS, ISCR (Institut des Sciences Chimiques de Rennes), Rennes, FranceView further author information
,
Patrice MalfreytUniversite Clermont Auvergne, CNRS, SIGMA Clermont, Institut de Chimie de Clermont-Ferrand (ICCF), Clermont-Ferrand, FranceView further author information
&
Aziz GhoufiUniv Rennes, CNRS, IPR (Institut de Physique de Rennes), Rennes, FranceCorrespondence[email protected]
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Pages 454-461 | Received 15 May 2018, Accepted 15 Jul 2018, Published online: 30 Jul 2018

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Nadia Ben-Cheik Mansour, Julia Paredes, Hengli Zhao, Anthony Szymczyk, Ezzedine Ferjani & Aziz Ghoufi. (2022) Water transport through a two-dimensional nanoporous material: is there a relationship between water flux and surface tension?. Molecular Physics 120:8.
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Articles from other publishers (16)

Zhicheng Feng, Zhangke Lei, Yuanpeng Yao, Jianxin Liu, Bozhao Wu & Wengen Ouyang. (2023) Anisotropic Interfacial Force Field for Interfaces of Water with Hexagonal Boron Nitride. Langmuir.
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Kawaljit Singh Randhawa & Jagruti B. Prajapati. (2023) Hygroscopicity Analysis and Tribo-mechanical Characterizations of Conditioned PA6/MoS2/h-BN Hybrid Composite. Journal of Inorganic and Organometallic Polymers and Materials 33:2, pages 625-635.
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Takahiro Murono, Kenta Hongo, Kousuke Nakano & Ryo Maezono. (2022) Ab-initio-based interface modeling and statistical analysis for estimate of the water contact angle on a metallic Cu(111) surface. Surfaces and Interfaces 34, pages 102342.
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Yuting Qiao, Xianrong Liu, Zhi Jia, Peng Zhang, Li Gao, Bingxin Liu, Lijuan Qiao & Lei Zhang. (2022) In Situ Growth Intercalation Structure MXene@Anatase/Rutile TiO2 Ternary Heterojunction with Excellent Phosphoprotein Detection in Sweat. Biosensors 12:10, pages 865.
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Ashutosh Kumar Verma & Ananth Govind Rajan. (2022) Surface Roughness Explains the Observed Water Contact Angle and Slip Length on 2D Hexagonal Boron Nitride. Langmuir 38:30, pages 9210-9220.
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Abhishek T. Sose, Esmat Mohammadi, Preeya F. Achari & Sanket A. Deshmukh. (2022) Determination of Accurate Interaction Parameters between the Molybdenum Disulfide and Water to Investigate Their Interfacial Properties. The Journal of Physical Chemistry C 126:4, pages 2013-2022.
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Akarsh Verma, Avinash Parashar & Adri C.T. van Duin. 2022. Innovations in Graphene-Based Polymer Composites. Innovations in Graphene-Based Polymer Composites 133 165 .
Aniruddha Seal & Ananth Govind Rajan. (2021) Modulating Water Slip Using Atomic-Scale Defects: Friction on Realistic Hexagonal Boron Nitride Surfaces. Nano Letters 21:19, pages 8008-8016.
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Akarsh Verma, Weiwei Zhang & Adri C. T. van Duin. (2021) ReaxFF reactive molecular dynamics simulations to study the interfacial dynamics between defective h-BN nanosheets and water nanodroplets. Physical Chemistry Chemical Physics 23:18, pages 10822-10834.
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Qicheng Chen, Xupan Yang, Yingjin Zhang & Yulong Ding. (2021) Influence of Vacancy Defect of Calcium Oxide Surface on the Wettability of Molten Alkali Metal Salt in Calcium Looping Process. Langmuir 37:7, pages 2503-2513.
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Sima Majidi, Siamak Pakdel, Jafar Azamat & Hamid Erfan-Niya. 2021. Two-Dimensional (2D) Nanomaterials in Separation Science. Two-Dimensional (2D) Nanomaterials in Separation Science 163 191 .
Enrique Wagemann, Yanbin Wang, Siddhartha Das & Sushanta K. Mitra. (2020) On the wetting translucency of hexagonal boron nitride. Physical Chemistry Chemical Physics 22:15, pages 7710-7718.
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Qicheng Chen, Yingjin Zhang & Yulong Ding. (2020) Wettability of molten sodium sulfate salt on nanoscale calcium oxide surface in high-temperature thermochemical energy storage. Applied Surface Science 505, pages 144550.
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Enrique Wagemann, Yanbin Wang, Siddhartha Das & Sushanta K. Mitra. (2020) Wettability of nanostructured hexagonal boron nitride surfaces: molecular dynamics insights on the effect of wetting anisotropy. Physical Chemistry Chemical Physics 22:4, pages 2488-2497.
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Akin Budi & Tiffany R. Walsh. (2019) A Bespoke Force Field To Describe Biomolecule Adsorption at the Aqueous Boron Nitride Interface. Langmuir 35:49, pages 16234-16243.
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Ananth Govind Rajan, Michael S. Strano & Daniel Blankschtein. (2019) Liquids with Lower Wettability Can Exhibit Higher Friction on Hexagonal Boron Nitride: The Intriguing Role of Solid–Liquid Electrostatic Interactions. Nano Letters 19:3, pages 1539-1551.
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