The DOI matches its Crossref record; 38 of the 38 references it cites were found in a registry or an index.
Friction of Water on Graphene and Hexagonal Boron Nitride from Ab Initio Methods: Very Different Slippage Despite Very Similar Interface Structures
Open accessAbstract
Friction is one of the main sources of dissipation at liquid water/solid interfaces. Despite recent progress, a detailed understanding of water/solid friction in connection with the structure and energetics of the solid surface is lacking. Here, we show for the first time that ab initio molecular dynamics can be used to unravel the connection between the structure of nanoscale water and friction for liquid water in contact with graphene and with hexagonal boron nitride. We find that although the interface presents a very similar structure between the two sheets, the friction coefficient on boron nitride is ≈ 3 times larger than that on graphene. This comes about because of the greater corrugation of the energy landscape on boron nitride arising from specific electronic structure effects. We discuss how a subtle dependence of the friction on the atomistic details of a surface, which is not related to its wetting properties, may have a significant impact on the transport of water at the nanoscale, with implications for the development of membranes for desalination and for osmotic power harvesting.
Overview
The claims and statistics of this paper haven’t been checked yet.
Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.
Integrity signals
Registry
Cites
Statistics
Verification
Claims the paper makes
The claims and statistics of this paper haven’t been checked yet.
Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.
Self-check
Percentages, sums and reported differences re-computed from the paper’s own numbers.
The self-check needs the paper’s full text.
Citations
Cites
Van der Waals heterostructures
Geim, A. K., & Grigorieva, I. V. (2013) · Nature · doi:10.1038/nature12385 · Cited by 10,875
VandeVondele, J., Krack, M., Mohamed, F., Parrinello, M., Chassaing, T., & Hutter, J. (2005) · Computer Physics Communications · doi:10.1016/j.cpc.2004.12.014 · Cited by 5,822
Van der Waals density functionals applied to solids
Klimeš, J., Bowler, D. R., & Michaelides, A. (2011) · Physical Review B · doi:10.1103/physrevb.83.195131 · Cited by 4,624
Self-citationWater conduction through the hydrophobic channel of a carbon nanotube
Hummer, G., Rasaiah, J. C., & Noworyta, J. P. (2001) · Nature · doi:10.1038/35102535 · Cited by 3,557
Unimpeded Permeation of Water Through Helium-Leak–Tight Graphene-Based Membranes
Nair, R. R., Wu, H. A., Jayaram, P. N., Grigorieva, I. V., & Geim, A. K. (2012) · Science · doi:10.1126/science.1211694 · Cited by 3,073
Fast Mass Transport Through Sub-2-Nanometer Carbon Nanotubes
Holt, J. K., Park, H. G., Wang, Y., Stadermann, M., Artyukhin, A. B., Grigoropoulos, C. P., Noy, A., & Bakajin, O. (2006) · Science · doi:10.1126/science.1126298 · Cited by 3,015
Water Desalination across Nanoporous Graphene
Cohen-Tanugi, D., & Grossman, J. C. (2012) · Nano Letters · doi:10.1021/nl3012853 · Cited by 2,204
Hydrogen-bond kinetics in liquid water
Luzar, A., & Chandler, D. (1996) · Nature · doi:10.1038/379055a0 · Cited by 2,048
Enhanced flow in carbon nanotubes
Majumder, M., Chopra, N., Andrews, R., & Hinds, B. J. (2005) · Nature · doi:10.1038/438044a · Cited by 1,679
Membrane-based processes for sustainable power generation using water
Logan, B. E., & Elimelech, M. (2012) · Nature · doi:10.1038/nature11477 · Cited by 1,644
