Literature DB >> 20925366

Fluctuations in number of water molecules confined between nanoparticles.

Changsun Eun1, Max L Berkowitz.   

Abstract

We used molecular dynamics computer simulations to study the character of interactions between two nanoscale graphene plates in water and also between plates made of "carbon" atoms that have different interaction strength with water. Fluctuations in the number of water molecules in the confined space between plates are qualitatively similar when the plates are made of graphene or when the plates contain "carbon" atoms with weaker "carbon"-water interaction strength. We also observed that these fluctuations are strongly enhanced compared to the fluctuations observed next to a single plate. If the character of water fluctuations in the confined space determines the character of interactions, then it is possible to conclude that the interaction between graphene plates in water is hydrophobic.

Entities:  

Year:  2010        PMID: 20925366     DOI: 10.1021/jp1072654

Source DB:  PubMed          Journal:  J Phys Chem B        ISSN: 1520-5207            Impact factor:   2.991


  6 in total

1.  Evaporation rate of water in hydrophobic confinement.

Authors:  Sumit Sharma; Pablo G Debenedetti
Journal:  Proc Natl Acad Sci U S A       Date:  2012-03-05       Impact factor: 11.205

2.  Quantifying density fluctuations in volumes of all shapes and sizes using indirect umbrella sampling.

Authors:  Amish J Patel; Patrick Varilly; David Chandler; Shekhar Garde
Journal:  J Stat Phys       Date:  2011-10-01       Impact factor: 1.548

3.  Role of spatial ionic distribution on the energetics of hydrophobic assembly and properties of the water/hydrophobe interface.

Authors:  Brad A Bauer; Shuching Ou; Sandeep Patel
Journal:  Phys Chem Chem Phys       Date:  2012-01-09       Impact factor: 3.676

4.  Probing surface tension additivity on chemically heterogeneous surfaces by a molecular approach.

Authors:  Jihang Wang; Dusan Bratko; Alenka Luzar
Journal:  Proc Natl Acad Sci U S A       Date:  2011-04-01       Impact factor: 11.205

5.  Dynamics and energetics of hydrophobically confined water.

Authors:  Brad A Bauer; Shuching Ou; Sandeep Patel; Karthik Siva
Journal:  Phys Rev E Stat Nonlin Soft Matter Phys       Date:  2012-05-23

6.  Osmosis-Driven Water Transport through a Nanochannel: A Molecular Dynamics Simulation Study.

Authors:  Changsun Eun
Journal:  Int J Mol Sci       Date:  2020-10-28       Impact factor: 5.923

  6 in total

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