DOI: 10.1039/c4cp02375g. Ab initio Kinetic Monte Carlo simulations of dissolution at the NaCl

Ab initio Kinetic Monte Carlo simulations of dissolution at the NaCl–water interface

10.1039/c4cp02375g

Crossref journal-article

Royal Society of Chemistry (RSC)

Phys. Chem. Chem. Phys. (292)

Abstract

We have used ab initio molecular dynamics (AIMD) and Kinetic Monte Carlo simulations to study the interaction of water with the NaCl surface.

Bibliography

Chen, J.-C., Reischl, B., Spijker, P., Holmberg, N., Laasonen, K., & Foster, A. S. (2014). Ab initio Kinetic Monte Carlo simulations of dissolution at the NaClâwater interface. Phys. Chem. Chem. Phys., 16(41), 22545â22554.

Authors 6

Jian-Cheng Chen (first)
Bernhard Reischl (additional)
Peter Spijker (additional)
Nico Holmberg (additional)
Kari Laasonen (additional)
Adam S. Foster (additional)

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Dates

Type	When
Created	10 years, 11 months ago (Sept. 11, 2014, 8 a.m.)
Deposited	1 year, 4 months ago (April 17, 2024, 12:53 p.m.)
Indexed	3 months ago (May 30, 2025, 3:25 p.m.)
Issued	11 years, 8 months ago (Jan. 1, 2014)
Published	11 years, 8 months ago (Jan. 1, 2014)
Published Online	11 years, 8 months ago (Jan. 1, 2014)

Funders 2

Suomen Akatemia 10.13039/501100002341 Research Council of Finland
Region: Europe
gov (Universities (academic only))
Labels4
1. Suomen Akatemia
2. Finlands Akademi
3. Academy of Finland
4. AKA
Awards1
1. Centres of Excellence Program project no. 915804
European Cooperation in Science and Technology 10.13039/501100000921
Region: Europe
pri (Associations and societies (private and public))
Labels3
1. European Cooperation in Science & Technology
2. COST Association
3. COST
Awards1
1. Action MP1303

BibTeX

@article{Chen_2014, title={Ab initio Kinetic Monte Carlo simulations of dissolution at the NaCl–water interface}, volume={16}, ISSN={1463-9084}, url={http://dx.doi.org/10.1039/c4cp02375g}, DOI={10.1039/c4cp02375g}, number={41}, journal={Phys. Chem. Chem. Phys.}, publisher={Royal Society of Chemistry (RSC)}, author={Chen, Jian-Cheng and Reischl, Bernhard and Spijker, Peter and Holmberg, Nico and Laasonen, Kari and Foster, Adam S.}, year={2014}, pages={22545–22554} }

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