Nanofluidics, from bulk to interfaces
Bocquet, L., & Charlaix, E. (2010) · Chem. Soc. Rev. · doi:10.1039/b909366b · Cited by 1,582
Werder, T., Walther, J. H., Jaffe, R. L., Halicioglu, T., & Koumoutsakos, P. (2003) · The Journal of Physical Chemistry B · doi:10.1021/jp0268112 · Cited by 1,317
Giant osmotic energy conversion measured in a single transmembrane boron nitride nanotube
Siria, A., Poncharal, P., Biance, A.-L., Fulcrand, R., Blase, X., Purcell, S. T., & Bocquet, L. (2013) · Nature · doi:10.1038/nature11876 · Cited by 1,302
Wetting transparency of graphene
Rafiee, J., Mi, X., Gullapalli, H., Thomas, A. V., Yavari, F., Shi, Y., Ajayan, P. M., & Koratkar, N. A. (2012) · Nature Materials · doi:10.1038/nmat3228 · Cited by 1,119
The structure of liquid water at an extended hydrophobic surface
Lee, C.-Y., McCammon, J. A., & Rossky, P. J. (1984) · The Journal of Chemical Physics · doi:10.1063/1.447226 · Cited by 878
Falk, K., Sedlmeier, F., Joly, L., Netz, R. R., & Bocquet, L. (2010) · Nano Letters · doi:10.1021/nl1021046 · Cited by 862
Self-citationFlow boundary conditions from nano- to micro-scales
Bocquet, L., & Barrat, J.-L. (2007) · Soft Matter · doi:10.1039/b616490k · Cited by 682
Colloquium: Modeling friction: From nanoscale to mesoscale
Vanossi, A., Manini, N., Urbakh, M., Zapperi, S., & Tosatti, E. (2013) · Reviews of Modern Physics · doi:10.1103/revmodphys.85.529 · Cited by 542
Water Slippage versus Contact Angle: A Quasiuniversal Relationship
Huang, D. M., Sendner, C., Horinek, D., Netz, R. R., & Bocquet, L. (2008) · Physical Review Letters · doi:10.1103/physrevlett.101.226101 · Cited by 527
Water Confined in Nanotubes and between Graphene Sheets: A First Principle Study
Cicero, G., Grossman, J. C., Schwegler, E., Gygi, F., & Galli, G. (2008) · Journal of the American Chemical Society · doi:10.1021/ja074418+ · Cited by 514
Hydrodynamic boundary conditions, correlation functions, and Kubo relations for confined fluids
Bocquet, L., & Barrat, J.-L. (1994) · Physical Review E · doi:10.1103/physreve.49.3079 · Cited by 400
Superlubricity in centimetres-long double-walled carbon nanotubes under ambient conditions
Zhang, R., Ning, Z., Zhang, Y., Zheng, Q., Chen, Q., Xie, H., Zhang, Q., Qian, W., & Wei, F. (2013) · Nature Nanotechnology · doi:10.1038/nnano.2013.217 · Cited by 380
An ab Initio Molecular Dynamics Study of the Aqueous Liquid-Vapor Interface
Kuo, I.-F. W., & Mundy, C. J. (2004) · Science · doi:10.1126/science.1092787 · Cited by 356
How fast does water flow in carbon nanotubes?
Kannam, S. K., Todd, B. D., Hansen, J. S., & Daivis, P. J. (2013) · The Journal of Chemical Physics · doi:10.1063/1.4793396 · Cited by 329
Scaling laws for van der Waals interactions in nanostructured materials
Gobre, V. V., & Tkatchenko, A. (2013) · Nature Communications · doi:10.1038/ncomms3341 · Cited by 299
The interplay between apparent viscosity and wettability in nanoconfined water
Ortiz-Young, D., Chiu, H.-C., Kim, S., Voïtchovsky, K., & Riedo, E. (2013) · Nature Communications · doi:10.1038/ncomms3482 · Cited by 293
Li, H., & Zeng, X. C. (2012) · ACS Nano · doi:10.1021/nn204661d · Cited by 268
Liquid water can slip on a hydrophilic surface
Ho, T. A., Papavassiliou, D. V., Lee, L. L., & Striolo, A. (2011) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1105189108 · Cited by 264
Water Permeation through a Subnanometer Boron Nitride Nanotube
Won, C. Y., & Aluru, N. R. (2007) · Journal of the American Chemical Society · doi:10.1021/ja0687318 · Cited by 221
