Predicting Monolayer Oxide Stability over Low-Index Surfaces of TiO2 Polymorphs Using ab Initio Thermodynamics
Monolayer metal oxide coatings on metal oxide supports have the possibility of tuning the surface chemical properties of the coated systems. However, the (meta)stability of these structures makes experimental discovery challenging. A computational approach can help to determine properties that make...
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Bibliographische Detailangaben
| Veröffentlicht in: | Langmuir : the ACS journal of surfaces and colloids. - 1992. - 34(2018), 39 vom: 02. Okt., Seite 11685-11694
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| 1. Verfasser: |
Jonayat, A S M
(VerfasserIn) |
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| Weitere Verfasser: |
Chen, Siqi,
van Duin, Adri C T,
Janik, Michael |
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| Format: | Online-Aufsatz
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| Sprache: | English |
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| Veröffentlicht: |
2018
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| Zugriff auf das übergeordnete Werk: | Langmuir : the ACS journal of surfaces and colloids
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| Schlagworte: | Journal Article
Research Support, U.S. Gov't, Non-P.H.S. |
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