Role of Sn atoms on the Crotonaldehyde (2-Butenal) adsorption over bimetallic catalysts PtSn(110), Pt3Sn(111)/Pt(111), Pt3Sn(111) and PtSn4(010): A periodic DFT study
In this study, adsorption of crotonaldehyde (C4H6O) on catalysts composed by Pt and Sn was examined using periodic density functional theory (DFT) calculations. Therefore, different compositions of catalysts were evaluated such as, PtSn(110), Pt3Sn(111), PtSn4(010) and Pt3Sn(111)/Pt(111) surfaces. T...
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| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2025-05-01
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| Series: | Results in Chemistry |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2211715625002073 |
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