Friction and energy dissipation mechanisms in adsorbed molecules and molecularly thin films
Krim, J. (2012) · Advances in Physics · doi:10.1080/00018732.2012.706401 · Cited by 201
First-Principles Calculation of Transport Coefficients
Alfè, D., & Gillan, M. J. (1998) · Physical Review Letters · doi:10.1103/physrevlett.81.5161 · Cited by 201
Structural and Vibrational Properties of Liquid Water from van der Waals Density Functionals
Zhang, C., Wu, J., Galli, G., & Gygi, F. (2011) · Journal of Chemical Theory and Computation · doi:10.1021/ct200329e · Cited by 197
To Wet or Not to Wet? Dispersion Forces Tip the Balance for Water Ice on Metals
Carrasco, J., Santra, B., Klimeš, J., & Michaelides, A. (2011) · Physical Review Letters · doi:10.1103/physrevlett.106.026101 · Cited by 189
Self-citationOn the Green-Kubo relationship for the liquid-solid friction coefficient
Bocquet, L., & Barrat, J. (2013) · The Journal of Chemical Physics · doi:10.1063/1.4816006 · Cited by 144
Measurement of the slip length of water flow on graphite surface
Maali, A., Cohen-Bouhacina, T., & Kellay, H. (2008) · Applied Physics Letters · doi:10.1063/1.2840717 · Cited by 127
Solvent-Induced Proton Hopping at a Water–Oxide Interface
Tocci, G., & Michaelides, A. (2014) · The Journal of Physical Chemistry Letters · doi:10.1021/jz402646c · Cited by 112
Self-citationFriction of water slipping in carbon nanotubes
Ma, M. D., Shen, L., Sheridan, J., Liu, J. Z., Chen, C., & Zheng, Q. (2011) · Physical Review E · doi:10.1103/physreve.83.036316 · Cited by 94
Feibelman, P. J. (2013) · The Journal of Physical Chemistry C · doi:10.1021/jp312152h · Cited by 33
Cited by
Anomalously low dielectric constant of confined water
Fumagalli, L., Esfandiar, A., Fabregas, R., Hu, S., Ares, P., Janardanan, A., Yang, Q., Radha, B., Taniguchi, T., Watanabe, K., et al. (2018) · Science · doi:10.1126/science.aat4191 · Cited by 1,067
Hermann, J., DiStasio, R. A., & Tkatchenko, A. (2017) · Chemical Reviews · doi:10.1021/acs.chemrev.6b00446 · Cited by 657
New avenues for the large-scale harvesting of blue energy
Siria, A., Bocquet, M.-L., & Bocquet, L. (2017) · Nature Reviews Chemistry · doi:10.1038/s41570-017-0091 · Cited by 640
Wettability effect on nanoconfined water flow
Wu, K., Chen, Z., Li, J., Li, X., Xu, J., & Dong, X. (2017) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1612608114 · Cited by 567
Critical Knowledge Gaps in Mass Transport through Single-Digit Nanopores: A Review and Perspective
Faucher, S., Aluru, N., Bazant, M. Z., Blankschtein, D., Brozena, A. H., Cumings, J., Pedro de Souza, J., Elimelech, M., Epsztein, R., Fourkas, J. T., et al. (2019) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.9b02178 · Cited by 365
Metadata
- Authors
- Tocci, G., Joly, L., & Michaelides, A.
- Venue
- Nano Letters
- Publisher
- American Chemical Society (ACS)
- Published
- 2014-11-19
- Volume
- 14
- Issue
- 12
- Pages
- 6872-6877
- ISSN
- 1530-6984 (ISSN-L)
- 1530-6992
- OpenAlex
- W2037811344
- Cited by
- 428
- References
- 38
- FWCI
- 12.91
- Type
- journal article
- Language
- en
- Open access
- green
About these checks
Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.
Statistics and arithmetic are recomputed, not judged.
Confidence bands are shown only for fields calibrated on our annotated test set. None is calibrated yet, so no band is shown.
What counts as a claim ›How we measure confidence ›How we check this ›
Are you an author, or do you see a problem with this page? Request a review
Data sources
Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.
