Effect of metal ion intercalation on the structure of MXene and water dynamics on its internal surfaces
MXenes are a recently discovered class of 2D materials with an excellent potential for energy storage applications. Because MXene surfaces are hydrophilic and attractive interaction forces between the layers are relatively weak, water molecules can spontaneously intercalate at ambient humidity and significantly influence the key properties of this 2D material. Using complementary X-ray and neutron scattering techniques, we demonstrate that intercalation with potassium cations significantly improves structural homogeneity and water stability in MXenes. Furthermore, in agreement with molecular dynamics simulations, intercalated potassium ions reduce the water self-diffusion coefficient by 2 orders of magnitude, suggesting greater stability of hydrated MXene against changing environmental conditions.
- Authors:
-
[1]
; [1]
; [2]
; [1]
; [3]
; [1]
; [1]
;
; [3]
; [1]
; [1]
- Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
- Pennsylvania State Univ., University Park, PA (United States)
- Drexel Univ., Philadelphia, PA (United States)
- Publication Date:
- Grant/Contract Number:
- AC05-00OR22725
- Type:
- Accepted Manuscript
- Journal Name:
- ACS Applied Materials and Interfaces
- Additional Journal Information:
- Journal Volume: 8; Journal Issue: 14; Journal ID: ISSN 1944-8244
- Publisher:
- American Chemical Society
- Research Org:
- Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
- Sponsoring Org:
- USDOE Office of Science (SC)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; intercalation; MXenes; quasi-elastic neutron scattering; ReaxFF simulation; water diffusion
- OSTI Identifier:
- 1261340
Osti, Naresh C., Naguib, Michael, Ostadhossein, Alireza, Kent, Paul R. C., Dyatkin, Boris, Rother, Gernot, Heller, William T., Adri C. T. van Duin, Gogotsi, Yury, Mamontov, Eugene, and Xie, Yu. Effect of metal ion intercalation on the structure of MXene and water dynamics on its internal surfaces. United States: N. p.,
Web. doi:10.1021/acsami.6b01490.
Osti, Naresh C., Naguib, Michael, Ostadhossein, Alireza, Kent, Paul R. C., Dyatkin, Boris, Rother, Gernot, Heller, William T., Adri C. T. van Duin, Gogotsi, Yury, Mamontov, Eugene, & Xie, Yu. Effect of metal ion intercalation on the structure of MXene and water dynamics on its internal surfaces. United States. doi:10.1021/acsami.6b01490.
Osti, Naresh C., Naguib, Michael, Ostadhossein, Alireza, Kent, Paul R. C., Dyatkin, Boris, Rother, Gernot, Heller, William T., Adri C. T. van Duin, Gogotsi, Yury, Mamontov, Eugene, and Xie, Yu. 2016.
"Effect of metal ion intercalation on the structure of MXene and water dynamics on its internal surfaces". United States.
doi:10.1021/acsami.6b01490. https://www.osti.gov/servlets/purl/1261340.
@article{osti_1261340,
title = {Effect of metal ion intercalation on the structure of MXene and water dynamics on its internal surfaces},
author = {Osti, Naresh C. and Naguib, Michael and Ostadhossein, Alireza and Kent, Paul R. C. and Dyatkin, Boris and Rother, Gernot and Heller, William T. and Adri C. T. van Duin and Gogotsi, Yury and Mamontov, Eugene and Xie, Yu},
abstractNote = {MXenes are a recently discovered class of 2D materials with an excellent potential for energy storage applications. Because MXene surfaces are hydrophilic and attractive interaction forces between the layers are relatively weak, water molecules can spontaneously intercalate at ambient humidity and significantly influence the key properties of this 2D material. Using complementary X-ray and neutron scattering techniques, we demonstrate that intercalation with potassium cations significantly improves structural homogeneity and water stability in MXenes. Furthermore, in agreement with molecular dynamics simulations, intercalated potassium ions reduce the water self-diffusion coefficient by 2 orders of magnitude, suggesting greater stability of hydrated MXene against changing environmental conditions.},
doi = {10.1021/acsami.6b01490},
journal = {ACS Applied Materials and Interfaces},
number = 14,
volume = 8,
place = {United States},
year = {2016},
month = {3}
}
- Free Publicly Accessible Full Text
-
Accepted Manuscript (DOE)
- Publisher's Version of Record
- https://doi.org/10.1021/acsami.6b01490