Record link: 
http://hdl.handle.net/20.500.12708/153810
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Title: 
Atomistic Simulations of Thermocatalytic Conversion of CO2
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Citation: 
Comas-Vives, A. (2022, April 20). Atomistic Simulations of Thermocatalytic Conversion of CO2 [Presentation]. First Catchy School in Budapest - Computational methods for cluster-based (CO2 conversion) catalysts, Budapest, Hungary.
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Publication Type: 
Presentation - 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): 
20-Apr-2022
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Event name: 
First Catchy School in Budapest - Computational methods for cluster-based (CO2 conversion) catalysts 
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Event date: 
19-Apr-2022 - 21-Apr-2022
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Event place: 
Budapest, Hungary
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Keywords: 
DFT Calculations; Ab Initio Atomistic Thermodynamics; Microkinetic Modelling; Ab Initio Molecular Dynamics; Heterogeneous Catalysis
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Research Areas: 
Metallic Materials: 25%
Surfaces and Interfaces: 25%
Modeling and Simulation: 50%
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Science Branch: 
1040 - Chemie: 75%
1030 - Physik, Astronomie: 25%
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