Asymmetry and coverage dependence in two-pulse correlation measurements of CO photodesorption from Pd(111): Insights from theory
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arXiv
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| Main Authors: | Bombín, Raúl, Muzas, Alberto S., Jiménez, Alfredo Serrano, Juaristi, J. Iñaki, Alducin, Maite |
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| Format: | Preprint |
| Published: |
2025
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