Record link: 
http://hdl.handle.net/20.500.12708/222865
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Title: 
Atomistic Understanding of MXenes as Catalysts and Single-Atom Catalyst Supports for C1 Conversion
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Citation: 
Comas-Vives, A. (2025, September 10). Atomistic Understanding of MXenes as Catalysts and Single-Atom Catalyst Supports for C1 Conversion [Keynote Presentation]. 2025 IEEE 15th International Conference “Nanomaterials: Applications & Properties” (IEEE NAP-2025), Bratislava, Slovakia.
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Publication Type: 
Presentation - Keynote Presentation
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Language: 
English
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Authors: 
Comas-Vives, Aleix 
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Organisational Unit: 
E165-03-1 - Forschungsgruppe Theoretische Materialchemie 
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Date (published): 
10-Sep-2025
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Event name: 
2025 IEEE 15th International Conference "Nanomaterials: Applications & Properties" (IEEE NAP-2025) 
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Event date: 
7-Sep-2025 - 12-Sep-2025
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Event place: 
Bratislava, Slovakia
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Keywords: 
MXenes; Mo2C; Atomistic Simulations; Heterogeneous Catalysis; C1 Conversion
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Project title: 
Dynamische Modellierung v. Sites in der heterogenen Katalyze: PAT3175423 (FWF - Österr. Wissenschaftsfonds) 
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Research Areas: 
Quantum Modeling and Simulation: 40%
Surfaces and Interfaces: 20%
Computational Materials Science: 40%
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Science Branch: 
1040 - Chemie: 75%
1030 - Physik, Astronomie: 25%
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